data_5tm0_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 5tm0 _Structure_validation_residue.Date_analyzed 2017-10-20 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.1 ttm . . . . . 0 N--CA 1.449 -0.521 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.2 -39.98 84.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.973 1.471 . . . . 0.0 114.973 171.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -74.42 -46.52 39.57 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -54.37 -52.94 60.07 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 118.968 0.804 . . . . 0.0 112.173 176.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -60.2 -37.0 78.92 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 173.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 40.5 t60 -62.71 -48.99 76.86 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 115.321 -2.276 . . . . 0.0 113.762 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -66.78 -36.57 82.71 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 121.127 1.785 . . . . 0.0 113.889 175.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -58.69 -33.47 70.19 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 117.47 -3.269 . . . . 0.0 110.963 169.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -77.74 -40.81 39.86 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 117.881 2.549 . . . . 0.0 117.881 175.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.8 mt -63.08 -17.88 62.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 117.825 2.528 . . . . 0.0 117.825 172.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -62.21 -52.28 64.42 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 115.275 -2.298 . . . . 0.0 109.991 167.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -53.47 -46.14 69.84 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 127.346 2.904 . . . . 0.0 108.358 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.8 t -72.46 -19.86 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 O-C-N 117.056 -3.527 . . . . 0.0 116.767 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -83.77 -39.02 20.57 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 117.516 -3.24 . . . . 0.0 112.543 163.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.4 tp -49.11 -52.28 26.88 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 124.466 2.079 . . . . 0.0 112.838 170.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.8 tp -81.24 -16.5 52.49 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 118.14 -2.85 . . . . 0.0 108.792 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -64.27 -49.85 70.25 Favored 'General case' 0 N--CA 1.449 -0.481 1 CA-C-N 126.014 4.006 . . . . 0.0 108.771 168.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 58.0 m-20 -71.34 -15.08 62.38 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 118.47 -2.644 . . . . 0.0 112.832 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.17 -36.8 61.45 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 115.265 -2.303 . . . . 0.0 115.457 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -63.0 -37.22 86.3 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.217 2.207 . . . . 0.0 116.003 170.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -67.16 -9.54 41.02 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 113.071 -1.877 . . . . 0.0 114.151 171.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -120.71 4.59 10.57 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.723 -2.486 . . . . 0.0 112.6 173.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.322 13.2 m-20 56.93 29.39 16.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 116.385 1.995 . . . . 0.0 116.385 -170.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.7 mt -102.71 0.61 33.26 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 117.802 -3.061 . . . . 0.0 115.3 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 36.5 p-80 -57.24 -45.75 83.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.927 2.091 . . . . 0.0 110.983 173.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.354 77.2 mt -55.44 -51.44 79.95 Favored Pre-proline 0 N--CA 1.445 -0.69 2 O-C-N 115.938 -4.226 . . . . 0.0 113.368 178.064 . . . . . . . . 3 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -77.73 -37.77 0.83 Allowed 'Trans proline' 0 N--CA 1.449 -1.126 0 CA-C-O 115.634 -1.903 . . . . 0.0 108.95 -176.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.6 tp -58.6 -40.79 84.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 120.035 1.289 . . . . 0.0 113.562 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.62 -36.98 73.76 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 116.031 -1.938 . . . . 0.0 113.376 174.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -62.16 -23.15 66.42 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 119.469 3.137 . . . . 0.0 119.469 166.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.0 tp -74.25 -48.3 29.56 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 125.872 1.982 . . . . 0.0 115.7 166.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 79.0 mmm -77.29 -8.78 58.19 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.384 -1.293 . . . . 0.0 113.692 -167.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 53.2 mt -144.51 128.84 17.86 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 125.245 1.591 . . . . 0.0 113.741 -166.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 62.3 p -71.78 152.38 93.31 Favored Pre-proline 0 N--CA 1.446 -0.644 0 CA-C-O 122.281 1.038 . . . . 0.0 109.528 176.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -62.38 -13.07 30.55 Favored 'Trans proline' 0 N--CA 1.446 -1.297 0 C-N-CA 122.607 2.205 . . . . 0.0 114.398 -174.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.97 -27.17 18.86 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 119.406 -2.059 . . . . 0.0 112.205 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.81 -46.39 78.81 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 158.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 60.8 mtm-85 -63.2 -40.82 98.59 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 117.971 -1.492 . . . . 0.0 111.286 -178.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -62.03 -36.69 82.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 166.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.24 -25.78 66.26 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 117.322 -3.361 . . . . 0.0 113.798 173.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.1 mt -76.81 -40.9 46.42 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 124.956 2.313 . . . . 0.0 115.348 -177.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -47.23 -56.42 7.99 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 110.85 -2.886 . . . . 0.0 117.065 161.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.1 m -71.86 -35.2 69.74 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 112.542 -1.829 . . . . 0.0 114.311 175.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 60.4 mtt180 -61.75 -34.96 76.78 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 121.229 1.831 . . . . 0.0 111.275 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.4 t -59.29 -42.13 86.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 O-C-N 117.126 -3.484 . . . . 0.0 109.241 171.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -72.73 -26.32 61.53 Favored 'General case' 0 N--CA 1.449 -0.492 1 O-C-N 115.461 -4.525 . . . . 0.0 112.033 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 52.7 mt -67.6 -47.04 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 117.126 -1.416 . . . . 0.0 107.696 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.4 t -62.99 -38.57 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-O 116.412 -1.756 . . . . 0.0 112.069 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -61.84 -49.62 75.54 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 125.127 3.603 . . . . 0.0 112.704 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -76.08 -18.07 59.35 Favored 'General case' 0 N--CA 1.448 -0.546 1 CA-C-O 111.047 -4.311 . . . . 0.0 114.18 -173.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.9 mt -77.55 -33.02 54.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 124.944 3.52 . . . . 0.0 111.795 160.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.2 mt -78.1 -26.42 48.03 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 119.566 -0.854 . . . . 0.0 112.189 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -85.42 -30.99 23.13 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 123.682 1.706 . . . . 0.0 114.855 172.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.25 25.32 61.77 Favored Glycine 0 C--N 1.339 0.718 0 O-C-N 117.203 -3.436 . . . . 0.0 115.749 161.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -110.88 -36.46 5.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 120.544 2.172 . . . . 0.0 110.047 -170.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 55.6 mtp -64.08 139.76 58.8 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 174.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 54.0 p -83.83 173.36 11.33 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 111.793 -2.458 . . . . 0.0 111.442 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -70.72 -28.61 64.86 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 177.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.45 ' NH2' HD22 ' A' ' 73' ' ' ASN . 34.7 ttt85 -80.74 -34.79 34.09 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 114.083 -2.865 . . . . 0.0 107.656 175.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -65.37 -42.93 92.2 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 120.71 1.595 . . . . 0.0 108.761 175.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 40.4 mt -68.13 -20.26 64.89 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 123.083 2.674 . . . . 0.0 110.02 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -87.33 -38.82 15.89 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 120.787 1.63 . . . . 0.0 108.659 -177.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.45 HD22 ' NH2' ' A' ' 69' ' ' ARG . 7.5 m120 -77.11 -30.9 55.47 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 117.002 2.223 . . . . 0.0 117.002 174.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -101.59 -37.9 8.18 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 121.265 1.848 . . . . 0.0 112.215 -170.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.8 mt -106.75 -8.55 16.77 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 130.348 3.459 . . . . 0.0 115.22 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 88.28 -15.43 56.33 Favored Glycine 0 CA--C 1.526 0.742 0 O-C-N 120.033 -1.667 . . . . 0.0 114.717 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.48 119.6 16.92 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 126.833 2.053 . . . . 0.0 115.5 -159.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.59 179.15 26.67 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 119.377 2.511 . . . . 0.0 119.377 172.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 76.1 mt -53.15 -47.86 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 117.838 -1.077 . . . . 0.0 108.141 163.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.36 -49.48 72.15 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -176.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.1 m -65.5 -48.84 71.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.814 0.816 . . . . 0.0 110.958 -167.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.6 mm -65.51 -26.8 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 124.663 2.173 . . . . 0.0 114.917 175.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 55.9 m -71.62 -40.3 69.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 119.433 -2.042 . . . . 0.0 111.075 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 60.9 ttt180 -79.17 -31.45 43.9 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 127.799 2.439 . . . . 0.0 106.15 -176.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -58.37 -55.06 32.79 Favored Glycine 0 CA--C 1.521 0.436 0 O-C-N 120.013 -1.679 . . . . 0.0 112.307 165.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.6 m -69.2 -19.61 63.98 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -81.82 -38.92 24.77 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 116.316 -3.99 . . . . 0.0 107.239 174.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.3 m -66.02 -28.61 68.99 Favored 'General case' 0 N--CA 1.451 -0.415 1 O-C-N 116.192 -4.067 . . . . 0.0 116.589 171.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.85 -42.03 22.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 117.55 -3.219 . . . . 0.0 107.997 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -62.85 -27.08 69.09 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 125.328 1.643 . . . . 0.0 114.274 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.56 -17.25 20.59 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 126.043 1.737 . . . . 0.0 112.792 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.57 153.08 11.07 Favored Pre-proline 0 N--CA 1.45 -0.443 0 O-C-N 119.032 -2.293 . . . . 0.0 113.959 165.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -76.42 155.94 36.63 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 N-CA-C 109.279 -1.085 . . . . 0.0 109.279 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.5 m -66.57 -37.32 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-O 126.397 2.999 . . . . 0.0 113.578 -175.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.4 pm0 -62.46 -19.18 63.27 Favored 'General case' 0 N--CA 1.447 -0.598 1 O-C-N 114.939 -4.851 . . . . 0.0 116.947 170.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 50.8 tp -83.08 -38.67 22.18 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 124.378 1.049 . . . . 0.0 111.805 169.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -73.56 -34.29 65.09 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 117.932 -1.507 . . . . 0.0 109.525 -175.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -68.43 -33.43 74.19 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.418 ' CE2' HG22 ' A' ' 103' ' ' VAL . 84.0 t90 -81.7 -26.83 34.31 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.871 2.068 . . . . 0.0 112.711 -176.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 75.6 mt -69.92 -44.97 68.56 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 116.609 -3.807 . . . . 0.0 115.75 164.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -64.34 -2.85 2.42 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 163.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -91.08 -62.94 1.34 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 119.584 -0.847 . . . . 0.0 109.42 154.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.418 HG22 ' CE2' ' A' ' 99' ' ' TRP . 77.9 t -66.98 -35.81 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-O 118.096 -0.954 . . . . 0.0 109.032 -154.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 33.1 mt -96.01 -7.02 37.5 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 117.698 -3.127 . . . . 0.0 110.794 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 50.4 mt -124.32 7.61 8.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 123.452 2.842 . . . . 0.0 111.857 -172.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.286 60.1 tttt . . . . . 0 N--CA 1.444 -0.735 0 O-C-N 117.133 -3.479 . . . . 0.0 114.635 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.448 0 N-CA-C 118.493 2.775 . . . . 0.0 118.493 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 26.2 ttm -76.68 -29.63 56.4 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 113.808 -2.996 . . . . 0.0 109.948 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . 0.295 . . -62.22 -44.15 97.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 123.364 2.802 . . . . 0.0 110.588 170.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -61.6 -56.43 19.99 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 115.976 -1.964 . . . . 0.0 112.45 170.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -45.6 -43.1 11.96 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 171.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . 0.26 39.4 mmt180 -70.13 -42.05 73.11 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 119.246 -2.159 . . . . 0.0 115.706 171.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -57.59 -41.88 82.07 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 117.326 -3.359 . . . . 0.0 112.588 171.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -75.51 -25.21 57.06 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 113.519 -3.134 . . . . 0.0 115.093 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -59.15 -45.58 90.6 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 122.682 2.492 . . . . 0.0 115.574 158.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 53.2 t-105 -64.04 -52.6 58.66 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.586 2.354 . . . . 0.0 116.811 175.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 89.1 mt -56.16 -31.67 63.6 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 117.295 -3.378 . . . . 0.0 111.625 169.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -69.84 -32.08 70.3 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 122.324 2.329 . . . . 0.0 106.748 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -65.24 -48.46 73.21 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 117.317 -1.325 . . . . 0.0 112.669 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 95.9 t -60.2 -49.84 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 CA-C-O 112.362 -3.685 . . . . 0.0 112.259 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -50.58 -45.92 57.54 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 124.892 3.496 . . . . 0.0 114.845 167.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 24.5 tp -56.92 -45.97 82.32 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 27.2 tp -73.44 -26.63 61.02 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 47.2 tttt -73.0 -43.26 62.36 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 116.763 -1.589 . . . . 0.0 110.125 176.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -62.42 -44.01 97.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 164.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.8 70.21 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 119.55 -1.969 . . . . 0.0 112.64 -175.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -68.38 -30.56 69.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.456 -2.652 . . . . 0.0 111.132 171.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -80.92 -4.34 54.6 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.118 -0.989 . . . . 0.0 113.291 174.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . 0.265 1.1 m-80 -124.67 13.27 8.65 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 116.304 -1.808 . . . . 0.0 113.237 170.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 53.76 23.43 3.73 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 117.064 2.246 . . . . 0.0 117.064 -175.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.1 mt -98.72 15.48 25.16 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 126.512 2.382 . . . . 0.0 112.313 172.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -74.4 -41.65 60.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 123.189 2.722 . . . . 0.0 113.534 -168.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 20.5 mt -69.99 -44.98 22.59 Favored Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-O 117.344 -1.312 . . . . 0.0 113.001 176.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.48 -46.21 30.56 Favored 'Trans proline' 0 N--CA 1.452 -0.968 0 CA-C-N 124.257 2.556 . . . . 0.0 113.475 170.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 61.2 tp -56.87 -52.23 65.93 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 127.187 2.195 . . . . 0.0 113.268 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 29.9 mt -60.48 -35.34 75.68 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 116.013 -1.946 . . . . 0.0 115.625 178.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -70.78 -32.3 69.37 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 128.336 2.655 . . . . 0.0 113.39 171.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 57.8 tp -67.55 -36.18 80.47 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 121.903 -0.498 . . . . 0.0 112.107 165.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 96.7 mmm -90.64 -24.77 20.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 121.553 3.909 . . . . 0.0 121.553 -178.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 10.1 mt -125.69 131.63 52.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 114.3 -2.762 . . . . 0.0 109.28 -176.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.252 73.0 p -71.55 153.69 93.54 Favored Pre-proline 0 N--CA 1.447 -0.583 0 O-C-N 128.545 3.653 . . . . 0.0 118.979 175.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_exo -44.87 -45.25 14.0 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.53 2.82 . . . . 0.0 108.568 -175.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -41.45 80.81 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.011 2.069 . . . . 0.0 114.376 -177.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.12 -39.46 90.09 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.084 2.153 . . . . 0.0 110.975 171.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 48.4 mtm-85 -71.38 -41.82 69.2 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.86 1.664 . . . . 0.0 110.891 -177.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.271 37.1 tt0 -68.88 -31.49 70.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 174.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.47 -35.91 73.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.812 -1.089 . . . . 0.0 111.527 172.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -75.06 -33.1 61.67 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 116.505 -3.872 . . . . 0.0 112.899 176.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.75 -29.8 75.26 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 117.453 -2.308 . . . . 0.0 116.32 172.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 99.3 m -80.56 -33.27 36.29 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 126.83 2.135 . . . . 0.0 109.278 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -59.65 -30.7 68.92 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 118.366 2.728 . . . . 0.0 118.366 173.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 9.4 t -65.75 -45.63 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 174.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -70.29 -31.61 69.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.108 -1.425 . . . . 0.0 112.988 177.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 68.5 mt -68.03 -39.67 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 123.311 2.778 . . . . 0.0 109.537 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.388 78.5 t -78.38 -41.07 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 128.057 2.543 . . . . 0.0 112.982 -175.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -48.57 -46.88 39.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 123.384 1.564 . . . . 0.0 109.898 167.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -76.73 -35.73 57.6 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 119.435 -2.041 . . . . 0.0 109.705 -171.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 39.5 mt -67.39 -17.38 64.71 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.801 -1.571 . . . . 0.0 111.945 174.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 70.4 mt -94.19 -29.76 14.95 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 114.429 -2.701 . . . . 0.0 114.428 168.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 26.2 ttm105 -72.23 -37.2 69.24 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 130.286 3.434 . . . . 0.0 109.745 173.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.98 18.59 64.73 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 128.52 2.962 . . . . 0.0 117.919 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -115.71 54.18 0.82 Allowed 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 129.93 3.959 . . . . 0.0 115.351 -171.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 6.8 mtt -144.71 146.62 32.3 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 129.52 3.128 . . . . 0.0 111.956 164.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 91.4 p -81.16 175.57 10.53 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 161.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -64.85 -38.58 91.46 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 119.487 -2.008 . . . . 0.0 112.055 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 20.0 ttt85 -56.01 -54.3 46.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 122.373 1.082 . . . . 0.0 113.235 174.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -58.16 -48.86 78.97 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.486 1.915 . . . . 0.0 112.937 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.41 -34.83 77.52 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 118.338 -2.726 . . . . 0.0 116.995 166.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 tptt -66.63 -36.02 81.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 121.627 2.012 . . . . 0.0 110.507 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -102.35 -45.15 5.18 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 120.876 -1.14 . . . . 0.0 108.997 -162.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -87.36 -34.72 18.71 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -171.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 63.7 mt -109.97 -10.93 14.7 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 117.23 2.308 . . . . 0.0 117.23 173.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.04 21.79 70.08 Favored Glycine 0 CA--C 1.526 0.73 0 C-N-CA 126.837 2.161 . . . . 0.0 111.614 177.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -103.74 96.17 6.52 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 122.423 3.111 . . . . 0.0 111.006 -177.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.37 178.61 41.28 Favored Glycine 0 C--N 1.335 0.489 0 O-C-N 126.127 2.142 . . . . 0.0 110.212 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 19.8 mt -42.12 -54.87 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 114.331 -0.935 . . . . 0.0 111.639 174.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.41 -56.0 11.15 Favored 'General case' 0 N--CA 1.451 -0.378 1 N-CA-C 121.856 4.021 . . . . 0.0 121.856 177.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 17.3 m -58.71 -47.17 85.47 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 173.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 40.7 mm -52.81 -45.61 50.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 124.581 1.152 . . . . 0.0 113.279 166.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 3.5 m -61.94 -36.92 82.83 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 123.962 1.839 . . . . 0.0 112.404 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -84.3 -27.96 27.45 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 117.578 -3.201 . . . . 0.0 109.456 -174.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.17 -38.89 28.53 Favored Glycine 0 C--N 1.334 0.434 0 O-C-N 118.435 -2.666 . . . . 0.0 111.694 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 18.8 m -65.03 -49.41 70.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 129.311 3.044 . . . . 0.0 107.658 175.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -52.55 -50.02 63.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 127.558 2.343 . . . . 0.0 111.313 170.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 13.5 m -66.06 -33.45 75.83 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.961 -1.712 . . . . 0.0 114.246 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 13.4 mt -61.45 -42.56 98.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 123.798 0.839 . . . . 0.0 112.861 167.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 39.3 mttm -65.73 -38.31 88.79 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 125.509 1.755 . . . . 0.0 113.551 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.06 -25.41 62.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.954 1.701 . . . . 0.0 111.875 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.38 165.74 6.46 Favored Pre-proline 0 N--CA 1.45 -0.464 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -69.11 162.1 43.12 Favored 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.788 2.326 . . . . 0.0 112.645 168.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 m -74.67 -30.56 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 O-C-N 119.109 -2.245 . . . . 0.0 111.156 171.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -70.85 -20.02 62.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.481 2.312 . . . . 0.0 111.254 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 13.3 tp -75.88 -56.46 4.65 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 114.538 -2.649 . . . . 0.0 110.1 167.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 92.9 mtm-85 -56.51 -46.67 80.41 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 121.22 1.827 . . . . 0.0 109.893 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -59.25 -30.35 68.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.729 -176.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 80.5 t90 -96.89 -33.09 11.74 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.066 -2.271 . . . . 0.0 112.488 -173.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.55 -33.38 73.75 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 118.664 -1.214 . . . . 0.0 111.798 166.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.7 -32.49 74.08 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 117.284 2.327 . . . . 0.0 117.284 171.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -75.32 -16.59 60.4 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 112.732 -2.031 . . . . 0.0 115.319 169.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 48.7 t -103.26 -41.14 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 O-C-N 117.069 -3.519 . . . . 0.0 115.416 171.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 88.6 mt -85.07 -35.47 21.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 121.903 2.138 . . . . 0.0 115.266 -168.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 33.2 mt -101.62 -10.34 20.14 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 118.828 -2.42 . . . . 0.0 109.543 -171.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -77.88 -7.69 57.06 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.339 1.855 . . . . 0.0 112.308 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . 0.25 14.4 m -89.36 -17.68 28.38 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.67 2.388 . . . . 0.0 116.549 178.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.27 70.4 m-20 . . . . . 0 C--O 1.248 0.986 0 C-N-CA 129.183 2.993 . . . . 0.0 109.129 171.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 62.4 ttp . . . . . 0 N--CA 1.474 0.751 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.92 168.96 11.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 120.491 1.496 . . . . 0.0 107.051 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -133.4 149.53 51.82 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.499 -2.626 . . . . 0.0 109.789 176.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -157.22 138.71 13.9 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 105.834 -1.913 . . . . 0.0 105.834 -177.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 32.6 p -139.91 171.4 7.94 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 130.62 3.568 . . . . 0.0 111.808 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -50.05 -33.42 34.72 Favored 'Trans proline' 0 N--CA 1.446 -1.278 0 N-CA-C 119.477 2.837 . . . . 0.0 119.477 174.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -151.02 148.06 27.89 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 115.851 -2.023 . . . . 0.0 107.109 -161.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 26.0 t -150.55 131.37 14.13 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.06 -23.66 60.59 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 114.653 -2.594 . . . . 0.0 113.269 167.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.85 -35.04 78.64 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 113.026 -3.369 . . . . 0.0 114.426 169.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 53.9 mtt -68.98 -43.23 75.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 127.178 2.799 . . . . 0.0 108.635 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . 0.254 . . -57.2 -37.62 72.48 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 174.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -64.96 -28.31 69.43 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 117.438 -3.289 . . . . 0.0 116.61 170.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -72.84 -44.94 60.81 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 120.373 -1.454 . . . . 0.0 113.401 170.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -36.15 71.76 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 126.144 1.778 . . . . 0.0 111.994 167.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -61.92 -44.89 95.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 120.251 -1.53 . . . . 0.0 111.234 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -75.52 -22.05 57.45 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 177.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -62.39 -45.22 94.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.838 1.255 . . . . 0.0 111.931 167.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 23.6 t-105 -59.5 -52.71 64.41 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 123.459 1.6 . . . . 0.0 114.423 169.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 15.3 mt -69.14 -24.63 64.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.148 -1.387 . . . . 0.0 112.858 -171.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -78.1 -32.35 50.55 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 117.17 -1.395 . . . . 0.0 113.555 165.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -58.9 -58.77 7.16 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 117.75 -1.58 . . . . 0.0 113.576 168.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.56 -46.42 95.03 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-O 122.452 1.12 . . . . 0.0 110.451 -171.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -58.74 -42.71 89.45 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 -177.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 60.9 tp -67.67 -46.51 72.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 131.389 3.876 . . . . 0.0 107.064 172.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.75 -31.46 72.46 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 128.015 3.322 . . . . 0.0 114.819 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . 0.32 27.3 ttpp -65.21 -41.33 94.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 117.621 2.452 . . . . 0.0 117.621 162.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -58.49 -27.57 64.57 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 124.327 3.239 . . . . 0.0 114.557 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.76 -38.01 86.41 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.757 1.623 . . . . 0.0 113.765 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -60.94 -16.75 46.07 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -82.71 -21.33 34.85 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 34.1 p-10 -126.62 8.03 6.95 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.374 2.0 m-20 73.59 23.18 2.47 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 119.862 -1.774 . . . . 0.0 114.006 175.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.61 5.57 31.18 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 122.026 2.194 . . . . 0.0 114.626 171.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -67.85 -43.48 79.37 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.203 -2.811 . . . . 0.0 116.557 -166.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.295 82.5 mt -72.1 -43.35 10.28 Favored Pre-proline 0 N--CA 1.45 -0.435 0 O-C-N 125.245 1.591 . . . . 0.0 114.139 170.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.61 -32.03 95.86 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 CA-C-O 124.57 1.821 . . . . 0.0 113.627 172.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 19.2 tp -72.39 -33.93 67.55 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.358 -2.714 . . . . 0.0 115.837 172.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 40.4 mt -77.33 -28.27 53.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.93 0.892 . . . . 0.0 109.757 173.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -73.46 -31.17 63.63 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 131.015 3.726 . . . . 0.0 109.883 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -72.29 -51.05 22.58 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 128.206 2.603 . . . . 0.0 115.766 168.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 91.7 mmm -85.4 -29.11 24.67 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.147 -1.406 . . . . 0.0 110.632 -164.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 9.1 mp -115.61 153.26 31.57 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 119.308 0.958 . . . . 0.0 110.153 -175.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 11.9 p -75.59 159.04 82.47 Favored Pre-proline 0 N--CA 1.449 -0.477 0 C-N-CA 127.03 2.132 . . . . 0.0 112.514 163.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.61 -24.77 46.79 Favored 'Trans proline' 0 N--CA 1.451 -1.024 1 C-N-CA 126.404 4.736 . . . . 0.0 116.446 173.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.76 -26.85 25.59 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.029 1.332 . . . . 0.0 109.412 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -77.37 -35.24 54.66 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 118.668 0.667 . . . . 0.0 112.558 172.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 86.6 mtm-85 -55.43 -52.17 64.49 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 124.955 1.302 . . . . 0.0 111.615 166.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -69.27 -39.51 78.34 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 115.603 -2.141 . . . . 0.0 110.846 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.39 -46.37 88.88 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.629 2.013 . . . . 0.0 111.454 169.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . 0.265 28.8 mt -63.89 -27.48 69.18 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 120.273 1.397 . . . . 0.0 113.658 -174.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.85 -25.1 42.67 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 117.62 1.808 . . . . 0.0 117.62 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 24.3 m -74.2 -37.56 63.87 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 116.015 -1.945 . . . . 0.0 112.07 166.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -56.78 -38.58 72.71 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 128.973 2.909 . . . . 0.0 114.877 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 69.1 t -59.31 -43.99 91.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 115.806 -2.045 . . . . 0.0 108.997 170.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 48.9 mtp180 -68.11 -34.13 75.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 122.006 2.185 . . . . 0.0 110.487 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 50.0 mt -72.51 -36.85 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 120.009 -1.682 . . . . 0.0 111.735 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 78.4 t -56.83 -47.59 82.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 N-CA-C 118.086 2.625 . . . . 0.0 118.086 160.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -53.91 -48.24 70.35 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 129.113 2.965 . . . . 0.0 115.92 175.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -69.06 -19.37 64.08 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.124 -1.417 . . . . 0.0 111.825 -177.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 95.8 mt -89.0 -30.07 19.01 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.161 -1.876 . . . . 0.0 114.666 177.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 37.8 mt -64.44 -43.86 92.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 119.357 0.981 . . . . 0.0 111.703 165.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -62.74 -51.04 68.71 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 127.405 2.282 . . . . 0.0 113.464 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.36 -5.05 79.27 Favored Glycine 0 C--N 1.338 0.644 0 CA-C-O 115.355 -2.914 . . . . 0.0 112.383 158.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -69.65 -15.16 63.13 Favored 'General case' 0 N--CA 1.447 -0.599 1 N-CA-C 121.879 4.029 . . . . 0.0 121.879 -174.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . 0.263 39.2 mtt -59.44 127.1 30.37 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 129.902 3.281 . . . . 0.0 110.199 173.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 96.4 p -81.47 168.29 18.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 125.517 1.761 . . . . 0.0 109.71 175.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -56.83 -26.28 57.89 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 117.061 -1.447 . . . . 0.0 114.248 174.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 mtp-105 -69.44 -26.21 64.49 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 126.448 1.899 . . . . 0.0 112.553 167.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -99.78 -34.31 10.21 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 128.126 2.57 . . . . 0.0 116.653 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . 0.25 24.7 mt -62.5 -22.51 66.32 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.88 -1.763 . . . . 0.0 109.251 168.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -91.11 -53.74 4.24 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 125.467 1.729 . . . . 0.0 113.689 168.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -104.87 -1.02 26.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 119.39 3.108 . . . . 0.0 119.39 -166.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 23.9 tp10 -122.74 -31.94 3.62 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 128.698 2.799 . . . . 0.0 116.502 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 tp -88.93 -31.39 18.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 121.464 -0.772 . . . . 0.0 112.583 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 93.05 -179.37 39.49 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-O 117.828 -1.54 . . . . 0.0 116.235 172.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.75 -21.13 54.69 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 125.168 2.413 . . . . 0.0 112.308 169.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.67 -15.47 18.76 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-O 124.894 2.386 . . . . 0.0 116.547 171.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 6.0 tt -70.16 -34.38 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 120.276 -1.72 . . . . 0.0 112.451 176.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.89 -27.29 68.04 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 171.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 25.2 m -72.63 -27.75 62.33 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 122.22 2.282 . . . . 0.0 110.414 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.317 39.2 mm -97.56 -22.8 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 126.876 2.07 . . . . 0.0 116.173 -173.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 39.4 p -118.39 -3.14 10.98 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 120.833 3.642 . . . . 0.0 120.833 -176.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -126.18 153.06 45.16 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 117.865 -3.022 . . . . 0.0 111.962 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 94.13 167.64 37.33 Favored Glycine 0 C--N 1.335 0.505 0 N-CA-C 117.484 1.754 . . . . 0.0 117.484 -172.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 93.9 p -80.61 2.92 23.7 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 117.854 2.539 . . . . 0.0 117.854 -174.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -117.72 -9.65 10.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.962 -1.971 . . . . 0.0 112.607 171.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 57.5 p -47.77 168.28 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 -173.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 tp -53.78 -38.96 65.01 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 120.714 3.598 . . . . 0.0 120.714 -163.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.256 57.1 mttt -88.51 -12.56 42.56 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 124.808 1.318 . . . . 0.0 114.406 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.13 -10.63 41.2 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 129.789 3.235 . . . . 0.0 112.242 169.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.05 150.59 69.56 Favored Pre-proline 0 N--CA 1.446 -0.648 0 CA-C-O 115.142 -2.361 . . . . 0.0 112.997 172.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -39.06 141.21 0.39 Allowed 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 123.794 2.996 . . . . 0.0 118.45 166.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 2.1 t -59.78 -45.28 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 CA-C-O 113.536 -3.126 . . . . 0.0 110.441 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.6 pm0 -61.12 -16.87 49.01 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 121.145 1.793 . . . . 0.0 115.414 -176.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 14.8 tp -82.64 -41.54 19.32 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 117.017 2.229 . . . . 0.0 117.017 164.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -60.82 -37.17 81.08 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 116.519 -3.863 . . . . 0.0 110.038 176.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -71.23 -35.02 71.32 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.971 1.708 . . . . 0.0 111.68 175.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -75.11 -40.27 59.99 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 31.1 mt -61.35 -36.71 80.95 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.972 1.709 . . . . 0.0 109.744 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.99 -27.92 67.84 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 170.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -79.36 -17.64 54.07 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 122.504 2.411 . . . . 0.0 111.137 174.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 92.8 t -108.93 -28.77 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 O-C-N 117.901 -2.999 . . . . 0.0 114.28 -176.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 65.9 mt -95.79 -45.9 6.8 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.079 0.942 . . . . 0.0 109.696 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 33.1 mt -92.98 16.85 11.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 120.992 -1.068 . . . . 0.0 113.271 -171.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 51.6 pttt . . . . . 0 N--CA 1.447 -0.601 0 O-C-N 118.506 -2.621 . . . . 0.0 116.813 157.169 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 21.0 p . . . . . 0 N--CA 1.447 -0.583 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 99.5 Cg_exo -53.25 -49.91 15.82 Favored 'Trans proline' 0 N--CA 1.449 -1.142 1 C-N-CA 125.651 4.234 . . . . 0.0 115.522 177.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -151.35 126.05 9.61 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.341 1.856 . . . . 0.0 114.547 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 14.5 t -47.12 113.66 0.71 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 166.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.16 -44.83 32.71 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 113.244 -1.798 . . . . 0.0 109.686 171.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.88 -26.47 62.36 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.612 2.078 . . . . 0.0 116.612 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 11' ' ' MET . . . . . 0.419 ' O ' ' HD2' ' D' ' 15' ' ' ARG . 17.8 mmt -71.32 -31.22 67.16 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 126.058 2.098 . . . . 0.0 111.244 168.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.42 -21.99 52.23 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 118.374 -2.704 . . . . 0.0 111.064 176.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -79.22 -34.87 42.43 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.817 1.189 . . . . 0.0 109.705 166.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -62.39 -43.3 99.13 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 123.666 1.698 . . . . 0.0 111.325 -177.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . 0.419 ' HD2' ' O ' ' D' ' 11' ' ' MET . 0.0 OUTLIER -64.57 -33.14 75.21 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 118.99 2.959 . . . . 0.0 118.99 169.719 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -72.51 -12.88 61.26 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 119.089 -2.257 . . . . 0.0 113.228 166.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -94.09 -32.54 13.73 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 118.894 2.924 . . . . 0.0 118.894 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -67.62 -26.55 66.3 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 111.248 -2.705 . . . . 0.0 109.019 169.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 8.2 t-105 -74.04 -53.44 10.0 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 123.727 1.727 . . . . 0.0 110.97 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.92 -15.64 44.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 117.926 -2.983 . . . . 0.0 112.764 173.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -75.46 -23.83 56.93 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 120.256 1.389 . . . . 0.0 113.99 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -78.51 -35.05 46.87 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.748 2.019 . . . . 0.0 109.328 174.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 91.9 t -62.2 -47.23 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 O-C-N 124.209 0.943 . . . . 0.0 109.174 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -70.87 -40.11 72.49 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.574 1.15 . . . . 0.0 112.468 174.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 20.7 tp -50.92 -45.11 60.27 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 121.129 1.786 . . . . 0.0 113.255 168.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 56.6 tp -73.87 -38.06 64.55 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 123.445 1.593 . . . . 0.0 115.187 -176.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . 0.466 ' HA ' ' CD2' ' D' ' 30' ' ' TYR . 27.9 ttpt -61.84 -49.29 76.86 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 120.358 -1.464 . . . . 0.0 108.163 169.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -58.84 -22.08 58.17 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.931 -2.981 . . . . 0.0 117.557 171.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.81 -26.43 25.74 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 120.27 -1.519 . . . . 0.0 112.455 176.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . 0.466 ' CD2' ' HA ' ' D' ' 27' ' ' LYS . 16.7 m-30 -56.69 -45.42 81.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 118.941 -2.35 . . . . 0.0 110.442 166.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -73.16 -25.59 60.86 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.886 2.074 . . . . 0.0 108.069 -163.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.2 p30 -115.22 5.35 14.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.211 1.804 . . . . 0.0 114.963 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 57.61 28.45 15.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 -178.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 15.3 mt -83.59 1.43 42.19 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.234 2.214 . . . . 0.0 112.067 164.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -60.08 3.73 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 118.212 2.671 . . . . 0.0 118.212 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 9.0 mt -57.37 -54.31 56.27 Favored Pre-proline 0 N--CA 1.451 -0.412 0 CA-C-O 114.396 -2.716 . . . . 0.0 109.677 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -43.68 -46.24 10.42 Favored 'Trans proline' 0 N--CA 1.447 -1.238 0 CA-C-N 124.696 2.713 . . . . 0.0 115.393 159.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 22.5 tp -74.44 -39.09 62.8 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 116.379 -3.951 . . . . 0.0 114.744 -176.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 42.4 mt -59.7 -48.44 81.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.18 -2.2 . . . . 0.0 107.185 166.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 33.0 m-20 -63.43 -31.57 72.76 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 121.393 1.906 . . . . 0.0 114.516 -178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 31.4 tp -71.15 -41.78 69.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 116.175 -1.869 . . . . 0.0 106.601 172.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 8.0 mmm -83.47 -23.3 32.26 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -170.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 29.5 mt -127.45 141.74 51.59 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 104.69 -2.337 . . . . 0.0 104.69 -173.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 71.7 p -60.22 158.05 29.88 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-O 114.745 -2.55 . . . . 0.0 116.82 171.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -48.15 -50.52 11.82 Favored 'Trans proline' 0 N--CA 1.447 -1.237 1 C-N-CA 126.684 4.923 . . . . 0.0 114.386 170.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -71.82 -17.83 62.13 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 117.738 2.496 . . . . 0.0 117.738 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -73.15 -42.14 63.16 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.412 163.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -61.18 -41.89 97.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 126.815 2.046 . . . . 0.0 108.02 175.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -66.07 -38.75 89.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.528 1.131 . . . . 0.0 110.927 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.59 -33.94 23.27 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.776 2.031 . . . . 0.0 112.911 -177.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 84.0 mt -58.65 -43.54 89.84 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.065 -2.397 . . . . 0.0 116.183 160.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.7 -34.44 70.41 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-N 121.102 1.774 . . . . 0.0 113.691 170.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 17.8 m -77.07 -38.14 53.12 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 122.335 1.064 . . . . 0.0 112.929 -177.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -61.54 -31.17 71.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 112.444 -3.646 . . . . 0.0 110.852 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.71 -49.94 70.95 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 CA-C-N 123.702 2.956 . . . . 0.0 112.515 170.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.307 9.4 ptm180 -65.64 -22.18 66.63 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 118.267 2.691 . . . . 0.0 118.267 169.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 10.2 mt -70.93 -42.49 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 124.194 3.179 . . . . 0.0 112.484 171.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 3.2 t -61.9 -48.12 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 128.163 3.415 . . . . 0.0 111.724 169.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -63.06 -38.82 92.73 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.313 -2.742 . . . . 0.0 108.976 -174.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -75.14 -26.9 59.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 115.679 -2.105 . . . . 0.0 112.305 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 63.4 mt -68.73 -23.62 64.36 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 116.734 -1.603 . . . . 0.0 110.389 174.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 29.8 mt -84.09 -38.72 20.43 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 170.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -69.64 -29.32 66.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 127.327 2.892 . . . . 0.0 114.455 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.42 36.99 92.5 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-O 115.727 -2.707 . . . . 0.0 113.481 158.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -111.63 -25.17 9.67 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 114.774 -2.536 . . . . 0.0 110.157 173.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . 0.256 33.6 mtm -89.23 30.84 0.93 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 169.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 77.7 p -85.36 172.83 10.77 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 119.47 -2.019 . . . . 0.0 111.022 -163.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.268 5.5 tp60 65.15 -17.64 0.09 Allowed 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 116.598 -3.814 . . . . 0.0 119.305 169.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 35.0 ttt85 -146.96 -59.85 0.28 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 129.995 3.318 . . . . 0.0 116.169 176.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -84.38 -35.86 22.87 Favored 'General case' 0 N--CA 1.446 -0.644 1 O-C-N 115.47 -4.519 . . . . 0.0 114.16 -152.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.72 -41.99 15.96 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 116.369 -3.957 . . . . 0.0 116.05 178.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt -61.14 -38.91 88.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 112.822 -1.99 . . . . 0.0 108.997 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -84.2 -20.56 32.12 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 126.49 2.369 . . . . 0.0 114.233 -176.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -97.3 -38.88 9.49 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 127.963 2.505 . . . . 0.0 110.986 -173.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -120.9 -16.91 8.02 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 85.47 -171.23 45.4 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-O 123.707 1.726 . . . . 0.0 116.746 165.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.254 . . -43.43 -16.69 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.88 -20.47 68.6 Favored Glycine 0 C--N 1.335 0.522 0 CA-C-N 122.585 2.448 . . . . 0.0 112.537 171.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 5.0 tt -46.05 -18.06 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 C-N-CA 126.498 1.919 . . . . 0.0 114.959 168.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -103.99 -21.9 13.54 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 117.866 -1.534 . . . . 0.0 112.65 -178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 17.7 m -66.72 -39.4 87.99 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.375 1.47 . . . . 0.0 109.816 165.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 8.5 mm -87.06 -18.18 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 O-C-N 117.755 -3.09 . . . . 0.0 114.444 -172.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 31.0 p -109.25 -24.89 10.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 120.99 3.7 . . . . 0.0 120.99 168.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.8 mtp85 -83.84 162.42 20.57 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.894 -3.004 . . . . 0.0 110.827 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.31 154.73 30.95 Favored Glycine 0 N--CA 1.446 -0.66 0 O-C-N 127.247 2.842 . . . . 0.0 112.275 -177.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 24.6 m -74.38 -7.2 52.08 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 115.847 -2.025 . . . . 0.0 114.943 -168.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . 0.276 18.2 m-80 -134.36 33.38 3.31 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 123.606 2.912 . . . . 0.0 105.963 -171.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 59.9 p -77.28 -175.5 3.72 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.415 2.746 . . . . 0.0 118.415 175.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 29.7 tp -56.24 -32.12 64.19 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 118.389 -2.695 . . . . 0.0 113.951 165.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -74.46 -16.92 60.84 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.161 0.584 . . . . 0.0 110.569 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -104.49 -15.24 15.42 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 113.634 -3.079 . . . . 0.0 113.372 -166.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . 0.405 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 45.07 87.19 0.12 Allowed Pre-proline 0 N--CA 1.449 -0.513 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 165.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . 0.568 ' C ' ' H ' ' D' ' 95' ' ' GLU . 50.7 Cg_exo 34.19 42.24 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.168 0 C-N-CA 122.447 -1.897 . . . . 0.0 115.861 36.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -72.73 15.19 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 111.062 -2.79 . . . . 0.0 110.743 -170.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . 0.568 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -144.25 -30.0 0.48 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -169.066 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 58.8 tp -50.82 -55.38 17.15 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.663 157.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . 0.31 24.2 ptt180 -59.3 -37.19 77.09 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 112.685 -3.531 . . . . 0.0 112.512 -176.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -71.16 -23.52 62.08 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.455 2.302 . . . . 0.0 110.72 176.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . 0.255 79.3 t90 -87.28 -42.48 12.89 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.709 1.204 . . . . 0.0 111.398 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 51.6 mt -59.76 -55.02 39.49 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 129.454 3.102 . . . . 0.0 106.432 169.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -44.47 -31.36 1.07 Allowed 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 173.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -89.49 -29.34 19.04 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 69.5 t -91.15 -22.83 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 O-C-N 121.316 -0.865 . . . . 0.0 110.729 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 65.9 mt -102.84 -27.67 12.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 119.915 -1.741 . . . . 0.0 112.308 -172.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 28.5 mt -101.78 12.01 37.78 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -62.2 152.16 34.03 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 127.478 2.986 . . . . 0.0 109.77 -171.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 47.8 m -66.38 -27.3 67.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 117.751 2.5 . . . . 0.0 117.751 -168.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . 0.255 0.6 OUTLIER . . . . . 0 C--O 1.25 1.099 0 O-C-N 126.899 2.625 . . . . 0.0 116.256 169.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.4 ttp . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.87 -25.5 60.07 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 124.617 2.151 . . . . 0.0 116.691 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -64.91 -30.41 71.4 Favored 'General case' 0 N--CA 1.445 -0.698 0 O-C-N 120.07 -1.644 . . . . 0.0 113.337 165.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -80.65 -38.69 28.68 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 118.563 -1.255 . . . . 0.0 108.232 -170.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.7 mmt-85 -62.11 -25.03 67.48 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 125.8 1.938 . . . . 0.0 114.839 176.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.0 t60 -61.52 -46.64 89.12 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 117.836 2.532 . . . . 0.0 117.836 171.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -68.93 -26.09 64.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 171.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -72.13 -48.79 41.09 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.496 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG . 20.2 t-105 -60.91 -45.59 94.03 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.31 1.844 . . . . 0.0 112.22 172.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.52 -18.94 62.95 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 177.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -69.45 -29.09 66.7 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 119.003 0.819 . . . . 0.0 110.205 170.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -62.1 -46.28 89.79 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 120.315 -1.491 . . . . 0.0 112.092 165.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.8 t -84.46 -0.21 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 115.6 1.704 . . . . 0.0 115.6 -170.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -96.52 -39.07 9.73 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 113.894 -1.503 . . . . 0.0 109.485 164.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 66.0 tp -60.68 -34.52 74.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 127.121 2.168 . . . . 0.0 108.382 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.6 tp -85.18 -22.87 28.58 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 126.8 2.563 . . . . 0.0 109.741 -169.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -79.62 -31.53 41.68 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 121.399 -0.813 . . . . 0.0 112.013 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . 0.256 25.9 m-20 -82.17 -22.27 36.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 118.683 -2.511 . . . . 0.0 111.153 175.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.76 -43.54 92.94 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 169.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -55.47 -46.51 76.84 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 123.684 1.707 . . . . 0.0 111.391 172.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -66.31 -24.86 66.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.562 1.945 . . . . 0.0 112.806 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -104.96 11.13 33.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 113.855 -2.974 . . . . 0.0 114.209 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.417 1.8 m-20 61.03 22.38 12.64 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 125.64 1.838 . . . . 0.0 112.144 174.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.3 mt -109.88 4.15 21.32 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.365 1.866 . . . . 0.0 112.837 177.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -49.53 -43.55 45.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 -179.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.391 80.1 mt -58.13 -60.49 9.95 Favored Pre-proline 0 N--CA 1.45 -0.46 0 N-CA-C 116.314 1.968 . . . . 0.0 116.314 172.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . 0.269 27.2 Cg_endo -60.21 -39.97 63.75 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 117.225 -1.383 . . . . 0.0 112.704 -176.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 tp -55.29 -40.33 70.92 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.488 -2.633 . . . . 0.0 115.846 172.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 85.5 mt -75.12 -35.13 61.74 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.766 0.826 . . . . 0.0 109.036 178.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -62.74 -40.5 97.42 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 123.521 0.513 . . . . 0.0 111.052 176.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.9 tp -68.25 -30.39 69.41 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 115.674 -2.108 . . . . 0.0 114.088 174.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 85.3 mmm -97.64 -22.15 16.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 123.494 2.861 . . . . 0.0 112.372 -168.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mp -134.13 150.13 51.11 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 126.091 1.757 . . . . 0.0 109.661 -176.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 64.3 p -81.57 163.34 54.69 Favored Pre-proline 0 N--CA 1.451 -0.401 0 C-N-CA 126.704 2.002 . . . . 0.0 111.724 173.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -64.15 -32.45 63.31 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 CA-C-N 119.509 0.86 . . . . 0.0 111.998 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.19 -35.32 77.81 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 115.645 -2.121 . . . . 0.0 110.432 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.21 -24.07 60.47 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 122.955 2.616 . . . . 0.0 114.18 174.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.0 mtm-85 -84.98 -35.31 22.07 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 126.014 2.071 . . . . 0.0 115.204 171.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.3 -39.14 82.08 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.404 1.882 . . . . 0.0 110.316 170.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.47 83.86 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 130.565 3.546 . . . . 0.0 113.486 174.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.2 mt -72.33 -36.47 68.85 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 118.017 -2.927 . . . . 0.0 107.143 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.03 -51.39 54.14 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 174.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.25 8.8 m -62.99 -30.82 71.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 128.889 2.876 . . . . 0.0 113.143 175.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.7 mtt180 -80.88 -32.79 34.75 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 117.715 -1.594 . . . . 0.0 108.373 -168.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 83.8 t -45.43 -46.4 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-O 115.16 -2.353 . . . . 0.0 114.738 154.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -79.51 -27.98 41.41 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.448 2.386 . . . . 0.0 108.657 -169.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.6 mt -63.53 -55.21 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 C-N-CA 125.27 1.428 . . . . 0.0 110.49 166.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.1 t -61.72 -35.16 65.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 117.019 -1.872 . . . . 0.0 113.514 -173.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . 0.256 28.8 tt0 -46.6 -60.09 2.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 118.137 -2.852 . . . . 0.0 113.136 166.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -58.82 -29.33 66.8 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 175.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 42.3 mt -76.09 -28.75 57.68 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 118.701 -1.2 . . . . 0.0 112.427 173.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.3 mt -74.28 -31.32 62.47 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 119.117 -2.239 . . . . 0.0 113.196 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 43.3 ttm105 -71.95 -41.48 67.73 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 129.805 3.242 . . . . 0.0 112.918 173.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.54 35.15 21.56 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 120.065 2.786 . . . . 0.0 120.065 -174.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -98.2 -37.43 9.7 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 119.863 1.831 . . . . 0.0 113.096 168.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 42.5 mtt -75.28 127.19 32.6 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 118.939 -1.105 . . . . 0.0 109.568 -177.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 54.0 p -47.94 165.75 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 127.227 2.211 . . . . 0.0 114.59 151.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -68.58 -33.65 74.43 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 127.407 2.283 . . . . 0.0 109.63 170.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.3 tpt85 -55.3 -54.35 44.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.248 1.019 . . . . 0.0 111.247 168.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -58.49 -48.58 80.34 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 175.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.5 mt -54.53 -29.09 49.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 115.463 1.653 . . . . 0.0 115.463 171.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -77.52 -50.03 13.48 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 118.305 -2.747 . . . . 0.0 109.084 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -64.18 -41.82 96.94 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 119.606 3.187 . . . . 0.0 119.606 172.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -81.06 -42.24 21.34 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 125.539 2.59 . . . . 0.0 114.072 -171.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.8 mt -120.9 -5.41 9.6 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 117.984 -2.948 . . . . 0.0 114.12 -172.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 82.32 -12.18 46.5 Favored Glycine 0 CA--C 1.523 0.577 0 O-C-N 116.664 -3.772 . . . . 0.0 115.686 175.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.55 120.69 17.49 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 125.498 1.352 . . . . 0.0 111.242 -174.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.8 -172.26 41.33 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-N 113.407 -1.724 . . . . 0.0 115.815 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.7 mt -55.37 -46.86 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-O 114.395 -2.717 . . . . 0.0 110.427 165.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.12 86.7 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 122.091 2.223 . . . . 0.0 115.228 -171.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 62.5 p -94.19 -25.57 17.03 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 124.003 1.859 . . . . 0.0 115.957 -174.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 31.1 mm -74.28 -34.2 36.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 O-C-N 118.446 -2.659 . . . . 0.0 107.717 171.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.1 m -62.39 -52.78 62.21 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 121.889 2.132 . . . . 0.0 109.071 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.6 ttt180 -63.17 -57.92 8.94 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 117.706 -1.14 . . . . 0.0 109.688 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.09 -31.42 4.38 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-O 123.19 1.439 . . . . 0.0 116.244 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.2 m -69.33 -50.79 43.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 119.998 -1.883 . . . . 0.0 111.108 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -56.82 -39.6 74.47 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 119.927 -1.733 . . . . 0.0 114.378 175.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.4 m -72.17 -41.32 67.17 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 115.018 -2.42 . . . . 0.0 112.263 176.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.7 tt -67.21 -40.91 86.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 122.844 2.566 . . . . 0.0 114.374 173.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -67.6 -23.3 65.36 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 118.121 2.637 . . . . 0.0 118.121 177.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.47 -13.66 25.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.848 1.659 . . . . 0.0 113.467 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.97 154.25 92.77 Favored Pre-proline 0 N--CA 1.452 -0.348 0 O-C-N 118.941 -2.349 . . . . 0.0 111.223 -177.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -64.99 141.52 70.9 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 125.008 3.805 . . . . 0.0 113.36 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.8 m -54.4 -32.04 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 O-C-N 126.877 2.611 . . . . 0.0 113.687 -177.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.5 pm0 -75.53 -22.91 56.69 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.559 -1.655 . . . . 0.0 113.739 -177.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 20.1 tp -76.76 -42.15 42.05 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 119.033 -2.292 . . . . 0.0 106.475 174.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . 0.331 22.9 mtm180 -67.76 -54.94 15.22 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 123.714 1.721 . . . . 0.0 114.415 -164.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -59.29 -13.96 9.7 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 129.983 3.313 . . . . 0.0 115.026 169.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 37.4 t90 -96.47 -28.49 14.4 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 115.092 -2.385 . . . . 0.0 109.675 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 84.9 mt -77.99 -35.79 49.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 123.834 3.015 . . . . 0.0 113.916 173.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.08 -30.5 71.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 116.551 -2.059 . . . . 0.0 115.305 170.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -65.79 -55.02 19.39 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 118.282 2.697 . . . . 0.0 118.282 162.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 84.9 t -80.83 -26.74 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 O-C-N 120.477 -1.389 . . . . 0.0 110.203 -167.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.9 mt -96.59 -32.53 12.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -175.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 44.2 mt -98.59 -11.27 22.31 Favored 'General case' 0 N--CA 1.446 -0.658 0 O-C-N 117.785 -3.072 . . . . 0.0 114.36 -171.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt . . . . . 0 N--CA 1.449 -0.521 0 O-C-N 124.089 0.868 . . . . 0.0 112.182 -176.017 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.643 0 N-CA-C 110.771 -0.085 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 12.3 ttm -70.86 -32.79 69.92 Favored 'General case' 0 N--CA 1.45 -0.448 1 O-C-N 116.047 -4.158 . . . . 0.0 108.654 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.56 -37.99 80.39 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.738 1.732 . . . . 0.0 111.825 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -61.76 -53.37 56.91 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.247 -2.158 . . . . 0.0 109.45 175.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -55.56 -20.37 13.11 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 117.497 2.406 . . . . 0.0 117.497 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 14.1 mmm180 -84.38 -33.51 23.79 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 170.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -66.35 -34.07 77.15 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 115.439 -2.22 . . . . 0.0 112.764 166.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -79.59 -27.52 41.1 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 115.808 -2.044 . . . . 0.0 109.838 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -65.29 -30.29 71.14 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 120.929 1.695 . . . . 0.0 114.96 164.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 18.6 t-105 -74.84 -45.68 41.6 Favored 'General case' 0 N--CA 1.445 -0.685 1 O-C-N 114.806 -4.934 . . . . 0.0 112.903 173.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 8.9 mt -60.72 -23.36 64.85 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 113.15 -3.309 . . . . 0.0 114.038 166.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 53.6 ttt180 -72.31 -34.37 68.07 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 125.325 3.693 . . . . 0.0 111.55 173.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -55.82 -50.69 69.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 119.649 1.113 . . . . 0.0 112.416 167.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 87.3 t -74.08 -33.58 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 O-C-N 127.159 2.787 . . . . 0.0 108.874 -171.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.82 -45.76 93.18 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 119.878 -1.764 . . . . 0.0 115.384 167.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 23.0 tp -62.75 -46.75 86.59 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.14 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 59.7 tp -69.32 -25.7 64.35 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 118.353 -2.717 . . . . 0.0 117.178 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -59.02 -61.28 2.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 118.265 -2.772 . . . . 0.0 110.011 162.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -60.32 -29.52 68.92 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.179 -3.451 . . . . 0.0 111.82 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.67 -32.28 69.49 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 130.766 3.626 . . . . 0.0 115.034 175.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -66.05 -52.46 48.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.962 1.305 . . . . 0.0 110.653 172.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -50.57 -43.38 56.35 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 115.94 -1.981 . . . . 0.0 115.511 167.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -91.18 3.68 54.2 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 130.27 3.428 . . . . 0.0 108.775 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.365 6.1 m-20 62.57 21.06 12.42 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 118.922 2.934 . . . . 0.0 118.922 -177.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -104.11 12.68 33.67 Favored 'General case' 0 N--CA 1.446 -0.636 1 O-C-N 114.46 -5.15 . . . . 0.0 114.651 -175.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 11.5 p-80 -57.86 -49.13 77.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 128.001 2.52 . . . . 0.0 116.151 -170.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 15.6 mt -66.21 -39.44 28.09 Favored Pre-proline 0 N--CA 1.449 -0.494 0 C-N-CA 126.881 2.072 . . . . 0.0 116.418 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.301 26.5 Cg_exo -59.03 -45.34 28.72 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 N-CA-C 115.193 1.19 . . . . 0.0 115.193 164.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 29.5 tp -56.62 -54.09 50.1 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 119.963 -1.711 . . . . 0.0 112.166 176.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 63.1 mt -54.58 -34.76 62.46 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 119.524 -1.985 . . . . 0.0 113.537 170.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -71.27 -29.44 65.08 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 117.796 -1.097 . . . . 0.0 110.685 173.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . 0.408 16.1 tp -75.04 -43.42 53.59 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 116.238 -1.839 . . . . 0.0 114.544 174.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 19.5 mmt -94.84 -20.92 19.04 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 125.283 1.614 . . . . 0.0 112.272 -168.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -114.28 133.93 55.3 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 121.077 1.762 . . . . 0.0 111.122 173.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 73.2 p -72.98 152.95 90.93 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 122.038 2.199 . . . . 0.0 110.971 170.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 99.4 Cg_exo -28.3 -54.87 0.14 Allowed 'Trans proline' 0 N--CA 1.449 -1.105 1 C-N-CA 126.325 4.683 . . . . 0.0 112.559 166.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -62.3 -43.02 99.79 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 127.627 3.08 . . . . 0.0 115.847 -175.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -64.19 -39.23 93.56 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 119.611 3.189 . . . . 0.0 119.611 166.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . 0.496 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 37.8 mtm-85 -61.42 -40.34 94.05 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 115.006 -2.426 . . . . 0.0 107.209 169.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -66.5 -31.36 72.05 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 124.25 3.205 . . . . 0.0 113.151 175.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.2 -47.55 82.12 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 118.38 -2.7 . . . . 0.0 114.323 168.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.12 -37.57 83.28 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 120.007 3.336 . . . . 0.0 120.007 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.09 -18.76 76.72 Favored Glycine 0 C--N 1.34 0.767 0 C-N-CA 117.705 -2.188 . . . . 0.0 112.009 176.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -85.06 -36.31 21.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 119.243 -2.328 . . . . 0.0 109.82 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 85.9 mtt180 -60.3 -25.9 66.11 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.327 1.451 . . . . 0.0 114.216 171.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . 0.319 16.6 t -59.37 -56.96 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 C-N-CA 126.085 1.754 . . . . 0.0 111.025 164.113 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -72.25 -32.49 66.73 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 120.369 1.44 . . . . 0.0 112.422 -176.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 9.1 mt -59.6 -56.14 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 121.221 1.828 . . . . 0.0 113.214 162.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.261 29.6 t -66.7 -36.24 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 O-C-N 117.818 -3.051 . . . . 0.0 112.759 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -45.19 -59.49 2.61 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 128.972 2.909 . . . . 0.0 112.248 159.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -69.2 -21.07 63.98 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 119.024 -2.297 . . . . 0.0 114.852 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 12.2 mt -67.03 -19.03 65.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 116.705 -3.747 . . . . 0.0 110.468 167.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mt -96.02 -40.56 9.2 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 122.694 2.497 . . . . 0.0 109.874 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 27.6 ttm180 -58.79 -59.24 5.75 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 125.006 1.441 . . . . 0.0 113.25 174.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.49 48.48 23.4 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 115.983 -3.008 . . . . 0.0 115.347 -179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -126.49 -27.71 3.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 126.568 1.981 . . . . 0.0 114.371 -178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 16.9 mtt -62.77 141.52 58.56 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 115.44 1.645 . . . . 0.0 115.44 177.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.7 p -72.65 157.97 36.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 162.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -64.29 -16.12 61.54 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 115.719 -2.086 . . . . 0.0 113.894 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -67.3 -48.48 67.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.708 1.203 . . . . 0.0 113.788 166.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -67.43 -34.06 76.44 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 128.506 2.723 . . . . 0.0 110.314 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . 0.252 79.4 mt -61.07 -55.14 36.07 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 123.501 1.62 . . . . 0.0 112.194 175.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -63.73 -44.79 92.52 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 119.844 -1.785 . . . . 0.0 110.56 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -97.23 -24.65 15.6 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 116.356 -1.783 . . . . 0.0 113.402 -160.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -117.1 -35.39 4.09 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 116.826 -1.95 . . . . 0.0 112.373 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 45.0 mt -92.43 -7.3 47.97 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 129.018 2.927 . . . . 0.0 115.38 177.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 55.31 41.17 78.85 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-O 118.893 -0.948 . . . . 0.0 115.156 -176.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.28 101.37 7.93 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 117.003 -1.475 . . . . 0.0 111.599 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.8 171.28 30.99 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 119.966 2.746 . . . . 0.0 119.966 161.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . 0.251 55.0 mt -40.9 -41.33 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 175.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . 0.334 . . -58.73 -37.87 77.12 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.639 1.175 . . . . 0.0 113.136 176.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.2 m -79.76 -35.01 39.32 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 120.785 -1.197 . . . . 0.0 113.161 178.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 16.3 mm -70.76 -39.66 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-O 118.011 -0.995 . . . . 0.0 109.943 174.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 93.1 m -59.68 -59.18 5.85 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.715 2.406 . . . . 0.0 112.41 171.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -70.91 -33.53 70.63 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -173.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.25 -34.52 85.92 Favored Glycine 0 CA--C 1.524 0.649 0 O-C-N 116.68 -3.762 . . . . 0.0 115.116 169.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 75.1 m -76.16 -34.39 59.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -67.52 -27.58 67.1 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 119.478 -2.014 . . . . 0.0 112.135 172.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 22.4 m -76.64 -32.91 58.3 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 126.842 2.057 . . . . 0.0 113.593 176.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.4 mt -65.4 -48.62 72.23 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 116.54 -1.695 . . . . 0.0 112.991 168.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -71.27 -25.98 62.69 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 126.987 2.68 . . . . 0.0 112.874 -178.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . 0.367 . . -84.47 4.62 30.88 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 116.943 -3.598 . . . . 0.0 114.969 170.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.53 167.47 29.88 Favored Pre-proline 0 N--CA 1.448 -0.555 0 CA-C-N 119.595 1.089 . . . . 0.0 113.77 166.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -74.21 155.54 46.79 Favored 'Trans proline' 0 N--CA 1.448 -1.191 0 N-CA-C 117.068 1.911 . . . . 0.0 117.068 169.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 m -61.58 -39.55 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 115.918 -1.991 . . . . 0.0 115.15 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 12.3 pm0 -66.78 -25.33 66.42 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 126.27 2.231 . . . . 0.0 110.636 173.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.5 tp -73.51 -39.76 64.57 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.408 -3.308 . . . . 0.0 111.458 174.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 89.5 mtm-85 -68.12 -33.2 74.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 114.029 -2.891 . . . . 0.0 115.163 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -66.05 -30.25 70.75 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 128.371 3.544 . . . . 0.0 105.593 168.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -84.69 -45.74 12.16 Favored 'General case' 0 N--CA 1.45 -0.465 1 O-C-N 115.882 -4.262 . . . . 0.0 105.63 -169.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 22.4 mt -70.8 -35.82 72.7 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 124.96 1.412 . . . . 0.0 114.661 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -61.85 -17.65 57.18 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 170.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -102.92 -19.77 14.5 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 177.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 92.6 t -95.02 -38.91 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 CA-C-O 124.115 1.912 . . . . 0.0 112.754 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 6.6 mt -86.74 -68.33 0.75 Allowed 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 117.768 -3.083 . . . . 0.0 111.13 -174.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 79.9 mt -64.01 -33.61 76.14 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 126.888 3.233 . . . . 0.0 113.459 -165.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -55.17 -17.23 3.96 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.11 2.964 . . . . 0.0 114.175 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 3.4 m -71.47 -20.75 62.04 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 170.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.695 2.798 . . . . 0.0 113.266 171.105 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.47 0.539 0 N-CA-C 104.908 -2.256 . . . . 0.0 104.908 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -51.26 134.65 27.46 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 124.783 2.23 . . . . 0.0 114.751 -175.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -109.11 148.72 30.4 Favored 'General case' 0 N--CA 1.445 -0.724 1 N-CA-C 121.97 4.063 . . . . 0.0 121.97 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -165.13 152.53 11.01 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 121.166 1.803 . . . . 0.0 109.062 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 12.6 p -152.71 162.67 25.83 Favored Pre-proline 0 N--CA 1.448 -0.55 0 C-N-CA 128.176 2.59 . . . . 0.0 108.896 164.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -47.73 -25.25 5.55 Favored 'Trans proline' 0 N--CA 1.449 -1.091 1 N-CA-C 124.069 4.603 . . . . 0.0 124.069 -158.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -142.81 160.72 39.79 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.288 178.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 13.6 t -157.32 125.94 5.7 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 127.095 2.158 . . . . 0.0 110.297 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.39 -27.73 59.2 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 119.412 -2.055 . . . . 0.0 112.697 175.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.15 -36.54 83.39 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 -170.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 34.0 mtt -77.82 -31.25 51.56 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 117.534 -3.229 . . . . 0.0 115.539 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.76 95.16 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.811 1.244 . . . . 0.0 112.248 174.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 tp10 -72.54 -29.46 63.59 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 126.648 2.468 . . . . 0.0 111.54 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . 0.301 50.9 tt0 -72.26 -36.01 68.92 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.652 0.739 . . . . 0.0 111.991 164.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -31.53 71.74 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 118.061 -2.9 . . . . 0.0 114.88 177.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -64.58 -51.43 62.76 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.417 2.287 . . . . 0.0 112.869 170.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.376 80.8 mm-40 -55.97 -42.53 76.43 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 114.877 -2.487 . . . . 0.0 112.621 170.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 68.2 mt-10 -66.74 -52.47 44.0 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 125.777 1.923 . . . . 0.0 112.44 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -55.93 -37.75 69.38 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 170.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.66 -29.64 68.98 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 117.849 -3.032 . . . . 0.0 115.165 167.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 37.5 ttt-85 -71.74 -27.26 62.87 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 127.126 2.766 . . . . 0.0 109.548 170.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -66.62 -54.13 26.71 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.894 -2.379 . . . . 0.0 111.397 171.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 88.7 t -57.7 -39.64 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 123.618 1.675 . . . . 0.0 112.429 -174.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -61.13 -58.5 8.11 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.712 2.005 . . . . 0.0 108.215 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 58.8 tp -50.78 -39.37 52.36 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 129.768 3.227 . . . . 0.0 112.321 175.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 46.6 tp -68.03 -50.04 57.77 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.726 2.41 . . . . 0.0 105.602 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -70.95 -29.39 65.4 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 120.23 -1.544 . . . . 0.0 114.868 -175.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -63.49 -32.09 73.44 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.848 -1.549 . . . . 0.0 113.85 166.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.99 -23.35 60.63 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.78 1.632 . . . . 0.0 112.852 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -69.88 -11.21 60.7 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 116.699 -3.75 . . . . 0.0 117.205 171.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -87.54 -25.61 23.56 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 128.955 2.902 . . . . 0.0 111.812 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -124.74 17.71 8.71 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 124.144 3.156 . . . . 0.0 111.44 -178.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 61.23 31.18 19.5 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 116.135 -1.888 . . . . 0.0 114.629 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 mt -103.36 13.99 32.48 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 175.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -78.39 -26.82 46.64 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 -170.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.4 83.8 mt -69.42 -48.11 25.63 Favored Pre-proline 0 N--CA 1.448 -0.553 0 O-C-N 126.691 2.494 . . . . 0.0 114.772 168.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -55.51 -38.96 93.55 Favored 'Trans proline' 0 N--CA 1.447 -1.261 1 C-N-CA 127.576 5.518 . . . . 0.0 111.995 171.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 40.2 tp -77.35 -37.64 51.92 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 119.524 -1.985 . . . . 0.0 112.323 -176.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 34.2 mt -74.42 -31.29 62.26 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 122.19 2.268 . . . . 0.0 107.344 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -70.16 -35.6 74.13 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 167.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 30.5 tp -63.52 -43.72 96.34 Favored 'General case' 0 N--CA 1.448 -0.543 1 O-C-N 115.969 -4.207 . . . . 0.0 111.136 170.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 12.9 mmt -74.01 -49.93 22.12 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.931 2.892 . . . . 0.0 116.374 -174.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.7 mp -106.5 130.0 54.36 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 129.948 3.299 . . . . 0.0 112.276 -176.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 71.0 p -56.35 153.45 19.65 Favored Pre-proline 0 N--CA 1.448 -0.555 0 O-C-N 127.241 2.838 . . . . 0.0 117.867 157.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . 0.271 13.5 Cg_exo -49.92 -39.96 49.18 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 C-N-CA 115.803 -2.331 . . . . 0.0 115.418 171.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.95 -31.6 71.15 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.706 1.602 . . . . 0.0 114.979 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -77.42 -30.94 53.73 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 113.666 -3.064 . . . . 0.0 111.429 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 46.4 mtm-85 -81.33 -27.68 34.85 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 126.478 2.361 . . . . 0.0 111.859 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -68.63 -43.38 76.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 119.261 -2.15 . . . . 0.0 113.199 163.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.29 86.5 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 116.845 -1.55 . . . . 0.0 112.5 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 19.4 mt -78.37 -25.66 46.36 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 117.876 2.547 . . . . 0.0 117.876 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.18 -35.72 70.74 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 119.07 -1.538 . . . . 0.0 114.157 169.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 7.0 m -54.55 -49.09 71.15 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 118.528 -2.748 . . . . 0.0 114.966 163.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -58.14 -24.14 57.76 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 126.014 2.071 . . . . 0.0 113.322 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 40.6 t -71.72 -37.27 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 115.541 -2.171 . . . . 0.0 110.003 170.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -73.29 -16.38 61.38 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 122.49 2.404 . . . . 0.0 113.429 174.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 11.6 mt -73.62 -35.27 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 121.271 -0.893 . . . . 0.0 111.354 170.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 47.6 t -70.78 -43.86 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 O-C-N 120.728 -1.233 . . . . 0.0 109.865 170.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.05 -42.22 98.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 117.671 -3.143 . . . . 0.0 115.852 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -68.71 -25.65 64.87 Favored 'General case' 0 N--CA 1.449 -0.508 1 O-C-N 115.741 -4.349 . . . . 0.0 113.822 174.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 86.7 mt -87.91 8.95 23.83 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 116.843 -3.661 . . . . 0.0 112.525 172.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 62.5 mt -112.99 -20.25 11.61 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 120.152 1.342 . . . . 0.0 111.935 162.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 39.0 ttm105 -78.15 -38.08 44.46 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 127.836 2.455 . . . . 0.0 112.978 171.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.58 25.71 67.52 Favored Glycine 0 CA--C 1.524 0.653 0 CA-C-O 126.22 3.122 . . . . 0.0 115.449 161.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -92.83 -33.9 14.07 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 112.306 -1.947 . . . . 0.0 113.989 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 53.9 mtt -62.87 142.74 58.14 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 127.356 2.91 . . . . 0.0 112.007 178.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 61.0 p -71.54 159.31 34.69 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.91 1.284 . . . . 0.0 113.15 160.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -59.8 -28.47 67.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 166.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . 0.254 23.6 ttp-105 -53.13 -49.18 67.08 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 127.772 2.429 . . . . 0.0 113.366 162.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -68.39 -59.38 3.22 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.108 1.763 . . . . 0.0 111.13 170.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mt -44.23 -38.85 4.04 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.991 -2.943 . . . . 0.0 116.481 176.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -53.15 -43.45 67.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 126.761 2.024 . . . . 0.0 115.374 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -112.21 -41.98 3.82 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 120.637 1.562 . . . . 0.0 112.479 -171.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -90.54 -33.1 16.05 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 120.176 -1.578 . . . . 0.0 109.157 -166.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 6.2 tp -84.24 -21.88 31.0 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 119.447 -2.033 . . . . 0.0 114.778 168.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.95 -174.77 28.8 Favored Glycine 0 C--N 1.335 0.508 0 N-CA-C 121.393 3.317 . . . . 0.0 121.393 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.21 68.26 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 111.895 -2.153 . . . . 0.0 115.87 -168.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.58 -13.17 2.77 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 121.191 3.236 . . . . 0.0 121.191 169.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 9.3 tt -60.22 -20.57 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.82 -27.78 58.04 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 120.532 -1.355 . . . . 0.0 111.356 -179.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 93.2 m -64.83 -29.88 70.86 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 127.103 2.161 . . . . 0.0 110.2 172.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 7.5 mm -96.38 -31.17 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 115.835 -2.031 . . . . 0.0 110.98 -174.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 29.7 p -117.57 -0.86 11.78 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 125.425 1.703 . . . . 0.0 113.597 -163.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -124.06 148.94 46.68 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 120.998 -1.064 . . . . 0.0 113.007 172.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 98.79 169.74 31.18 Favored Glycine 0 C--N 1.338 0.639 0 CA-C-O 123.713 1.73 . . . . 0.0 112.19 -171.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 92.7 p -66.63 -34.52 78.06 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -177.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -89.34 10.69 21.48 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 115.195 -2.336 . . . . 0.0 112.022 -176.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 60.4 p -79.3 169.8 17.57 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 126.443 2.339 . . . . 0.0 114.542 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 21.0 tp -51.25 -42.76 61.25 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 116.822 -3.673 . . . . 0.0 113.922 -165.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -97.18 24.17 6.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 124.016 3.098 . . . . 0.0 111.791 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -141.43 -19.99 0.77 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 115.648 -2.12 . . . . 0.0 112.304 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.04 150.87 1.26 Allowed Pre-proline 0 N--CA 1.449 -0.495 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 164.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.54 156.1 62.71 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 CA-C-N 121.886 1.709 . . . . 0.0 113.475 -174.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 70.6 t -77.22 -27.5 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-O 112.757 -3.496 . . . . 0.0 108.338 -161.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -68.79 -29.32 67.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 124.849 3.477 . . . . 0.0 113.509 173.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 18.3 tp -78.75 -45.7 20.53 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 120.472 1.487 . . . . 0.0 108.547 176.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -50.38 -39.31 46.43 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 170.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -74.24 -35.88 63.87 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.235 -1.364 . . . . 0.0 108.347 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 36.2 t90 -81.55 -22.3 37.93 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 118.334 2.716 . . . . 0.0 118.334 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.15 -32.26 70.16 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.971 -0.456 . . . . 0.0 111.709 171.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.98 -35.18 80.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 115.0 1.482 . . . . 0.0 115.0 171.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -83.3 -29.29 28.47 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 118.512 -2.617 . . . . 0.0 115.258 -173.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 t -85.46 -41.24 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 171.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 7.0 mt -88.38 -5.02 58.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 121.771 3.989 . . . . 0.0 121.771 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . 0.286 99.3 mt -129.56 50.6 2.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 125.972 2.045 . . . . 0.0 112.11 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 16.8 pttt . . . . . 0 N--CA 1.448 -0.559 0 O-C-N 117.925 -2.984 . . . . 0.0 113.07 -166.887 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 3.4 p . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 118.235 -0.888 . . . . 0.0 108.991 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.64 -52.3 2.51 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-N 123.763 2.38 . . . . 0.0 110.808 177.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -141.73 128.87 20.91 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 128.905 2.882 . . . . 0.0 113.295 167.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.6 t -61.21 137.41 58.24 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 118.682 2.845 . . . . 0.0 118.682 -175.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.61 -35.49 72.54 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 131.047 3.739 . . . . 0.0 110.272 170.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.56 -14.23 59.71 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.494 -2.629 . . . . 0.0 112.21 175.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 11.3 mmt -87.14 -31.85 20.18 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.588 1.995 . . . . 0.0 115.381 168.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . 0.303 . . -62.88 -33.69 75.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.369 -2.253 . . . . 0.0 116.324 167.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -61.54 -38.26 86.78 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 128.382 3.551 . . . . 0.0 113.935 168.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -81.56 -35.47 30.2 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 114.179 -2.82 . . . . 0.0 109.534 -169.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -21.5 66.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 117.392 2.367 . . . . 0.0 117.392 174.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -84.57 -37.16 21.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.995 2.118 . . . . 0.0 113.312 173.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -76.86 -37.23 55.96 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 125.08 1.487 . . . . 0.0 111.579 176.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -63.85 -18.99 64.71 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 116.072 -2.251 . . . . 0.0 112.422 166.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 -79.89 -47.61 14.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.835 1.254 . . . . 0.0 110.986 175.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 63.2 mt -52.52 -32.84 42.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.2 -2.333 . . . . 0.0 113.972 170.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 41.5 ttt180 -76.73 -19.49 57.6 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 114.867 -2.492 . . . . 0.0 110.265 173.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -75.56 -41.94 53.56 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 123.91 3.05 . . . . 0.0 114.836 155.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 77.8 t -60.19 -38.24 76.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 121.557 1.98 . . . . 0.0 111.826 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -74.44 -32.12 62.52 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 120.778 3.621 . . . . 0.0 120.778 168.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 21.4 tp -63.1 -44.08 96.69 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 165.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 26.2 tp -67.71 -43.16 80.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 120.462 1.483 . . . . 0.0 109.377 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . 0.451 ' HB3' ' HE2' ' D' ' 27' ' ' LYS . 35.9 ttpt -57.34 -41.43 79.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 118.479 -2.638 . . . . 0.0 115.397 175.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -69.7 -32.49 71.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 116.674 -1.631 . . . . 0.0 110.243 171.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.263 . . -68.7 -20.93 64.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 121.419 1.918 . . . . 0.0 115.239 168.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -66.42 -45.61 79.32 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 123.236 2.744 . . . . 0.0 108.686 170.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -67.33 -5.79 15.88 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.628 -1.92 . . . . 0.0 114.644 -166.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 39.4 p-10 -137.25 16.08 2.99 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 125.428 1.705 . . . . 0.0 112.442 165.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 60.92 33.91 19.7 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 115.927 1.825 . . . . 0.0 115.927 172.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 48.1 mt -93.18 3.1 56.25 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 111.169 -2.741 . . . . 0.0 115.984 161.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.28 -60.68 2.99 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 130.753 3.621 . . . . 0.0 113.741 -178.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.13 -47.89 89.35 Favored Pre-proline 0 N--CA 1.451 -0.421 0 O-C-N 117.376 -3.327 . . . . 0.0 113.866 -174.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -64.01 -18.61 64.34 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 CA-C-N 123.035 2.119 . . . . 0.0 111.0 174.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . 0.315 38.1 tp -64.64 -70.81 0.21 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 123.353 2.797 . . . . 0.0 110.148 167.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 3.9 mt -36.09 -53.32 0.79 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 116.469 -1.729 . . . . 0.0 115.289 170.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . 0.291 26.8 m-20 -74.89 -22.27 58.74 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 116.998 -1.881 . . . . 0.0 111.194 -176.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 35.9 tp -65.65 -38.5 89.54 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 121.723 2.056 . . . . 0.0 112.84 166.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 72.1 mmm -89.85 -32.74 16.76 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 126.191 2.182 . . . . 0.0 114.223 -165.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 73.4 mt -105.61 122.3 45.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 118.041 -2.912 . . . . 0.0 112.888 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . 0.323 73.1 p -57.23 151.82 34.35 Favored Pre-proline 0 N--CA 1.45 -0.47 0 N-CA-C 119.223 3.046 . . . . 0.0 119.223 160.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -42.26 -53.3 3.7 Favored 'Trans proline' 0 N--CA 1.448 -1.201 0 C-N-CA 124.816 3.677 . . . . 0.0 116.864 -175.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.299 0.9 OUTLIER -84.22 -3.93 58.5 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 115.762 -2.066 . . . . 0.0 112.045 -169.704 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -75.41 -44.1 46.44 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 125.863 1.665 . . . . 0.0 109.199 162.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 36.9 mtm-85 -67.61 -33.58 75.27 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 115.318 -2.277 . . . . 0.0 111.781 171.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -67.59 -44.83 77.19 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 175.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.25 . . -56.31 -48.07 77.44 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 121.446 1.93 . . . . 0.0 113.289 176.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 mt -65.78 -39.38 90.94 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.877 -1.765 . . . . 0.0 114.429 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.33 -36.74 53.78 Favored Glycine 0 N--CA 1.448 -0.504 0 O-C-N 119.526 -1.984 . . . . 0.0 113.601 167.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 29.5 m -94.73 -31.83 13.61 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 120.203 -1.763 . . . . 0.0 109.438 -171.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -52.37 -33.84 45.09 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 119.273 3.064 . . . . 0.0 119.273 170.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.46 -39.47 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 N-CA-C 115.932 1.827 . . . . 0.0 115.932 173.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -80.25 -25.08 39.69 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 174.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 78.8 mt -56.22 -50.21 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 O-C-N 120.631 -1.293 . . . . 0.0 112.34 158.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 41.9 t -64.47 -50.54 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 O-C-N 125.338 1.649 . . . . 0.0 114.349 176.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -51.67 -42.28 62.01 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 125.165 2.412 . . . . 0.0 109.823 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -72.78 -19.3 61.38 Favored 'General case' 0 N--CA 1.451 -0.409 1 O-C-N 115.051 -4.78 . . . . 0.0 117.193 178.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 62.8 mt -79.49 -18.93 50.92 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 126.449 2.343 . . . . 0.0 115.425 166.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 10.4 mt -94.83 -25.99 16.39 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.956 2.102 . . . . 0.0 108.548 175.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 31.4 ttm105 -77.23 -38.47 51.17 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 122.627 2.467 . . . . 0.0 110.822 163.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.37 17.63 74.51 Favored Glycine 0 C--N 1.339 0.696 0 CA-C-N 123.441 2.837 . . . . 0.0 116.869 169.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -92.93 -40.49 10.55 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 119.034 1.417 . . . . 0.0 110.841 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 49.5 mtm -75.15 44.51 0.25 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.094 2.558 . . . . 0.0 108.154 173.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 85.5 p -87.24 175.45 8.03 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 119.673 3.212 . . . . 0.0 119.673 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 63.92 -33.33 0.13 Allowed 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 129.918 3.287 . . . . 0.0 112.797 174.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -146.75 -46.13 0.18 Allowed 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 129.119 2.968 . . . . 0.0 108.771 -176.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -75.39 -40.79 57.56 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 117.738 -3.101 . . . . 0.0 118.537 -149.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 tt -62.83 -43.0 99.96 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.81 0.844 . . . . 0.0 109.575 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -54.0 -22.51 10.68 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.133 0.973 . . . . 0.0 112.434 175.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -110.78 -37.56 5.39 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 116.942 2.201 . . . . 0.0 116.942 174.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -64.6 -51.12 64.37 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.435 3.094 . . . . 0.0 115.79 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.37 1.3 mm? -99.23 -22.75 15.48 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.563 1.545 . . . . 0.0 109.884 170.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 77.57 -149.7 35.49 Favored Glycine 0 CA--C 1.523 0.593 1 N-CA-C 123.949 4.34 . . . . 0.0 123.949 166.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -45.51 -24.1 0.29 Allowed 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 128.031 2.842 . . . . 0.0 118.154 -164.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.05 -20.43 79.97 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-O 125.72 2.845 . . . . 0.0 118.984 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . 0.308 2.1 tt -44.31 -39.13 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 111.846 -2.177 . . . . 0.0 114.739 176.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.79 -17.43 44.15 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 129.548 3.139 . . . . 0.0 110.414 -175.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 1.7 m -74.73 -39.61 61.76 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 125.473 2.558 . . . . 0.0 112.598 164.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 15.2 mm -73.62 -19.87 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 120.991 3.7 . . . . 0.0 120.991 173.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 72.5 p -111.54 -40.98 4.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 117.565 -3.209 . . . . 0.0 105.826 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.279 35.0 mtp85 -70.79 169.53 14.39 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 122.765 2.53 . . . . 0.0 114.28 171.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 100.73 133.37 8.11 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 104.763 -3.335 . . . . 0.0 104.763 -174.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -49.68 -24.79 2.44 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -145.11 42.89 1.31 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 127.688 2.395 . . . . 0.0 112.847 -169.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 60.2 p -75.95 -177.93 4.1 Favored 'General case' 0 N--CA 1.45 -0.464 1 O-C-N 129.252 4.095 . . . . 0.0 107.918 174.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.285 3.0 tt -52.98 -31.67 42.05 Favored 'General case' 0 N--CA 1.45 -0.44 1 N-CA-C 122.356 4.206 . . . . 0.0 122.356 160.152 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -72.09 -24.59 61.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.418 1.887 . . . . 0.0 112.214 172.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.69 -19.57 16.0 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.614 -1.66 . . . . 0.0 114.728 -175.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 41.5 84.5 0.18 Allowed Pre-proline 0 N--CA 1.449 -0.489 0 C-N-CA 128.736 2.814 . . . . 0.0 113.581 163.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . 0.573 ' C ' ' H ' ' D' ' 95' ' ' GLU . 50.2 Cg_exo 22.82 54.07 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 O-C-N 115.231 -3.089 . . . . 0.0 112.933 58.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 4.7 t -74.03 31.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 CA-C-O 122.612 1.196 . . . . 0.0 110.325 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . 0.573 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -137.18 -37.42 0.64 Allowed 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 116.199 -1.858 . . . . 0.0 114.788 174.597 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . 0.259 26.4 tp -55.68 -46.46 77.57 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.588 -1.672 . . . . 0.0 109.204 163.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 26.2 ptt180 -65.38 -35.04 79.76 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 117.0 -1.88 . . . . 0.0 114.217 -176.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -71.08 -35.54 71.89 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 115.038 1.495 . . . . 0.0 115.038 -172.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 29.9 t90 -63.65 -46.91 83.48 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 160.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 21.2 mt -63.22 -38.79 92.57 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 122.776 1.274 . . . . 0.0 113.234 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -47.38 -42.71 22.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 117.797 2.517 . . . . 0.0 117.797 163.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -95.15 -20.59 19.13 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 118.349 -2.719 . . . . 0.0 108.352 -166.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 89.8 t -85.61 -32.79 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 128.532 2.733 . . . . 0.0 114.185 165.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 64.9 mt -102.26 -6.09 23.54 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -171.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 51.9 mt -120.54 21.33 11.62 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 119.992 -1.692 . . . . 0.0 108.465 170.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 14.1 pttp -59.59 159.89 7.86 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 116.648 2.092 . . . . 0.0 116.648 -173.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.8 m -71.46 5.64 2.23 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 119.881 3.289 . . . . 0.0 119.881 -172.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 C--O 1.248 0.992 0 C-N-CA 127.167 2.187 . . . . 0.0 112.68 150.33 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.5 ttp . . . . . 0 N--CA 1.445 -0.691 0 CA-C-O 125.254 2.454 . . . . 0.0 114.685 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.78 -26.43 67.25 Favored 'General case' 0 N--CA 1.452 -0.346 1 O-C-N 114.173 -5.329 . . . . 0.0 111.616 166.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -88.19 -27.21 21.97 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 127.077 2.151 . . . . 0.0 114.485 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -85.15 -44.01 13.33 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 103.447 -2.797 . . . . 0.0 103.447 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -67.18 -45.63 76.38 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 104.054 -2.573 . . . . 0.0 104.054 -175.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -59.09 -46.29 88.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 117.737 -1.585 . . . . 0.0 114.349 175.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.11 -24.18 67.36 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 120.318 -1.488 . . . . 0.0 108.42 178.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.54 -28.83 61.13 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.969 -2.957 . . . . 0.0 109.569 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -94.52 -33.8 12.93 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 125.53 2.586 . . . . 0.0 112.583 -172.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.7 mt -60.75 -15.06 25.43 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 116.943 -3.598 . . . . 0.0 119.699 163.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -68.87 -48.32 63.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 130.472 3.509 . . . . 0.0 105.39 173.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -71.93 -37.29 70.04 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.549 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.3 t -65.45 -41.19 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-O 124.453 2.073 . . . . 0.0 112.264 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -69.96 -34.66 73.69 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 119.634 -1.916 . . . . 0.0 110.202 172.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 24.5 tp -73.96 -45.72 48.42 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 117.847 -3.033 . . . . 0.0 109.579 -173.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 tp -59.09 -36.59 75.38 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.437 ' HB2' ' CE1' ' B' ' 30' ' ' TYR . 69.8 tttt -62.62 -46.65 87.29 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 112.434 -2.166 . . . . 0.0 115.47 170.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -57.21 -39.19 74.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 126.205 1.802 . . . . 0.0 106.963 172.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.98 -31.27 56.39 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 114.395 -2.716 . . . . 0.0 108.597 -177.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -58.24 -42.2 85.86 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 173.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -75.68 -15.09 60.35 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 127.536 2.334 . . . . 0.0 110.553 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -131.78 16.69 4.76 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.34 3.4 m-20 73.3 1.75 4.1 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 168.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.2 mt -75.29 6.0 4.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.529 1.157 . . . . 0.0 113.562 168.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . 0.341 17.2 p-80 -67.47 -62.39 1.44 Allowed 'General case' 0 N--CA 1.451 -0.416 1 O-C-N 113.847 -5.533 . . . . 0.0 111.564 -166.436 . . . . . . . . 3 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.262 26.7 mt -49.1 -46.79 76.12 Favored Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-O 114.115 -2.85 . . . . 0.0 117.338 167.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -58.96 -42.88 47.71 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 124.665 3.577 . . . . 0.0 113.089 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 17.7 tp -69.69 -46.83 65.14 Favored 'General case' 0 N--CA 1.452 -0.372 1 O-C-N 115.025 -4.797 . . . . 0.0 110.726 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 74.7 mt -55.16 -42.46 73.15 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 126.416 2.323 . . . . 0.0 115.577 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -77.82 -4.6 47.35 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.084 1.353 . . . . 0.0 113.388 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 23.6 tp -99.36 -29.13 12.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 114.144 -2.836 . . . . 0.0 113.276 169.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 59.8 mmm -107.72 -9.48 15.81 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.076 2.11 . . . . 0.0 116.543 -177.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.5 mp -118.36 152.11 36.46 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 118.839 -2.413 . . . . 0.0 109.339 159.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.8 p -110.46 165.45 12.66 Favored Pre-proline 0 N--CA 1.452 -0.343 0 C-N-CA 124.972 1.309 . . . . 0.0 107.79 -170.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -61.34 -40.68 47.2 Favored 'Trans proline' 0 N--CA 1.446 -1.315 0 C-N-CA 124.307 3.338 . . . . 0.0 117.994 -163.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -22.56 62.56 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 116.632 -1.651 . . . . 0.0 109.969 176.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -72.0 -41.86 67.1 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 121.219 1.827 . . . . 0.0 112.517 175.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 20.6 mtm180 -65.23 -49.82 68.2 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 123.946 0.899 . . . . 0.0 110.944 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -55.92 -39.3 71.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 171.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.43 -37.15 84.56 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 117.261 -1.352 . . . . 0.0 110.14 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 30.2 mt -74.88 -27.88 60.42 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 124.664 3.393 . . . . 0.0 110.571 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.41 -44.39 98.09 Favored Glycine 0 CA--C 1.522 0.517 0 O-C-N 119.757 -1.839 . . . . 0.0 113.67 171.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -60.66 -32.13 71.33 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.288 1.435 . . . . 0.0 114.131 171.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.262 93.9 mtt180 -68.67 -34.42 75.66 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.545 -0.74 . . . . 0.0 111.232 -177.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.96 -48.21 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 168.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -55.01 -39.43 69.07 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 112.624 -3.56 . . . . 0.0 114.473 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 52.8 mt -63.43 -49.13 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 123.285 2.766 . . . . 0.0 111.849 167.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.0 -35.33 71.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 O-C-N 117.772 -3.08 . . . . 0.0 108.541 -174.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -60.45 -54.53 44.4 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 118.824 -2.423 . . . . 0.0 108.686 174.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -60.5 -27.6 67.72 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 171.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.5 mt -76.28 -25.31 54.77 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 117.456 -3.277 . . . . 0.0 111.149 176.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.9 mt -92.35 -40.06 11.12 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 127.725 2.41 . . . . 0.0 112.226 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.6 ttm105 -46.73 -56.49 6.11 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 117.044 -3.535 . . . . 0.0 112.454 148.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.67 44.94 61.12 Favored Glycine 0 C--N 1.337 0.611 0 C-N-CA 117.602 -2.237 . . . . 0.0 112.702 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -121.04 -52.08 2.09 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 127.653 2.381 . . . . 0.0 114.762 178.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.0 mtt -67.7 130.81 44.17 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 119.101 -2.249 . . . . 0.0 114.516 175.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.1 p -83.54 178.32 8.05 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 120.459 1.481 . . . . 0.0 110.033 -178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -63.87 -46.45 84.92 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 116.507 -2.077 . . . . 0.0 112.855 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.9 tpt85 -63.01 -10.07 12.46 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 119.792 3.256 . . . . 0.0 119.792 170.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -86.66 -42.89 13.05 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 120.938 1.699 . . . . 0.0 110.668 165.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 19.8 mt -63.83 -26.32 68.57 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.963 -1.71 . . . . 0.0 111.259 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -63.45 -21.81 66.52 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.356 1.062 . . . . 0.0 111.427 -176.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -102.08 -53.03 3.02 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 129.36 3.064 . . . . 0.0 111.125 166.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -74.59 -27.06 60.32 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 124.011 3.096 . . . . 0.0 115.523 -168.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.4 mt -121.83 -5.23 9.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 118.707 2.854 . . . . 0.0 118.707 170.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 82.35 5.15 89.83 Favored Glycine 0 CA--C 1.523 0.555 0 CA-C-O 116.137 -2.48 . . . . 0.0 115.027 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.67 138.78 43.08 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 117.438 2.384 . . . . 0.0 117.438 -170.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.73 171.53 55.13 Favored Glycine 0 C--N 1.34 0.779 0 CA-C-O 124.552 2.196 . . . . 0.0 116.159 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.8 mt -54.31 -59.29 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 1 O-C-N 115.096 -4.767 . . . . 0.0 112.656 173.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.11 -34.96 75.79 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.99 1.716 . . . . 0.0 113.842 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.15 -36.2 66.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 124.121 0.968 . . . . 0.0 110.538 177.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.39 49.7 mm -69.33 -45.15 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 O-C-N 118.465 -2.647 . . . . 0.0 114.338 164.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.1 m -65.36 -52.35 54.26 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.629 -177.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -74.55 -32.86 62.57 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 121.201 1.818 . . . . 0.0 110.462 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.12 -34.97 90.75 Favored Glycine 0 C--N 1.338 0.668 0 O-C-N 120.142 -1.599 . . . . 0.0 111.566 169.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.0 m -68.67 -45.0 72.87 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.126 -2.985 . . . . 0.0 111.036 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -57.94 -40.87 81.57 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 172.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 75.8 m -72.16 -25.94 61.89 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 113.656 -1.611 . . . . 0.0 113.848 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.6 tp -71.0 -33.09 70.06 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 166.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -69.04 -32.51 72.07 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 113.491 -3.147 . . . . 0.0 112.193 169.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.91 -5.68 40.09 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 128.109 3.381 . . . . 0.0 114.892 170.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.4 143.0 87.33 Favored Pre-proline 0 N--CA 1.448 -0.538 1 O-C-N 115.679 -4.388 . . . . 0.0 108.692 172.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -73.2 149.15 45.31 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 123.574 2.849 . . . . 0.0 110.202 175.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.2 m -65.98 -32.47 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 116.873 -3.642 . . . . 0.0 107.953 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.265 18.2 pm0 -65.07 -26.24 68.15 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 119.92 1.236 . . . . 0.0 111.192 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 48.2 tp -80.99 -41.9 22.02 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 116.757 -1.592 . . . . 0.0 110.853 177.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -68.59 -38.09 80.37 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 121.89 2.132 . . . . 0.0 111.79 176.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -53.79 -37.27 63.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 129.534 3.133 . . . . 0.0 111.815 168.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 34.2 t90 -77.19 -49.69 14.61 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.891 1.276 . . . . 0.0 109.098 176.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 79.1 mt -68.64 -33.42 73.99 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 -174.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.21 -36.18 81.16 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 121.64 2.018 . . . . 0.0 113.855 169.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -74.55 -34.43 62.94 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 118.959 -2.338 . . . . 0.0 114.548 170.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.4 t -70.55 -44.07 77.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 O-C-N 119.589 -1.944 . . . . 0.0 110.184 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . 0.286 12.0 mt -97.34 -27.98 14.24 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -172.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.6 mt -103.82 19.81 19.26 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 117.162 -3.461 . . . . 0.0 114.991 -167.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt . . . . . 0 N--CA 1.447 -0.579 0 O-C-N 119.848 -1.783 . . . . 0.0 115.417 -170.309 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.586 0 CA-C-O 115.556 -2.164 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 4.0 mtt -87.61 -43.0 12.3 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 103.95 -2.611 . . . . 0.0 103.95 -176.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.65 -37.36 63.05 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 128.114 2.566 . . . . 0.0 116.183 170.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -66.23 -57.27 7.94 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 130.559 3.544 . . . . 0.0 107.724 -178.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -47.93 -46.14 31.71 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 129.397 3.079 . . . . 0.0 115.394 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -74.7 -43.27 55.99 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 126.407 1.883 . . . . 0.0 109.837 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -62.9 -26.66 68.9 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.179 1.354 . . . . 0.0 114.393 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -73.81 -50.72 19.14 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 116.278 -1.82 . . . . 0.0 110.581 174.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -43.12 -51.84 5.72 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 127.718 3.136 . . . . 0.0 114.26 163.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 -57.09 -49.84 74.64 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.934 1.694 . . . . 0.0 115.028 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 38.7 mt -63.46 -23.34 67.36 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 119.751 -1.843 . . . . 0.0 112.009 -176.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . 0.259 67.5 ttt180 -67.93 -30.19 69.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.788 2.035 . . . . 0.0 112.301 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -79.77 -36.83 36.59 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 115.899 -2.0 . . . . 0.0 111.358 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 20.9 t -59.28 -39.69 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 O-C-N 126.402 2.314 . . . . 0.0 112.914 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -80.1 -35.23 37.17 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 116.464 -1.732 . . . . 0.0 114.872 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 25.8 tp -58.74 -47.43 84.66 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 126.175 2.893 . . . . 0.0 114.63 168.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 28.8 tp -70.53 -32.93 70.58 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 116.863 -3.648 . . . . 0.0 112.526 -177.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . 0.317 59.2 tttt -49.7 -50.59 43.21 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 126.318 2.961 . . . . 0.0 110.854 165.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -81.91 -20.04 39.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 116.958 -3.588 . . . . 0.0 111.51 -174.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.49 -36.32 57.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 172.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . 0.437 ' CE1' ' HB2' ' A' ' 27' ' ' LYS . 6.3 m-85 -50.53 -39.73 49.78 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 170.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -90.28 6.28 43.6 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.375 2.361 . . . . 0.0 117.375 178.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -119.67 6.21 11.01 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 119.409 -2.057 . . . . 0.0 107.93 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 57.82 43.5 21.65 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 117.231 -3.418 . . . . 0.0 112.793 -173.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 89.3 mt -125.15 5.51 7.86 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.46 -2.65 . . . . 0.0 111.523 -174.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -62.76 -39.49 94.31 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 119.197 -2.189 . . . . 0.0 113.555 -178.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' B' ' 36' ' ' LEU . 12.3 mt -66.54 -52.42 35.59 Favored Pre-proline 0 N--CA 1.446 -0.662 1 O-C-N 115.21 -4.681 . . . . 0.0 109.143 -173.281 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -70.53 -26.16 24.26 Favored 'Trans proline' 0 N--CA 1.447 -1.215 0 C-N-CA 121.665 1.576 . . . . 0.0 110.833 -177.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 tp -64.76 -44.47 89.93 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.583 1.553 . . . . 0.0 114.864 174.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 83.1 mt -78.84 -32.03 45.97 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.848 2.459 . . . . 0.0 111.456 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -62.33 -28.06 69.48 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 123.567 2.894 . . . . 0.0 109.276 165.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 51.6 tp -89.36 -34.79 16.4 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.643 1.977 . . . . 0.0 113.844 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 16.6 mmt -86.99 -21.47 26.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 115.085 -2.388 . . . . 0.0 112.077 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 44.5 mt -137.81 124.55 21.08 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 128.891 2.876 . . . . 0.0 110.153 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 77.1 p -68.9 166.79 24.23 Favored Pre-proline 0 N--CA 1.451 -0.423 0 C-N-CA 124.769 1.228 . . . . 0.0 112.292 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -40.54 -52.51 3.07 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 124.65 3.567 . . . . 0.0 113.726 167.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -66.7 -24.63 66.28 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 121.719 2.054 . . . . 0.0 114.816 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -83.49 -33.79 25.49 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 127.296 2.239 . . . . 0.0 115.912 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 56.6 mtm-85 -72.71 -40.53 66.11 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 127.442 2.297 . . . . 0.0 108.848 177.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.286 38.8 tt0 -63.57 -37.47 87.45 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 126.579 2.425 . . . . 0.0 115.688 176.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.7 -53.44 58.01 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.987 174.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.0 mt -59.14 -37.48 77.37 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 121.134 3.753 . . . . 0.0 121.134 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.19 -30.73 74.6 Favored Glycine 0 CA--C 1.523 0.594 0 C-N-CA 126.638 2.066 . . . . 0.0 115.313 166.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 74.1 m -87.29 -45.08 10.92 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 112.191 -3.766 . . . . 0.0 104.221 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -51.01 -45.93 61.35 Favored 'General case' 0 N--CA 1.452 -0.359 1 CA-C-N 126.227 4.103 . . . . 0.0 109.879 176.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.0 t -50.62 -55.07 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 116.627 -1.654 . . . . 0.0 111.773 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -56.18 -35.02 66.77 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 116.116 1.895 . . . . 0.0 116.116 172.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 80.7 mt -67.55 -45.37 85.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 120.545 1.521 . . . . 0.0 113.33 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 43.7 t -83.56 -1.9 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 126.285 1.834 . . . . 0.0 114.608 -172.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . 0.292 57.4 tt0 -92.36 -28.21 17.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.062 -1.829 . . . . 0.0 106.062 171.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -78.57 -20.96 49.4 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 126.467 1.907 . . . . 0.0 115.616 177.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 91.9 mt -63.93 -33.79 76.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 160.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . 0.267 13.2 mt -77.03 -33.27 57.37 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 120.6 3.556 . . . . 0.0 120.6 174.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 37.4 ttm105 -87.42 -58.67 2.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 127.867 3.229 . . . . 0.0 108.5 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.71 39.5 20.93 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 118.98 2.352 . . . . 0.0 118.98 175.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -123.5 -6.09 8.15 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 117.705 -1.141 . . . . 0.0 111.648 -168.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 5.1 mtt -83.37 152.33 25.1 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 30.5 p -83.45 159.56 21.73 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 117.662 -3.149 . . . . 0.0 115.989 157.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -61.97 -31.15 71.48 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 119.86 -1.775 . . . . 0.0 109.119 -173.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -59.29 -39.76 84.03 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 119.275 -2.141 . . . . 0.0 114.497 171.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -72.1 -38.1 69.41 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 119.822 -1.799 . . . . 0.0 108.5 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 46.3 mt -55.98 -48.85 75.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 118.95 -2.344 . . . . 0.0 107.554 176.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -66.39 -40.3 89.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 116.505 -2.078 . . . . 0.0 114.881 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -99.38 -17.86 17.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 125.691 2.663 . . . . 0.0 117.317 -164.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -105.2 -49.62 3.42 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 128.98 2.912 . . . . 0.0 112.236 176.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 60.7 mt -95.85 -4.83 42.98 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 126.452 2.345 . . . . 0.0 113.604 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.84 19.27 60.74 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-O 118.895 -0.947 . . . . 0.0 114.14 -178.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -100.79 118.25 36.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 116.418 2.007 . . . . 0.0 116.418 -165.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.01 167.98 54.36 Favored Glycine 0 CA--C 1.523 0.556 1 CA-C-O 128.364 4.313 . . . . 0.0 110.688 174.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 80.6 mt -52.23 -39.71 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 O-C-N 116.467 -3.961 . . . . 0.0 112.399 171.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . 0.275 . . -78.65 -39.29 37.39 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 116.798 -3.689 . . . . 0.0 115.013 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 9.2 m -56.92 -36.82 70.65 Favored 'General case' 0 N--CA 1.454 -0.272 1 O-C-N 114.22 -5.3 . . . . 0.0 113.171 166.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 14.3 mm -64.1 -53.07 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 170.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 24.1 m -55.07 -48.28 73.74 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 121.309 1.868 . . . . 0.0 114.455 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 20.1 ttt180 -63.88 -41.37 97.76 Favored 'General case' 0 N--CA 1.451 -0.408 1 O-C-N 116.239 -4.038 . . . . 0.0 112.524 175.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.68 -46.82 66.04 Favored Glycine 0 C--N 1.334 0.46 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 172.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m -71.6 -29.66 64.93 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 117.008 -1.472 . . . . 0.0 113.953 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -61.27 -58.79 6.82 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 119.79 1.177 . . . . 0.0 111.119 169.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -60.04 -33.24 71.75 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.078 2.151 . . . . 0.0 114.225 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 20.2 mt -58.69 -36.25 73.92 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 113.59 -3.1 . . . . 0.0 114.446 162.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 58.8 mttt -70.33 1.79 4.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 122.6 2.455 . . . . 0.0 112.39 173.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -117.52 -5.79 11.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 127.897 2.479 . . . . 0.0 115.761 174.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.4 131.84 64.15 Favored Pre-proline 0 N--CA 1.448 -0.567 0 C-N-CA 124.225 1.01 . . . . 0.0 109.809 -174.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -61.69 153.27 68.51 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 117.843 -0.971 . . . . 0.0 109.839 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.0 m -55.89 -33.77 35.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 126.52 2.388 . . . . 0.0 114.084 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 -74.49 -27.89 60.76 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 117.508 2.41 . . . . 0.0 117.508 -177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 52.7 tp -66.34 -50.79 62.38 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 117.343 -3.348 . . . . 0.0 111.437 164.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 15.3 mtm180 -61.47 -45.02 96.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 -173.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -53.98 -38.8 65.43 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 118.679 -2.513 . . . . 0.0 115.651 163.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -74.16 -35.44 64.03 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.42 -31.31 72.43 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 175.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -75.54 -18.78 59.68 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 124.488 1.117 . . . . 0.0 113.035 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -84.6 -31.85 24.07 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 131.617 3.967 . . . . 0.0 115.663 170.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 84.8 t -104.68 -52.63 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 116.287 -1.816 . . . . 0.0 111.956 -170.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 79.1 mt -76.41 -50.11 14.98 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 121.446 1.93 . . . . 0.0 108.665 -173.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 45.0 mt -67.91 -30.45 69.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.226 2.204 . . . . 0.0 110.376 -173.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . 0.283 89.1 mttt -70.06 -11.69 61.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 120.038 -1.664 . . . . 0.0 114.281 172.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.3 m -82.31 -9.37 59.5 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 116.554 -3.842 . . . . 0.0 116.506 168.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 . . . . . 0 C--O 1.248 1.013 0 CA-C-N 123.608 2.913 . . . . 0.0 112.428 170.165 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 14.9 ttt . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 124.975 2.321 . . . . 0.0 108.466 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.53 159.44 31.28 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 111.867 -2.424 . . . . 0.0 114.166 -168.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -131.86 148.4 52.54 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -127.09 127.22 44.3 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 128.462 2.705 . . . . 0.0 110.943 169.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 5' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 74.5 p -119.95 167.92 11.41 Favored Pre-proline 0 N--CA 1.451 -0.382 0 O-C-N 127.735 3.147 . . . . 0.0 113.45 168.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' C' ' 5' ' ' SER 0.269 87.4 Cg_exo -59.52 -31.59 94.84 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.983 3.122 . . . . 0.0 117.18 179.535 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . 0.271 68.9 t80 -148.66 141.56 24.74 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 119.346 -2.096 . . . . 0.0 108.539 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 2.7 t -141.37 120.89 13.26 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.443 -1.253 . . . . 0.0 112.328 166.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.82 -5.74 22.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 121.558 3.91 . . . . 0.0 121.558 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.91 -17.02 59.2 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 117.596 2.443 . . . . 0.0 117.596 171.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 33.1 mtt -86.58 -39.31 16.29 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 126.215 1.806 . . . . 0.0 108.015 173.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.07 -28.06 54.5 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 177.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -70.89 -28.93 64.9 Favored 'General case' 0 N--CA 1.449 -0.494 1 O-C-N 116.287 -4.008 . . . . 0.0 109.942 170.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -76.07 -31.66 58.88 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 115.86 -2.019 . . . . 0.0 113.457 171.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -35.34 79.09 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 121.535 1.97 . . . . 0.0 109.576 165.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -66.29 -49.56 66.67 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 125.92 2.012 . . . . 0.0 107.414 -174.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 71.4 mm-40 -63.9 -30.58 71.65 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -67.36 -34.31 77.03 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.199 -2.188 . . . . 0.0 109.207 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . 0.465 ' CE2' ' HD2' ' D' ' 48' ' ' ARG . 58.3 t-105 -82.98 -40.27 20.24 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 -175.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 21.8 mt -64.85 -37.14 86.62 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 117.463 -1.695 . . . . 0.0 112.318 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -53.59 -36.78 62.31 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 128.172 2.589 . . . . 0.0 113.627 167.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . 0.274 75.7 t80 -52.24 -59.92 3.82 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 127.239 2.216 . . . . 0.0 106.153 171.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 98.8 t -74.38 -32.48 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 125.162 1.538 . . . . 0.0 110.671 -170.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -68.4 -34.34 75.86 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 116.698 -3.751 . . . . 0.0 112.02 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 35.8 tp -77.44 -28.35 52.44 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 119.095 -2.253 . . . . 0.0 109.276 174.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 15.6 tp -70.72 -28.33 64.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 115.652 -2.118 . . . . 0.0 113.848 170.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp -88.11 -28.66 21.15 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 121.901 2.137 . . . . 0.0 110.365 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -60.98 -28.67 69.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.863 1.665 . . . . 0.0 110.952 164.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.44 -7.22 48.68 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 122.98 1.371 . . . . 0.0 111.786 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -99.64 0.75 42.66 Favored 'General case' 0 N--CA 1.451 -0.402 1 O-C-N 115.968 -4.207 . . . . 0.0 110.89 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -70.69 -36.56 73.34 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 124.474 3.306 . . . . 0.0 111.402 175.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 49.8 p-10 -124.1 17.65 9.2 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 120.408 -1.432 . . . . 0.0 108.859 -171.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.292 4.2 m-20 56.31 32.55 20.64 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 116.939 2.2 . . . . 0.0 116.939 -175.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 21.9 mt -89.2 10.04 23.51 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.105 -2.872 . . . . 0.0 107.567 173.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -58.23 -47.03 84.8 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 123.011 2.641 . . . . 0.0 110.96 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.283 62.8 mt -67.55 -44.61 45.16 Favored Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-O 113.227 -3.273 . . . . 0.0 110.466 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -70.27 -20.3 32.6 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 CA-C-N 123.731 2.368 . . . . 0.0 111.629 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 26.5 tp -81.17 -30.02 34.5 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 122.088 2.222 . . . . 0.0 115.215 167.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 75.1 mt -65.34 -27.98 68.97 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 120.452 -1.405 . . . . 0.0 111.795 165.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -92.94 -0.64 57.18 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 126.913 2.085 . . . . 0.0 109.235 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 30.7 tp -100.63 -44.41 5.84 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 127.939 3.733 . . . . 0.0 115.106 167.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . 0.252 9.1 mmt -77.57 -36.47 52.04 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 117.51 -3.244 . . . . 0.0 114.284 -175.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.53 152.6 33.77 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 125.128 1.518 . . . . 0.0 111.787 -173.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 27.8 p -76.46 162.43 70.94 Favored Pre-proline 0 N--CA 1.452 -0.347 0 C-N-CA 127.024 2.129 . . . . 0.0 115.909 163.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -56.9 -37.29 98.62 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 CA-C-N 124.241 2.55 . . . . 0.0 116.72 -176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -79.61 -4.32 51.04 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 127.985 3.303 . . . . 0.0 114.871 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -97.38 -16.58 20.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.006 -1.452 . . . . 0.0 113.39 171.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -84.5 -44.62 13.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 117.613 -1.184 . . . . 0.0 111.02 167.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -57.4 -43.9 84.08 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 104.31 -2.478 . . . . 0.0 104.31 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.05 -40.61 64.96 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 118.62 -2.55 . . . . 0.0 110.887 -169.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . 0.409 HD22 ' CE2' ' D' ' 22' ' ' PHE . 3.3 mt -60.29 -45.63 92.68 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 125.427 2.537 . . . . 0.0 108.988 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.66 -43.26 96.36 Favored Glycine 0 CA--C 1.524 0.652 0 CA-C-O 116.781 -2.122 . . . . 0.0 111.667 173.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 60.6 m -60.37 -42.67 96.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.152 1.976 . . . . 0.0 112.982 173.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.309 96.0 mtt180 -57.61 -24.61 57.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 119.716 -1.865 . . . . 0.0 112.543 -172.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 98.5 t -63.8 -38.84 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 106.322 -1.732 . . . . 0.0 106.322 178.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 68.2 mtp180 -83.27 -15.53 49.87 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 123.855 1.788 . . . . 0.0 112.048 -171.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 32.6 mt -74.95 -47.23 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 C-N-CA 126.272 1.829 . . . . 0.0 106.522 169.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 35.1 t -61.16 -48.98 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 122.602 1.192 . . . . 0.0 113.553 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -49.83 -42.54 47.48 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 117.44 2.385 . . . . 0.0 117.44 173.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -69.4 -50.74 43.2 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 115.149 -2.357 . . . . 0.0 109.684 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 mt -66.06 -7.22 16.17 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 123.238 2.744 . . . . 0.0 117.464 177.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 80.1 mt -93.74 -33.25 13.69 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.449 2.3 . . . . 0.0 110.387 167.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 45.5 ttm180 -80.02 -38.7 31.47 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.54 22.23 74.95 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 122.672 3.829 . . . . 0.0 122.672 170.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -83.54 -16.08 46.84 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 116.665 -3.844 . . . . 0.0 115.763 165.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 35.4 mtt -77.96 130.13 36.16 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 117.708 -1.597 . . . . 0.0 113.095 173.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 81.7 p -80.8 168.31 18.94 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 124.065 0.853 . . . . 0.0 111.992 159.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -41.37 -43.63 2.57 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 130.023 3.329 . . . . 0.0 110.52 172.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -52.77 -41.62 64.25 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 118.05 -2.906 . . . . 0.0 112.263 -176.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -90.38 -38.3 13.41 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 131.592 3.957 . . . . 0.0 109.616 -169.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 62.8 mt -62.23 -21.49 65.2 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 120.133 -1.604 . . . . 0.0 111.689 174.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 31.7 tttp -80.46 -46.43 15.93 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 118.133 -1.427 . . . . 0.0 113.199 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -86.59 -54.0 4.65 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 119.02 -2.3 . . . . 0.0 112.506 -176.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -71.41 -32.97 69.01 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.327 -1.483 . . . . 0.0 113.67 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 mp -101.22 -3.24 29.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 116.447 2.017 . . . . 0.0 116.447 174.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 72.23 -142.17 32.46 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-O 117.112 -1.938 . . . . 0.0 112.698 159.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -99.48 -7.04 26.56 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 131.446 3.899 . . . . 0.0 114.169 164.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.38 -32.45 52.07 Favored Glycine 0 C--N 1.337 0.595 0 C-N-CA 126.778 2.132 . . . . 0.0 112.567 172.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 13.1 tt -54.29 -40.9 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-O 114.705 -2.569 . . . . 0.0 117.161 175.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.65 -34.28 77.85 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.148 1.53 . . . . 0.0 109.972 -178.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 31.5 m -60.25 -33.13 71.87 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 115.418 -2.229 . . . . 0.0 114.054 168.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 28.1 mm -88.97 -17.41 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 126.825 2.05 . . . . 0.0 111.492 -177.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.2 p -117.48 -19.73 9.35 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -165.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -119.23 151.03 39.1 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 118.494 -2.629 . . . . 0.0 114.609 -175.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.7 170.0 44.17 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 120.879 3.111 . . . . 0.0 120.879 -164.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 67.8 p -84.96 0.85 49.89 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 118.103 -2.998 . . . . 0.0 113.654 -168.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -117.98 5.93 12.13 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.74 2.416 . . . . 0.0 114.325 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 74.6 p -61.14 158.35 14.03 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 119.939 3.311 . . . . 0.0 119.939 175.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 15.7 tp -57.11 -28.18 62.45 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 120.016 -1.677 . . . . 0.0 115.41 -163.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -103.4 16.67 25.93 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -119.68 -7.78 10.02 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 128.181 2.592 . . . . 0.0 112.867 169.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.64 163.32 61.74 Favored Pre-proline 0 N--CA 1.451 -0.379 0 C-N-CA 128.167 2.587 . . . . 0.0 109.587 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -61.63 146.68 96.63 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.504 2.803 . . . . 0.0 110.506 -176.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 12.9 t -67.15 -42.34 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 CA-C-N 113.376 -1.738 . . . . 0.0 113.42 -178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pm0 -56.5 -12.05 1.56 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 160.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . 0.285 14.3 tp -93.36 -41.3 9.92 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.632 -3.168 . . . . 0.0 115.073 164.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -51.68 -34.1 36.87 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 129.243 3.017 . . . . 0.0 113.69 167.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -94.47 -42.13 9.01 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 116.795 -1.574 . . . . 0.0 108.148 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -58.14 -40.49 81.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 116.713 -1.613 . . . . 0.0 113.562 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 82.6 mt -62.61 -38.67 91.09 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 125.707 1.879 . . . . 0.0 110.696 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -71.68 -8.23 52.88 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 172.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -99.25 -5.72 29.35 Favored 'General case' 0 N--CA 1.447 -0.595 2 CA-C-N 127.383 4.628 . . . . 0.0 110.75 175.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 90.0 t -125.49 -42.97 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.675 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 8.3 mt -80.6 -15.24 57.11 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.95 -2.344 . . . . 0.0 109.786 -176.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 83.9 mt -136.42 15.76 3.19 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 116.84 2.163 . . . . 0.0 116.84 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 60.2 pttt . . . . . 0 N--CA 1.45 -0.436 0 O-C-N 118.441 -2.662 . . . . 0.0 116.409 172.779 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 79.1 p . . . . . 0 N--CA 1.449 -0.494 0 CA-C-O 113.934 -2.936 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.42 -27.97 46.68 Favored 'Trans proline' 0 N--CA 1.448 -1.148 1 C-N-CA 128.105 5.87 . . . . 0.0 113.973 -176.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -142.81 145.13 32.91 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 143.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 31.0 t -70.93 129.26 38.57 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 125.435 2.54 . . . . 0.0 110.829 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.45 -19.34 50.12 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 128.911 2.884 . . . . 0.0 108.485 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . 0.252 . . -67.61 -50.85 56.17 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 128.18 2.592 . . . . 0.0 110.285 167.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 17.1 mmt -63.27 -41.64 99.05 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 119.368 -2.082 . . . . 0.0 110.509 168.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.42 -33.62 72.77 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 120.588 1.54 . . . . 0.0 114.427 -176.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -51.89 -65.21 0.6 Allowed 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 119.157 -2.214 . . . . 0.0 114.114 158.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -52.05 -35.5 47.48 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 118.53 2.789 . . . . 0.0 118.53 -174.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -34.67 78.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 120.261 -1.524 . . . . 0.0 113.768 171.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -78.76 -25.01 44.39 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 112.394 -3.67 . . . . 0.0 108.148 165.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -72.0 -33.33 67.99 Favored 'General case' 0 N--CA 1.45 -0.465 1 CA-C-N 126.17 4.077 . . . . 0.0 115.351 177.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -70.03 -25.25 63.49 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.095 1.758 . . . . 0.0 112.09 174.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 24.9 t-105 -79.83 -52.34 8.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 127.264 2.852 . . . . 0.0 106.451 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 61.5 mt -49.77 -32.97 15.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 116.762 2.134 . . . . 0.0 116.762 167.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -73.07 -31.0 64.1 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.611 1.564 . . . . 0.0 114.011 176.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . 0.409 ' CE2' HD22 ' C' ' 51' ' ' LEU . 69.3 t80 -69.07 -46.43 67.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 126.656 2.472 . . . . 0.0 115.062 165.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 77.5 t -59.07 -36.92 65.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 120.255 1.389 . . . . 0.0 110.787 175.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . 0.326 20.8 t70 -61.26 -62.98 1.45 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 127.081 2.152 . . . . 0.0 111.7 169.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 13.2 tp -47.68 -42.98 26.09 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 115.493 -2.194 . . . . 0.0 110.352 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 60.1 tp -71.27 -50.96 27.34 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 127.765 2.426 . . . . 0.0 108.8 -174.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -56.35 -35.21 67.38 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.072 -2.268 . . . . 0.0 114.249 170.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -68.52 -40.46 80.77 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 116.962 -1.895 . . . . 0.0 110.597 173.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.76 -15.32 62.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 127.219 2.208 . . . . 0.0 113.578 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . 0.298 18.3 m-30 -75.26 -26.2 58.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 118.034 -2.916 . . . . 0.0 111.007 161.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -83.91 -23.95 30.97 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 124.288 3.222 . . . . 0.0 114.788 -168.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -103.28 4.74 36.89 Favored 'General case' 0 N--CA 1.451 -0.397 1 N-CA-C 121.863 4.024 . . . . 0.0 121.863 153.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.261 39.9 m-20 68.11 26.56 7.14 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.593 1.957 . . . . 0.0 113.762 170.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 91.1 mt -93.94 5.67 50.92 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.12 2.568 . . . . 0.0 113.294 175.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -52.79 59.83 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.531 2.332 . . . . 0.0 114.063 176.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.7 -45.91 66.79 Favored Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-O 115.808 -2.044 . . . . 0.0 108.758 -168.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.251 26.5 Cg_endo -64.4 -28.57 62.76 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 CA-C-N 122.428 1.903 . . . . 0.0 113.211 176.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 44.4 tp -68.2 -50.17 55.96 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 95.4 mt -58.28 -38.37 76.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.542 1.537 . . . . 0.0 114.128 166.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . 0.395 6.1 m-20 -68.01 -29.64 68.7 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 117.503 -1.237 . . . . 0.0 111.04 177.214 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 17.1 tp -75.29 -35.41 61.31 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 123.247 1.499 . . . . 0.0 113.439 172.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 7.4 mmm -87.24 -19.97 27.57 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 116.154 -2.218 . . . . 0.0 114.359 -176.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 93.8 mt -125.78 126.4 44.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.534 -2.604 . . . . 0.0 107.968 -172.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 61.8 p -62.67 157.97 54.34 Favored Pre-proline 0 N--CA 1.449 -0.524 0 CA-C-O 114.152 -2.832 . . . . 0.0 117.646 174.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -59.69 -37.42 87.67 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 CA-C-N 125.429 2.975 . . . . 0.0 117.221 -173.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -63.68 -31.81 73.1 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 120.44 -1.413 . . . . 0.0 113.327 169.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -73.15 -30.13 63.37 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 120.351 -1.468 . . . . 0.0 110.958 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . 0.465 ' HD2' ' CE2' ' C' ' 19' ' ' TRP . 77.9 mtm-85 -76.59 -41.17 47.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.933 2.093 . . . . 0.0 111.898 176.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -54.96 -60.44 3.37 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 125.379 1.472 . . . . 0.0 111.933 166.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.15 -43.23 66.85 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 73.3 mt -64.58 -53.92 40.22 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 126.163 2.165 . . . . 0.0 114.08 173.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -37.89 -36.93 0.36 Allowed Glycine 0 C--N 1.336 0.534 0 CA-C-N 120.224 1.374 . . . . 0.0 116.315 159.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 87.3 m -77.84 -35.94 50.55 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.017 2.127 . . . . 0.0 110.633 -176.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 22.7 mtt180 -71.87 -20.94 61.73 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 114.199 -2.81 . . . . 0.0 110.445 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 85.8 t -55.79 -46.63 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 116.285 1.957 . . . . 0.0 116.285 166.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -84.81 -26.52 27.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 126.689 2.493 . . . . 0.0 110.22 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 15.4 mt -70.31 -36.72 68.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 O-C-N 118.759 -2.463 . . . . 0.0 108.737 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 94.9 t -67.93 -32.62 57.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 118.097 2.629 . . . . 0.0 118.097 170.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -70.82 -45.22 64.96 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.407 -1.724 . . . . 0.0 111.667 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.18 -32.7 74.38 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.428 1.491 . . . . 0.0 110.045 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 19.7 mt -71.88 -17.09 62.14 Favored 'General case' 0 N--CA 1.447 -0.579 1 O-C-N 115.027 -4.796 . . . . 0.0 114.676 172.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -91.21 -32.11 15.91 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 124.249 1.976 . . . . 0.0 113.025 165.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -61.78 -52.79 62.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.733 -1.854 . . . . 0.0 113.029 170.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.63 26.23 69.61 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-O 115.362 -2.91 . . . . 0.0 118.792 174.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -99.75 -45.59 5.69 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 100.808 -3.775 . . . . 0.0 100.808 -166.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 5.1 mtm -88.88 56.57 3.78 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 23.7 p -90.36 -171.77 3.21 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 123.428 1.585 . . . . 0.0 113.629 -168.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.376 7.2 tp60 61.25 -82.64 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 121.3 3.815 . . . . 0.0 121.3 170.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 25.7 ttt85 -93.84 -31.96 14.14 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 126.247 2.217 . . . . 0.0 112.53 175.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -76.49 -44.22 36.27 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 -165.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.54 -44.42 69.2 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 172.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . 0.285 27.1 mtmt -72.96 -19.2 61.28 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 114.988 -2.434 . . . . 0.0 109.674 -177.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -123.9 -11.31 7.66 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 125.872 1.983 . . . . 0.0 111.812 -168.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 -103.85 -47.6 4.16 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 128.642 2.777 . . . . 0.0 109.816 176.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.21 -45.06 11.0 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 128.316 3.51 . . . . 0.0 105.448 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 76.73 -135.0 16.1 Favored Glycine 0 N--CA 1.444 -0.822 0 O-C-N 117.784 -3.072 . . . . 0.0 118.035 172.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.298 . . -78.28 36.83 0.25 Allowed 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 118.683 2.846 . . . . 0.0 118.683 -154.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.41 -15.64 2.7 Favored Glycine 0 N--CA 1.447 -0.594 1 C-N-CA 130.861 4.077 . . . . 0.0 113.626 168.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 3.9 tt -68.21 -15.45 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-O 114.091 -2.862 . . . . 0.0 116.217 -172.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -95.75 -27.32 15.31 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 127.183 2.802 . . . . 0.0 109.853 178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.3 m -52.46 -39.98 61.74 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 124.289 3.222 . . . . 0.0 111.65 159.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.259 34.2 mm -71.28 -45.03 72.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 C-N-CA 125.447 1.499 . . . . 0.0 112.237 -176.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 19.5 p -86.4 -24.02 25.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 115.465 -2.207 . . . . 0.0 114.606 174.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -90.95 168.23 11.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 126.479 3.038 . . . . 0.0 106.099 177.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.11 147.33 18.52 Favored Glycine 0 N--CA 1.447 -0.585 0 CA-C-O 125.102 2.501 . . . . 0.0 107.527 172.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 5.9 m -68.15 -27.99 66.91 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 118.155 -2.968 . . . . 0.0 114.742 -154.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -128.42 33.99 4.61 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 122.786 1.279 . . . . 0.0 110.956 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 90.7 p -73.72 -177.84 2.92 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 118.16 -2.837 . . . . 0.0 111.686 170.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.6 tt -69.89 -23.88 63.32 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 117.364 -3.335 . . . . 0.0 112.725 -164.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -60.56 -17.46 46.29 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 128.802 2.841 . . . . 0.0 111.265 167.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.09 -35.62 10.75 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.062 -1.923 . . . . 0.0 110.311 175.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 56.96 80.54 0.28 Allowed Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 119.909 3.3 . . . . 0.0 119.909 -175.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . 0.621 ' C ' ' H ' ' D' ' 95' ' ' GLU 0.413 67.2 Cg_exo 32.66 27.82 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.114 0 O-C-N 123.223 1.118 . . . . 0.0 114.399 46.197 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 47.9 t -51.17 -8.31 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 117.608 2.448 . . . . 0.0 117.608 174.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . 0.621 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -117.72 -21.85 8.29 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 113.262 -1.79 . . . . 0.0 110.506 -173.195 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 40.3 tp -63.77 -53.79 45.47 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.761 -2.066 . . . . 0.0 109.657 151.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -46.1 -60.86 2.03 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 120.523 3.527 . . . . 0.0 120.523 171.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -60.41 -18.17 48.97 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 127.358 2.263 . . . . 0.0 115.03 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 59.1 t90 -88.3 -42.43 12.24 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 170.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 42.0 mt -51.62 -46.36 63.61 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 170.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -60.88 -35.08 75.71 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.797 2.839 . . . . 0.0 109.96 -170.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.61 9.31 21.69 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 127.194 2.197 . . . . 0.0 116.544 177.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 88.6 t -125.24 -35.06 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 112.338 -2.21 . . . . 0.0 111.243 177.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 82.5 mt -97.7 -23.05 16.11 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.264 1.826 . . . . 0.0 114.376 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 60.0 mt -117.23 12.78 14.49 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 125.32 1.638 . . . . 0.0 107.021 -174.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -70.33 161.8 29.73 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 120.027 -1.67 . . . . 0.0 110.912 -174.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -62.67 -32.3 73.34 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 126.122 1.769 . . . . 0.0 111.928 -177.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 C--O 1.251 1.152 0 C-N-CA 127.823 2.449 . . . . 0.0 109.938 170.306 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 53.9 ttp . . . . . 0 N--CA 1.448 -0.535 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -38.2 90.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 126.786 2.554 . . . . 0.0 113.754 172.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -59.59 -48.42 81.73 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 115.127 -2.368 . . . . 0.0 109.112 170.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -67.48 -42.4 83.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 126.407 2.317 . . . . 0.0 110.981 -169.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 86.8 mmt-85 -66.01 -25.38 67.05 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 126.54 2.4 . . . . 0.0 114.504 175.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -82.1 -30.04 31.44 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.574 -0.704 . . . . 0.0 110.762 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -73.43 -27.97 61.72 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.813 -3.054 . . . . 0.0 112.039 169.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -63.18 -35.0 78.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 116.556 -3.84 . . . . 0.0 115.334 170.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -62.07 -53.61 53.1 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 128.151 3.834 . . . . 0.0 115.863 168.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.1 mt -67.59 -26.53 66.32 Favored 'General case' 0 N--CA 1.447 -0.609 1 O-C-N 112.933 -6.104 . . . . 0.0 116.977 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.415 HH12 ' CD ' ' B' ' 59' ' ' GLU . 67.0 ttt180 -49.33 -43.26 43.56 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 116.35 -1.786 . . . . 0.0 110.342 162.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -75.01 -23.21 58.18 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 114.954 -2.45 . . . . 0.0 115.764 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.3 t -81.65 -14.71 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 119.987 1.267 . . . . 0.0 113.177 171.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -88.88 -45.97 9.29 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 117.863 -3.023 . . . . 0.0 116.258 161.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.3 tp -54.18 -42.19 69.38 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 118.264 -2.772 . . . . 0.0 111.239 170.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.262 29.9 tp -67.12 -38.8 86.22 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.829 1.252 . . . . 0.0 114.092 175.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -67.47 -48.61 66.69 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 116.932 -1.508 . . . . 0.0 109.957 174.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.7 m-20 -59.06 -20.52 54.03 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 119.422 1.01 . . . . 0.0 113.586 174.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.29 -36.95 29.21 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -63.79 -44.58 92.94 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 119.314 -2.116 . . . . 0.0 112.538 168.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.77 -29.51 70.18 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.327 -1.797 . . . . 0.0 112.581 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -95.97 9.41 40.79 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.386 7.8 m-20 54.98 21.94 4.05 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 118.143 2.646 . . . . 0.0 118.143 -168.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.8 mt -89.47 9.15 27.53 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.27 -2.769 . . . . 0.0 107.143 172.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -55.63 -51.8 65.97 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.989 2.177 . . . . 0.0 113.587 -171.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.52 -53.36 52.47 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-O 115.84 -2.029 . . . . 0.0 114.221 177.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_exo -35.0 -53.02 0.69 Allowed 'Trans proline' 0 N--CA 1.448 -1.162 0 C-N-CA 122.563 2.175 . . . . 0.0 113.563 162.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.6 tp -74.87 -32.42 61.88 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.575 -3.203 . . . . 0.0 115.573 -171.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -63.43 -44.95 93.09 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 130.335 3.454 . . . . 0.0 114.782 171.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -60.76 -34.92 75.18 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 127.063 2.145 . . . . 0.0 108.995 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.0 tp -74.56 -42.87 58.03 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 120.517 3.525 . . . . 0.0 120.517 170.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 95.9 mmm -78.73 -21.5 47.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 114.745 -2.55 . . . . 0.0 116.857 177.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 mp -132.93 141.13 48.19 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.126 1.77 . . . . 0.0 108.041 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.3 p -80.39 153.76 74.03 Favored Pre-proline 0 N--CA 1.446 -0.628 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -55.68 -17.16 16.83 Favored 'Trans proline' 0 N--CA 1.452 -0.94 1 C-N-CA 125.594 4.196 . . . . 0.0 116.233 -173.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -76.88 -45.18 29.17 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 167.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . 0.279 42.1 mt-10 -74.7 -31.37 61.85 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 123.509 1.623 . . . . 0.0 109.997 -175.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -67.12 -54.41 21.64 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 119.361 -2.087 . . . . 0.0 115.374 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -47.75 -44.58 28.2 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.274 1.83 . . . . 0.0 112.738 163.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.81 -38.12 89.93 Favored 'General case' 0 N--CA 1.448 -0.561 1 O-C-N 114.787 -4.946 . . . . 0.0 114.962 174.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -62.77 -37.29 86.05 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 116.402 -1.761 . . . . 0.0 113.366 165.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.51 -36.83 48.27 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 119.999 2.76 . . . . 0.0 119.999 159.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.1 m -74.38 -40.62 61.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 120.996 2.398 . . . . 0.0 110.901 173.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.267 97.6 mtt180 -53.16 -36.11 60.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 67.3 t -63.18 -38.94 83.43 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 167.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.6 mtp180 -74.71 -25.74 59.35 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 114.726 -2.559 . . . . 0.0 110.759 175.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.251 63.2 mt -68.84 -51.09 48.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 115.514 -2.184 . . . . 0.0 108.857 167.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 53.9 t -62.38 -31.26 51.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 115.041 -2.409 . . . . 0.0 115.036 177.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -59.34 -55.46 34.44 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 127.454 2.971 . . . . 0.0 108.274 169.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -73.26 -14.86 61.41 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 122.658 2.481 . . . . 0.0 115.85 -178.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.9 mt -84.25 -27.38 27.95 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.318 1.847 . . . . 0.0 113.148 173.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.51 -18.37 41.78 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 117.934 -2.979 . . . . 0.0 118.336 165.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.6 ttm105 -82.22 -53.48 6.03 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 170.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.3 37.29 90.66 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 129.589 3.471 . . . . 0.0 107.727 170.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -86.32 -49.76 7.43 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 120.199 -1.765 . . . . 0.0 109.684 170.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 44.2 mtt -63.58 135.1 56.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 123.65 1.691 . . . . 0.0 109.527 165.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.2 p -99.37 -174.87 2.84 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 110.042 -3.254 . . . . 0.0 111.738 161.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -75.93 -33.49 59.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 117.359 -3.338 . . . . 0.0 109.132 -170.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.0 tpt85 -58.87 -26.97 64.74 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 131.067 3.747 . . . . 0.0 114.021 172.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -87.49 -42.93 12.42 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 120.283 -1.511 . . . . 0.0 111.971 173.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.31 -23.98 67.66 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -174.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.8 tptp -66.2 -40.1 90.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 113.958 -1.474 . . . . 0.0 110.864 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -83.64 -34.48 25.03 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 124.578 2.132 . . . . 0.0 112.456 179.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -85.25 -55.62 3.94 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.355 -2.716 . . . . 0.0 108.099 -170.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.0 mt -112.17 6.05 18.84 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 128.504 2.722 . . . . 0.0 114.343 -165.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.82 10.95 73.15 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-O 115.624 -2.765 . . . . 0.0 110.417 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.32 119.63 27.78 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 122.116 2.958 . . . . 0.0 118.312 -174.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.91 162.23 9.55 Favored Glycine 0 C--N 1.342 0.892 0 O-C-N 126.658 2.474 . . . . 0.0 118.396 159.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 52.1 mt -59.34 -45.84 92.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 131.535 3.934 . . . . 0.0 111.791 -172.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.33 -39.2 63.0 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.6 p -63.77 -41.35 97.99 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 114.785 -2.531 . . . . 0.0 117.364 169.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 31.0 mm -62.05 -37.34 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 125.931 3.968 . . . . 0.0 112.795 163.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . 0.369 54.3 m -64.67 -49.62 70.26 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.189 -2.194 . . . . 0.0 113.386 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -62.58 -53.47 54.23 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.248 -2.158 . . . . 0.0 107.653 173.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -41.75 -38.57 2.36 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 126.368 1.937 . . . . 0.0 115.609 175.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.4 m -77.03 -36.12 56.42 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 117.863 0.832 . . . . 0.0 110.274 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -68.44 -35.52 77.72 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 121.597 -0.69 . . . . 0.0 112.718 170.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 7.8 m -62.68 -38.26 89.64 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 173.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . 0.259 35.7 tp -68.28 -31.16 70.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.986 2.114 . . . . 0.0 113.926 174.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -84.35 -33.61 23.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 119.75 1.159 . . . . 0.0 112.434 171.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . 0.261 . . -71.48 -18.4 62.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 117.485 2.402 . . . . 0.0 117.485 166.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.56 136.76 92.47 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 158.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.5 153.03 79.29 Favored 'Trans proline' 0 N--CA 1.446 -1.288 0 CA-C-O 126.836 2.765 . . . . 0.0 113.831 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.5 m -61.8 -26.17 39.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-O 115.344 -2.265 . . . . 0.0 111.461 -169.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.266 22.9 pm0 -69.47 -32.45 71.37 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 123.414 2.824 . . . . 0.0 110.108 175.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 4.6 tp -76.13 -38.24 57.06 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 124.288 3.222 . . . . 0.0 113.162 173.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 56.1 mtm-85 -56.7 -37.06 70.39 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.57 1.948 . . . . 0.0 115.126 161.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -72.41 -31.19 65.32 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 121.748 2.067 . . . . 0.0 112.304 170.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -72.59 -50.07 27.92 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 115.586 -2.15 . . . . 0.0 116.24 172.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.27 -21.25 59.84 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 122.326 2.33 . . . . 0.0 110.912 -170.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -77.96 -15.39 59.02 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.691 1.996 . . . . 0.0 112.695 176.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -92.89 -33.27 14.28 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 121.854 2.116 . . . . 0.0 110.542 166.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . 0.411 47.0 t -84.16 -26.06 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-O 115.289 -2.291 . . . . 0.0 116.546 -168.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.7 mt -107.56 -3.99 18.8 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 123.692 1.71 . . . . 0.0 113.537 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 75.4 mt -133.45 8.64 3.95 Favored 'General case' 0 N--CA 1.447 -0.584 1 O-C-N 113.324 -5.86 . . . . 0.0 111.478 -156.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.6 mtpt . . . . . 0 N--CA 1.452 -0.339 0 CA-C-N 122.257 2.298 . . . . 0.0 115.668 178.952 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 122.651 1.215 . . . . 0.0 108.713 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . 0.295 42.6 mtt -65.13 -51.22 62.52 Favored 'General case' 0 N--CA 1.444 -0.751 0 O-C-N 121.523 -0.735 . . . . 0.0 111.226 176.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.59 -40.94 69.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.392 1.077 . . . . 0.0 113.834 177.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -70.74 -32.4 69.56 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 126.912 2.085 . . . . 0.0 110.68 177.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -73.93 -41.18 62.43 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 118.396 -2.69 . . . . 0.0 109.488 178.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -65.55 -42.51 91.78 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 169.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -63.8 -36.7 84.77 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 167.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -63.36 -40.74 98.09 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 117.307 -1.757 . . . . 0.0 113.476 170.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -53.17 -49.2 67.14 Favored 'General case' 0 N--CA 1.452 -0.36 1 O-C-N 115.79 -4.319 . . . . 0.0 111.617 172.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -52.64 -49.08 65.87 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 127.677 2.391 . . . . 0.0 110.631 171.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 79.4 mt -69.42 -30.32 68.23 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 116.175 -4.078 . . . . 0.0 109.677 -178.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -63.07 -26.43 68.83 Favored 'General case' 0 N--CA 1.453 -0.319 1 CA-C-N 126.057 4.026 . . . . 0.0 113.427 171.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -76.09 -46.12 30.56 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.186 1.794 . . . . 0.0 111.958 174.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 18.7 t -64.91 -37.81 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 119.941 -1.725 . . . . 0.0 106.417 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -64.36 -50.24 68.49 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.504 -1.998 . . . . 0.0 108.635 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 39.0 tp -60.67 -39.3 87.91 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 120.073 -1.642 . . . . 0.0 111.627 -174.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 23.8 tp -75.97 -35.94 59.45 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 119.449 -2.032 . . . . 0.0 112.375 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -48.36 -39.72 23.14 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 124.465 2.078 . . . . 0.0 112.988 168.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -89.06 -23.48 22.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 118.93 -2.357 . . . . 0.0 109.987 -176.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.55 -26.61 66.39 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-O 116.092 -1.909 . . . . 0.0 109.213 174.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -76.38 -30.32 57.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 127.15 2.18 . . . . 0.0 112.509 175.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -70.71 -26.25 63.32 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 165.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -105.76 -4.86 20.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 124.678 2.18 . . . . 0.0 110.897 -175.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.278 7.4 m-20 57.21 42.34 25.55 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 116.522 -3.861 . . . . 0.0 111.797 -175.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 22.9 mt -120.31 13.46 11.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.842 2.457 . . . . 0.0 112.619 174.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -65.07 -39.91 93.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 112.78 -3.486 . . . . 0.0 114.375 174.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 11.3 mt -55.04 -48.28 96.43 Favored Pre-proline 0 N--CA 1.452 -0.346 0 CA-C-N 121.899 2.136 . . . . 0.0 112.857 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.302 58.4 Cg_endo -66.77 -40.76 12.08 Favored 'Trans proline' 0 N--CA 1.445 -1.352 0 O-C-N 117.581 -1.852 . . . . 0.0 114.787 172.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 24.0 tp -52.66 -40.71 63.12 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 125.581 1.801 . . . . 0.0 109.722 174.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 68.8 mt -80.65 -36.64 32.23 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.133 -2.854 . . . . 0.0 110.335 -171.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -60.88 -42.0 97.1 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 173.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 46.4 tp -67.41 -45.11 77.11 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.866 1.266 . . . . 0.0 111.095 -175.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 14.9 mmt -75.1 -34.4 61.72 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.778 2.031 . . . . 0.0 115.415 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 33.7 mt -128.1 122.69 32.67 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 125.235 1.414 . . . . 0.0 109.218 -170.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 35.7 p -75.32 162.6 72.23 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 126.331 1.852 . . . . 0.0 114.978 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . 0.274 9.7 Cg_endo -67.8 -21.28 44.78 Favored 'Trans proline' 0 N--CA 1.446 -1.31 0 CA-C-N 125.136 2.87 . . . . 0.0 116.244 -164.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.61 -37.63 73.88 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.552 1.941 . . . . 0.0 111.543 169.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -72.62 -35.24 67.78 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 173.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 45.9 mtm-85 -66.61 -37.3 84.58 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 116.209 -1.853 . . . . 0.0 112.715 169.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.46 -46.75 87.87 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 126.3 2.25 . . . . 0.0 115.662 165.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.2 -30.11 66.0 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 116.734 -1.603 . . . . 0.0 109.307 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 17.7 mt -75.42 -28.43 59.4 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 121.238 1.836 . . . . 0.0 113.989 174.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.41 -41.47 77.47 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 125.504 1.526 . . . . 0.0 111.971 172.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 27.2 m -76.44 -37.65 56.69 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.011 -0.995 . . . . 0.0 112.119 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -58.92 -31.14 68.39 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 124.874 1.359 . . . . 0.0 108.797 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 91.9 t -59.16 -49.22 84.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 O-C-N 116.895 -3.628 . . . . 0.0 115.279 167.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -56.51 -32.92 65.53 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 116.94 -3.6 . . . . 0.0 109.432 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 62.9 mt -72.04 -44.59 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-O 115.912 -1.994 . . . . 0.0 114.746 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 54.7 t -66.88 -41.69 87.99 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 119.638 1.108 . . . . 0.0 110.439 176.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . 0.415 ' CD ' HH12 ' A' ' 21' ' ' ARG . 36.5 tt0 -52.47 -41.07 63.02 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 169.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -82.78 -25.19 33.0 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 117.579 2.437 . . . . 0.0 117.579 173.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 14.0 mt -48.79 -44.74 39.31 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 120.332 1.424 . . . . 0.0 113.657 154.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 44.3 mt -85.73 -2.61 58.39 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 115.158 -2.353 . . . . 0.0 114.426 -178.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 ttm105 -93.34 -71.7 0.64 Allowed 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 125.634 1.834 . . . . 0.0 114.701 176.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.16 55.75 1.92 Allowed Glycine 0 CA--C 1.525 0.702 0 CA-C-N 114.3 -1.318 . . . . 0.0 113.338 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -137.83 -8.3 1.62 Allowed 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 127.656 2.382 . . . . 0.0 115.441 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 40.4 mtt -89.82 133.37 34.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 167.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -62.27 160.41 13.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 127.883 2.473 . . . . 0.0 116.287 156.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -50.52 -43.29 55.87 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.576 -1.202 . . . . 0.0 111.237 172.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -58.88 -45.4 90.31 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 126.885 2.616 . . . . 0.0 114.281 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -67.12 -46.22 74.79 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.092 2.957 . . . . 0.0 109.998 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 34.3 mt -48.77 -56.11 9.58 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.927 1.691 . . . . 0.0 109.014 171.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 34.7 tptt -66.9 -31.74 72.53 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 115.477 1.658 . . . . 0.0 115.477 -174.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -126.21 0.73 7.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 120.919 1.69 . . . . 0.0 112.914 -167.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -124.1 -6.4 7.79 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.77 1.228 . . . . 0.0 114.143 171.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 33.1 mt -127.88 -10.98 5.46 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 129.395 3.078 . . . . 0.0 117.051 165.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 79.45 11.87 84.4 Favored Glycine 0 CA--C 1.524 0.63 0 C-N-CA 126.453 1.978 . . . . 0.0 117.383 178.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.92 114.32 28.32 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 129.956 3.302 . . . . 0.0 115.038 -164.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.54 171.56 36.57 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 127.205 2.336 . . . . 0.0 111.736 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 mt -48.98 -47.2 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 131.603 3.961 . . . . 0.0 111.856 172.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.1 -55.77 16.86 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.997 -2.314 . . . . 0.0 114.211 176.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 27.2 m -46.18 -45.44 16.79 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 118.178 2.658 . . . . 0.0 118.178 165.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 18.4 mm -67.34 -45.42 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 O-C-N 116.909 -3.62 . . . . 0.0 113.896 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 5.7 m -47.75 -40.27 20.14 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 169.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -74.39 -37.74 63.33 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.853 2.461 . . . . 0.0 113.703 -176.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -72.73 -37.31 57.57 Favored Glycine 0 N--CA 1.447 -0.587 0 O-C-N 119.01 -2.306 . . . . 0.0 116.67 165.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 37.9 m -64.4 -42.06 96.32 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 119.097 -2.413 . . . . 0.0 113.834 176.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -61.8 -37.47 84.49 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 120.757 -1.214 . . . . 0.0 112.328 168.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 37.2 m -75.69 -30.2 59.27 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.913 0.863 . . . . 0.0 113.025 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.83 -44.02 94.28 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 114.917 -2.468 . . . . 0.0 113.182 164.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 61.1 mttt -51.36 -45.62 62.46 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 127.109 2.755 . . . . 0.0 111.725 169.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.81 -30.55 65.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -176.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.76 155.06 92.39 Favored Pre-proline 0 N--CA 1.45 -0.44 0 C-N-CA 128.055 2.542 . . . . 0.0 113.221 -171.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . 0.271 23.9 Cg_exo -63.38 156.28 57.1 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 O-C-N 117.184 -2.061 . . . . 0.0 116.424 176.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -61.89 -40.83 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 O-C-N 118.41 -2.682 . . . . 0.0 113.791 170.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.325 23.0 pm0 -61.02 -26.07 67.35 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 114.08 -2.867 . . . . 0.0 114.984 170.161 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.3 tp -84.89 -44.58 13.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 122.311 2.323 . . . . 0.0 105.597 178.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 23.2 mtm-85 -64.5 -27.13 68.76 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 116.347 -3.971 . . . . 0.0 116.696 -177.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -75.2 -33.31 61.4 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.24 0.543 . . . . 0.0 111.657 178.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -69.74 -52.56 24.29 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.976 2.11 . . . . 0.0 105.886 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.3 mt -65.07 -43.68 91.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.697 0.799 . . . . 0.0 112.043 -172.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -59.86 -36.29 76.56 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.838 0.455 . . . . 0.0 110.245 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -68.83 -46.22 69.11 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 116.226 1.936 . . . . 0.0 116.226 171.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.7 t -71.16 -57.57 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 113.905 -2.95 . . . . 0.0 112.362 174.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.84 -18.81 63.46 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 126.544 2.402 . . . . 0.0 113.616 -163.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 31.4 mt -97.09 -36.27 10.54 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 116.941 -3.599 . . . . 0.0 109.236 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -88.3 19.79 3.59 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 116.37 -3.956 . . . . 0.0 109.508 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . 0.363 69.0 m -87.94 -25.62 23.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 131.289 3.836 . . . . 0.0 114.26 160.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 . . . . . 0 C--O 1.25 1.088 0 O-C-N 116.511 -3.868 . . . . 0.0 112.132 166.991 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ttt . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.12 128.22 33.01 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 126.006 2.066 . . . . 0.0 110.668 -176.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -122.76 135.73 54.65 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 126.392 2.307 . . . . 0.0 113.277 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -120.58 156.38 31.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.078 0.951 . . . . 0.0 111.466 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -129.85 165.68 31.63 Favored Pre-proline 0 N--CA 1.45 -0.438 1 C-N-CA 132.367 4.267 . . . . 0.0 113.214 169.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -81.6 -20.57 6.73 Favored 'Trans proline' 0 N--CA 1.449 -1.107 0 N-CA-C 116.175 1.567 . . . . 0.0 116.175 -179.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -138.96 160.61 39.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.891 1.994 . . . . 0.0 108.951 170.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 28.0 t -151.58 124.45 8.58 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 129.46 3.104 . . . . 0.0 110.405 176.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.68 -26.5 61.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 124.183 1.944 . . . . 0.0 113.188 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.87 -37.42 14.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 117.424 -3.298 . . . . 0.0 117.036 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 64.3 mtt -61.2 -33.85 74.14 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 126.27 2.232 . . . . 0.0 111.167 163.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.9 -42.65 99.86 Favored 'General case' 0 N--CA 1.446 -0.664 1 O-C-N 115.61 -4.431 . . . . 0.0 115.279 168.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -75.23 -25.73 58.36 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 120.283 -1.511 . . . . 0.0 113.945 175.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -62.03 -37.17 83.92 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 120.765 -1.209 . . . . 0.0 109.48 160.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -36.6 84.64 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 119.732 -1.855 . . . . 0.0 112.92 174.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -68.61 -33.31 73.83 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 124.302 2.001 . . . . 0.0 116.327 174.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -77.35 -24.12 50.77 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 129.918 3.287 . . . . 0.0 117.038 173.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -70.52 -36.56 73.81 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 125.092 2.377 . . . . 0.0 112.611 161.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 9.4 t-105 -63.45 -58.3 7.48 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 118.555 -2.59 . . . . 0.0 112.628 167.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 20.9 mt -56.63 -29.21 61.96 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 124.573 3.351 . . . . 0.0 109.772 -176.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -82.94 -23.92 33.26 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 122.007 2.185 . . . . 0.0 113.238 -177.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -62.6 -40.31 96.52 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 114.482 -2.675 . . . . 0.0 110.294 162.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.37 -49.94 67.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 116.002 -1.951 . . . . 0.0 110.202 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -60.52 -39.65 88.6 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 122.411 2.368 . . . . 0.0 115.902 176.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 63.7 tp -65.1 -41.63 94.78 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 127.291 2.236 . . . . 0.0 107.556 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 12.0 tp -74.1 -43.77 56.4 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 122.545 1.164 . . . . 0.0 111.682 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -57.09 -28.93 63.07 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 164.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . 0.277 91.7 m-20 -79.02 -24.1 43.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 129.364 3.066 . . . . 0.0 113.812 176.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.24 -6.21 54.25 Favored 'General case' 0 N--CA 1.448 -0.555 1 O-C-N 115.607 -4.433 . . . . 0.0 112.018 176.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -76.09 -21.93 56.16 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.533 171.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -65.08 -23.92 67.3 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 120.287 -1.508 . . . . 0.0 111.342 177.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -138.43 7.73 2.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 119.817 -1.802 . . . . 0.0 113.107 -163.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 50.8 28.16 3.49 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.684 2.476 . . . . 0.0 117.684 -168.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 50.1 mt -88.86 19.12 4.25 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 118.873 0.76 . . . . 0.0 110.302 164.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -64.94 -46.33 82.04 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 119.243 -2.161 . . . . 0.0 115.43 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.333 71.6 mt -68.86 -41.93 22.01 Favored Pre-proline 0 N--CA 1.452 -0.358 0 C-N-CA 127.685 2.394 . . . . 0.0 113.936 169.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_exo -58.93 -48.83 13.0 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 C-N-CA 121.668 1.579 . . . . 0.0 115.569 170.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 66.3 tp -53.86 -45.56 71.02 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 118.132 -2.855 . . . . 0.0 115.05 167.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 20.5 mt -68.24 -26.42 65.68 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 118.938 -1.105 . . . . 0.0 112.986 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -77.85 -39.13 44.48 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 127.782 2.433 . . . . 0.0 108.159 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 38.7 tp -56.71 -48.03 78.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 125.217 2.437 . . . . 0.0 111.835 167.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 7.8 mmt -84.03 -15.48 47.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 112.194 -3.765 . . . . 0.0 113.721 -167.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mp -135.34 157.53 46.66 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 126.724 2.515 . . . . 0.0 114.662 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 34.7 p -76.44 151.78 83.28 Favored Pre-proline 0 N--CA 1.448 -0.555 0 CA-C-O 114.023 -2.894 . . . . 0.0 111.32 161.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -63.46 -27.23 70.45 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 CA-C-N 123.797 2.392 . . . . 0.0 112.177 179.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.05 -44.0 74.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 115.713 -2.089 . . . . 0.0 110.922 170.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -71.13 -28.57 64.39 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 116.465 -1.731 . . . . 0.0 110.754 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 88.1 mtm-85 -71.61 -46.49 59.02 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 121.722 2.056 . . . . 0.0 109.267 176.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.15 -30.71 71.81 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.851 -1.78 . . . . 0.0 114.237 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.31 -50.4 63.75 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.786 2.434 . . . . 0.0 110.095 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 9.2 mt -65.81 -40.28 91.72 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 122.147 2.249 . . . . 0.0 108.676 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.9 -38.57 94.29 Favored Glycine 0 C--N 1.337 0.605 0 O-C-N 117.186 -3.446 . . . . 0.0 115.706 171.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 20.8 m -66.65 -38.69 87.39 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 114.341 -2.742 . . . . 0.0 110.59 169.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -61.71 -29.91 70.42 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 121.109 1.777 . . . . 0.0 112.642 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 91.2 t -69.5 -43.07 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 123.113 2.688 . . . . 0.0 108.812 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -70.15 -28.8 65.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 113.144 -3.312 . . . . 0.0 113.065 174.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 9.4 mt -56.31 -57.61 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 124.852 3.478 . . . . 0.0 112.168 157.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 57.5 t -57.11 -40.48 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 CA-C-O 117.17 -1.395 . . . . 0.0 111.429 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -61.4 -45.82 92.72 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.719 2.008 . . . . 0.0 106.166 178.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -68.28 -32.96 73.5 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 120.309 1.413 . . . . 0.0 111.453 -176.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 22.4 mt -76.58 -22.89 53.64 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 124.564 1.146 . . . . 0.0 109.359 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 80.7 mt -80.17 -44.18 20.28 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 117.509 -3.244 . . . . 0.0 113.713 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttm105 -57.0 -39.26 74.35 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.492 2.317 . . . . 0.0 115.664 170.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 57.77 26.83 58.26 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 126.81 2.148 . . . . 0.0 117.269 171.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -97.07 -7.37 32.96 Favored 'General case' 0 N--CA 1.449 -0.495 1 CA-C-O 111.474 -4.108 . . . . 0.0 108.569 170.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 50.6 mtt -69.55 147.68 50.45 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 125.864 3.938 . . . . 0.0 116.621 167.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 88.6 p -106.8 168.2 9.35 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.352 1.461 . . . . 0.0 107.706 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -46.53 -30.15 2.1 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 176.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 29.9 ttp-105 -59.01 -55.01 40.62 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 126.22 2.2 . . . . 0.0 113.686 176.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . 0.319 1.7 mt-10 -70.27 -40.66 74.24 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 -174.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 22.5 mt -53.43 -35.63 60.65 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 119.073 -2.267 . . . . 0.0 112.469 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -91.32 -30.68 16.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.895 2.078 . . . . 0.0 112.747 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -97.83 -59.17 1.82 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 119.514 1.052 . . . . 0.0 111.22 -171.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -70.31 -42.18 72.32 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 116.559 -2.056 . . . . 0.0 113.804 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mp -90.0 -15.42 31.93 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 127.629 2.371 . . . . 0.0 112.427 -172.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 60.93 -105.47 0.86 Allowed Glycine 0 N--CA 1.448 -0.535 0 CA-C-O 116.711 -2.161 . . . . 0.0 116.753 168.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.24 -17.44 2.68 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 129.887 3.275 . . . . 0.0 112.839 -169.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.54 -13.82 71.62 Favored Glycine 0 N--CA 1.45 -0.399 0 O-C-N 118.177 -2.827 . . . . 0.0 114.236 172.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 3.9 tt -56.48 -39.86 64.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 CA-C-N 114.765 -0.718 . . . . 0.0 109.949 174.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.1 -12.77 59.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 126.916 3.246 . . . . 0.0 112.585 -170.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 11.0 m -69.69 -46.45 66.0 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 116.927 -3.608 . . . . 0.0 107.191 166.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 46.4 mm -66.96 -40.18 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 N-CA-C 116.781 2.141 . . . . 0.0 116.781 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 40.5 p -100.69 -17.77 16.83 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -167.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 60.4 mtp85 -103.62 161.51 13.84 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 114.819 -2.515 . . . . 0.0 115.288 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.33 158.51 30.0 Favored Glycine 0 CA--C 1.524 0.618 0 O-C-N 126.053 2.095 . . . . 0.0 117.838 -177.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 88.9 p -63.85 4.83 0.26 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 118.135 2.642 . . . . 0.0 118.135 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -115.78 -5.25 12.09 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 3.2 p -68.21 177.12 2.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.287 1.835 . . . . 0.0 113.233 -154.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 15.3 tp -58.05 -26.49 62.55 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 116.272 -1.823 . . . . 0.0 111.703 -167.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -106.14 7.63 31.75 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 113.933 -2.937 . . . . 0.0 111.73 176.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -111.91 -5.74 14.32 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 129.976 3.31 . . . . 0.0 113.353 167.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.79 151.09 89.78 Favored Pre-proline 0 N--CA 1.452 -0.334 0 C-N-CA 127.076 2.15 . . . . 0.0 115.449 171.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -55.69 139.02 82.82 Favored 'Trans proline' 0 N--CA 1.448 -1.193 0 CA-C-N 120.324 1.151 . . . . 0.0 112.238 174.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 99.0 t -72.22 -30.94 37.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 124.714 1.206 . . . . 0.0 108.266 -166.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -60.75 -19.7 59.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.956 2.947 . . . . 0.0 118.956 161.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . 0.403 ' HA ' HD13 ' D' ' 34' ' ' LEU . 43.8 tp -84.02 -47.25 11.15 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.322 -0.861 . . . . 0.0 109.53 168.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 76.8 mtp180 -56.85 -49.9 74.06 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 115.894 -2.003 . . . . 0.0 109.812 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -53.09 -50.61 64.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.026 1.73 . . . . 0.0 109.294 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 61.0 t90 -75.1 -33.21 61.6 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.817 1.247 . . . . 0.0 112.271 -165.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 82.3 mt -63.49 -26.07 68.55 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 116.635 -3.791 . . . . 0.0 114.657 166.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -72.97 -27.39 61.79 Favored 'General case' 0 N--CA 1.45 -0.436 1 O-C-N 114.549 -5.094 . . . . 0.0 108.041 169.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -80.3 -24.17 40.18 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . 0.317 99.5 t -97.95 -28.18 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 124.73 3.423 . . . . 0.0 116.382 177.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 18.6 mt -110.52 -29.05 8.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.268 1.827 . . . . 0.0 112.973 -172.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 71.3 mt -121.0 30.54 6.81 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 41.4 pttt . . . . . 0 N--CA 1.45 -0.456 0 C-N-CA 126.578 1.951 . . . . 0.0 113.168 162.856 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 90.9 p . . . . . 0 N--CA 1.45 -0.439 0 CA-C-O 116.618 -1.658 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -79.92 -44.03 0.12 Allowed 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 124.652 3.568 . . . . 0.0 112.112 155.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -152.66 140.24 19.79 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 155.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 36.0 t -67.13 121.22 15.14 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 109.805 -3.361 . . . . 0.0 110.849 -173.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . 0.263 . . -56.97 -21.26 28.98 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 117.711 -1.138 . . . . 0.0 110.659 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.5 -29.18 17.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.889 2.476 . . . . 0.0 113.556 -172.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.3 21.7 mmt -64.95 -37.48 87.79 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.888 -0.577 . . . . 0.0 112.189 158.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.81 -35.14 80.15 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 117.147 2.277 . . . . 0.0 117.147 173.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -60.73 -58.25 9.25 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.957 -2.965 . . . . 0.0 108.233 159.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -47.3 -38.38 12.52 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 117.907 -2.995 . . . . 0.0 118.815 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.39 5.8 49.23 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 131.408 3.883 . . . . 0.0 115.074 -173.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -104.93 -22.62 13.11 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 117.046 -1.454 . . . . 0.0 107.949 146.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -77.29 -34.08 55.61 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 123.23 2.741 . . . . 0.0 112.294 -176.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -66.5 -15.3 63.27 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 171.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -82.96 -37.18 24.45 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 167.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.17 -15.34 62.93 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 114.501 -2.666 . . . . 0.0 111.095 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -65.15 -49.58 69.32 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 114.012 -2.899 . . . . 0.0 105.714 164.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -70.05 -38.76 75.89 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 122.177 2.262 . . . . 0.0 111.207 -172.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 20.7 t -66.19 -34.84 72.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 C-N-CA 128.317 2.647 . . . . 0.0 111.032 171.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -75.31 -37.83 60.6 Favored 'General case' 0 N--CA 1.448 -0.539 1 O-C-N 115.302 -4.624 . . . . 0.0 115.46 167.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 tp -69.09 -33.07 72.94 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 24.8 tp -73.85 -46.07 47.24 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 121.426 -0.796 . . . . 0.0 110.066 -177.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -58.03 -46.05 85.94 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 126.222 1.809 . . . . 0.0 112.097 172.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -52.35 -30.44 28.63 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 166.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 -29.24 30.87 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.436 1.094 . . . . 0.0 113.369 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -50.54 -40.57 52.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 125.264 2.459 . . . . 0.0 111.246 167.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -75.44 -30.18 59.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 118.834 -2.416 . . . . 0.0 113.744 -158.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 53.3 p-10 -111.18 14.17 21.79 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 128.922 3.889 . . . . 0.0 118.448 168.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 52.89 54.82 9.88 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' C' ' 96' ' ' LEU . 14.9 mt -121.33 5.42 10.22 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 129.305 3.042 . . . . 0.0 110.749 171.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -61.89 2.26 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 116.428 -1.748 . . . . 0.0 112.071 174.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 4.2 mt -52.15 -45.74 93.8 Favored Pre-proline 0 N--CA 1.45 -0.445 0 CA-C-O 115.183 -2.342 . . . . 0.0 115.22 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.24 -20.55 14.39 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 114.714 -3.057 . . . . 0.0 114.159 172.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 12.0 tp -68.01 -35.73 78.78 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 124.126 3.148 . . . . 0.0 113.18 169.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 24.3 mt -71.05 -36.37 72.29 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 123.227 1.489 . . . . 0.0 107.15 -175.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 35.3 m-20 -78.58 -26.99 45.6 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.863 1.792 . . . . 0.0 112.688 -175.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -68.02 -48.45 65.65 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.143 166.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 65.1 mmm -65.47 -34.63 78.74 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 114.892 -2.48 . . . . 0.0 114.858 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -115.16 144.76 43.18 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 122.231 2.287 . . . . 0.0 116.798 -172.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 70.1 p -67.62 148.78 98.54 Favored Pre-proline 0 N--CA 1.452 -0.37 0 O-C-N 117.161 -3.462 . . . . 0.0 110.035 167.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -35.79 -54.15 0.81 Allowed 'Trans proline' 0 N--CA 1.451 -1.009 1 C-N-CA 127.072 5.181 . . . . 0.0 113.438 171.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -71.37 -9.63 58.47 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 -178.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . 0.251 38.8 mt-10 -86.43 -41.63 14.28 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 120.398 -1.439 . . . . 0.0 112.321 163.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -59.88 -36.5 77.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 125.216 2.436 . . . . 0.0 114.455 172.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -74.43 -40.19 62.12 Favored 'General case' 0 N--CA 1.451 -0.412 1 C-N-CA 134.76 5.224 . . . . 0.0 108.404 -175.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.28 -41.4 63.65 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 116.605 -3.809 . . . . 0.0 112.736 171.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 50.8 mt -59.65 -44.87 93.38 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 119.833 -1.792 . . . . 0.0 107.904 178.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.22 -33.38 85.77 Favored Glycine 0 CA--C 1.523 0.576 0 C-N-CA 118.563 -1.78 . . . . 0.0 114.884 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 97.6 m -78.96 -24.03 44.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 119.577 -2.131 . . . . 0.0 111.156 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 27.0 mtt180 -75.26 -20.67 59.05 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 117.579 -1.649 . . . . 0.0 113.105 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 99.3 t -49.56 -61.02 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 114.731 -2.556 . . . . 0.0 115.763 159.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -65.27 -26.07 67.92 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 126.187 2.179 . . . . 0.0 113.515 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 36.5 mt -67.51 -52.09 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 129.711 3.204 . . . . 0.0 107.831 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 55.0 t -54.49 -39.62 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 125.984 1.714 . . . . 0.0 115.618 165.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -58.1 -60.73 3.28 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 122.98 1.371 . . . . 0.0 114.005 176.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -57.24 -37.86 72.93 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 128.725 2.81 . . . . 0.0 110.525 176.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 7.2 mt -61.06 -41.34 96.44 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 115.857 -2.337 . . . . 0.0 114.262 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 31.5 mt -67.84 -40.62 83.68 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.521 2.328 . . . . 0.0 110.91 170.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -63.9 -42.6 97.39 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 115.214 1.561 . . . . 0.0 115.214 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 52.0 61.2 6.73 Favored Glycine 0 CA--C 1.521 0.443 0 O-C-N 116.841 -3.662 . . . . 0.0 116.019 -173.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -139.31 -37.63 0.5 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 121.005 2.402 . . . . 0.0 106.972 -174.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 49.1 mtt -93.08 52.68 1.84 Allowed 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 118.9 -2.375 . . . . 0.0 113.724 159.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 31.1 p -95.01 -174.85 3.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 121.405 3.854 . . . . 0.0 121.405 -172.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.25 4.4 tp-100 56.3 -76.24 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 129.101 2.96 . . . . 0.0 115.431 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 49.8 ttt85 -88.25 -34.95 17.56 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 121.565 1.984 . . . . 0.0 114.137 169.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -74.67 -51.84 13.27 Favored 'General case' 0 N--CA 1.446 -0.674 0 O-C-N 118.829 -2.419 . . . . 0.0 116.504 -157.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -35.66 -47.97 0.5 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.517 1.127 . . . . 0.0 112.757 161.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -68.91 -27.24 65.59 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 116.948 2.203 . . . . 0.0 116.948 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -105.32 -31.73 8.93 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 124.796 2.236 . . . . 0.0 112.823 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -87.67 -36.45 17.43 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.537 2.051 . . . . 0.0 116.537 -172.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.19 -36.31 5.86 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.714 2.006 . . . . 0.0 108.638 175.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 59.61 -113.01 4.81 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 118.885 2.314 . . . . 0.0 118.885 167.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.57 2.91 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 120.94 3.681 . . . . 0.0 120.94 -159.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -110.94 -7.2 25.56 Favored Glycine 0 CA--C 1.526 0.774 0 O-C-N 119.736 -1.852 . . . . 0.0 111.512 170.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 4.9 tt -73.91 -19.43 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 118.839 -2.566 . . . . 0.0 114.3 -166.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -97.34 -11.85 23.53 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 119.589 1.086 . . . . 0.0 109.466 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.2 m -79.54 -55.43 5.05 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 106.376 -1.712 . . . . 0.0 106.376 161.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.327 20.4 mm -58.18 -26.98 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 118.141 -2.849 . . . . 0.0 114.599 176.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 30.9 p -111.08 8.55 21.85 Favored 'General case' 0 N--CA 1.451 -0.401 1 N-CA-C 123.34 4.57 . . . . 0.0 123.34 177.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -112.03 -144.58 0.39 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 114.915 -2.469 . . . . 0.0 106.519 164.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 75.77 155.3 5.38 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-N 122.959 2.618 . . . . 0.0 109.757 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 94.1 p -71.66 -30.8 66.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 176.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -138.9 43.16 2.09 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 -167.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 96.6 p -84.14 -179.32 7.2 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 124.074 1.892 . . . . 0.0 112.053 173.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.267 1.6 mp -69.46 -9.0 51.81 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 112.665 -2.061 . . . . 0.0 114.676 175.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 22.6 tttt -71.81 -16.44 62.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 115.618 1.711 . . . . 0.0 115.618 155.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -101.08 -41.88 6.59 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 120.057 -1.652 . . . . 0.0 109.515 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . 0.502 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 59.62 91.66 0.07 OUTLIER Pre-proline 0 N--CA 1.452 -0.345 0 CA-C-N 120.695 1.589 . . . . 0.0 109.997 -174.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . 0.502 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.285 97.9 Cg_exo 37.4 35.72 0.0 OUTLIER 'Cis proline' 0 N--CA 1.448 -1.161 0 N-CA-C 116.756 1.791 . . . . 0.0 116.756 29.823 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 61.1 t -66.76 -18.22 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 C-N-CA 128.327 2.651 . . . . 0.0 111.324 -172.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.55 -28.11 9.06 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -166.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 36.9 tp -57.69 -46.06 84.81 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 120.531 -1.356 . . . . 0.0 110.884 151.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -67.5 -49.24 64.34 Favored 'General case' 0 N--CA 1.451 -0.408 1 O-C-N 116.135 -4.103 . . . . 0.0 112.184 -175.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -61.0 -2.61 0.61 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 114.383 -2.722 . . . . 0.0 111.811 172.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -103.87 -54.18 2.61 Favored 'General case' 0 N--CA 1.45 -0.438 1 CA-C-N 127.74 4.791 . . . . 0.0 110.888 171.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 92.1 mt -48.81 -42.56 36.46 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.8 1.24 . . . . 0.0 107.657 174.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -66.99 -35.54 80.17 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.574 -0.704 . . . . 0.0 112.372 -173.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -80.51 -24.35 39.46 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 120.612 1.551 . . . . 0.0 109.136 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 78.1 t -100.88 -15.2 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 123.908 3.049 . . . . 0.0 107.626 -168.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 83.9 mt -112.9 -16.22 12.74 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 121.487 1.949 . . . . 0.0 112.463 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.353 25.1 mt -98.4 16.34 21.96 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 171.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 15.6 pttp -77.77 161.52 27.62 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.741 2.016 . . . . 0.0 114.131 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 5.4 m -80.74 -9.66 59.79 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 117.893 -3.005 . . . . 0.0 117.797 -164.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-N 121.851 2.114 . . . . 0.0 112.913 -176.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 56.6 ttp . . . . . 0 N--CA 1.448 -0.549 0 CA-C-O 121.197 0.523 . . . . 0.0 109.863 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.97 -49.81 76.46 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 117.08 -3.513 . . . . 0.0 114.959 168.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -54.31 -43.13 70.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 122.711 1.243 . . . . 0.0 112.452 173.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -55.42 -53.11 60.33 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 122.78 1.276 . . . . 0.0 112.313 174.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -69.94 -40.57 75.42 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 116.576 -1.678 . . . . 0.0 109.372 -175.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -47.8 -33.35 7.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 125.768 2.699 . . . . 0.0 116.067 171.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . 0.309 2.6 mp0 -73.55 -31.7 63.79 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 117.772 -3.08 . . . . 0.0 113.008 173.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -76.08 -19.8 58.26 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 119.401 -2.062 . . . . 0.0 110.014 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . 0.34 38.7 t-105 -71.18 -50.06 37.22 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.184 2.994 . . . . 0.0 114.981 166.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.54 -27.38 68.58 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.027 1.731 . . . . 0.0 114.514 173.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -75.05 -35.06 61.91 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 116.566 2.061 . . . . 0.0 116.566 165.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.38 -50.27 70.15 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 119.883 1.219 . . . . 0.0 112.806 161.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.4 t -76.96 -25.58 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 CA-C-O 115.414 -2.232 . . . . 0.0 113.811 -173.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -61.02 -55.74 29.21 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 115.405 -2.236 . . . . 0.0 114.893 155.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 48.9 tp -56.18 -37.43 69.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 121.011 1.732 . . . . 0.0 113.154 -173.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 23.4 tp -68.23 -46.84 69.43 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 110.082 -3.235 . . . . 0.0 114.411 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.472 ' HB3' ' HE2' ' A' ' 27' ' ' LYS . 20.2 ttpt -60.88 -42.47 97.99 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 118.569 -2.582 . . . . 0.0 112.023 174.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.89 -32.23 71.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 126.221 2.201 . . . . 0.0 111.996 173.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.88 -36.68 82.84 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 111.883 -3.913 . . . . 0.0 108.971 171.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -62.64 -34.05 76.26 Favored 'General case' 0 N--CA 1.448 -0.547 1 CA-C-N 130.116 5.871 . . . . 0.0 115.328 168.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.328 77.1 mt-30 -64.6 -21.2 66.65 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 116.972 2.212 . . . . 0.0 116.972 170.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -109.02 10.57 26.17 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 124.701 1.25 . . . . 0.0 108.623 173.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 52.66 27.21 5.0 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 116.737 -3.727 . . . . 0.0 118.265 -168.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.2 mt -102.54 6.69 40.03 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 117.491 -3.255 . . . . 0.0 112.004 -172.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -72.22 -30.59 65.07 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.561 1.544 . . . . 0.0 110.755 -158.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 56.4 mt -63.6 -59.23 12.28 Favored Pre-proline 0 N--CA 1.451 -0.396 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 167.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -49.96 -33.91 35.67 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 CA-C-N 124.994 2.819 . . . . 0.0 113.454 170.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.3 tp -64.44 -52.08 59.87 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 122.281 2.31 . . . . 0.0 116.097 174.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.3 mt -60.68 -35.09 75.41 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.13 1.772 . . . . 0.0 114.78 168.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 -73.87 -30.75 62.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 121.801 2.091 . . . . 0.0 108.02 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.275 19.6 tp -78.36 -36.93 45.41 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 116.78 -3.7 . . . . 0.0 111.272 176.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 62.1 mmm -70.68 -20.28 62.7 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 118.279 2.696 . . . . 0.0 118.279 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.415 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 10.5 mt -137.32 125.15 22.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 130.342 3.457 . . . . 0.0 114.278 178.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 66.8 p -67.16 152.19 96.35 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-O 114.715 -2.564 . . . . 0.0 108.855 175.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -59.32 -26.83 83.24 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 N-CA-C 119.163 2.717 . . . . 0.0 119.163 -159.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -63.59 -44.55 93.67 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 125.645 1.84 . . . . 0.0 108.143 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 21.9 mt-10 -59.13 -44.9 92.06 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 131.673 3.989 . . . . 0.0 114.353 177.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.6 mtm180 -65.48 -54.67 25.02 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.889 3.276 . . . . 0.0 113.266 172.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -47.42 -36.32 9.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 165.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.12 -38.74 79.05 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 118.595 -2.565 . . . . 0.0 114.057 169.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.9 mt -66.7 -32.49 73.84 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 116.672 -1.632 . . . . 0.0 107.076 178.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.93 -50.74 62.67 Favored Glycine 0 CA--C 1.523 0.57 0 CA-C-N 120.287 1.403 . . . . 0.0 110.986 166.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.5 m -60.74 -33.85 73.53 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 120.723 2.261 . . . . 0.0 110.804 -175.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -73.18 -25.95 60.99 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 120.926 1.694 . . . . 0.0 109.092 -170.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 85.8 t -58.49 -43.4 86.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 C-N-CA 124.695 1.198 . . . . 0.0 112.44 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 -67.16 -43.21 82.83 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 129.271 3.028 . . . . 0.0 112.227 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 81.8 mt -54.11 -54.64 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 125.114 1.509 . . . . 0.0 111.09 165.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.7 t -66.1 -26.2 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 120.729 1.604 . . . . 0.0 112.263 176.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . 0.25 11.0 tt0 -63.67 -53.39 52.07 Favored 'General case' 0 N--CA 1.446 -0.652 1 O-C-N 116.066 -4.146 . . . . 0.0 111.396 170.095 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -75.63 -23.05 56.33 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 117.17 -3.456 . . . . 0.0 113.02 -175.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 80.3 mt -76.31 -34.88 59.04 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 119.011 -2.306 . . . . 0.0 112.224 165.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 63.2 mt -73.55 -50.12 22.95 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 116.792 -3.693 . . . . 0.0 113.105 173.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.7 ttm180 -43.05 -41.54 3.54 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 116.532 -3.855 . . . . 0.0 115.424 161.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 59.11 29.71 65.91 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 120.278 2.871 . . . . 0.0 120.278 172.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -95.75 -43.13 8.02 Favored 'General case' 0 N--CA 1.444 -0.725 1 C-N-CA 131.746 4.019 . . . . 0.0 114.505 175.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 40.8 mtt -69.48 130.54 42.78 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 168.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.7 p -78.73 172.19 14.08 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.933 2.093 . . . . 0.0 113.074 158.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -50.54 -44.4 56.44 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 128.106 2.562 . . . . 0.0 113.995 171.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -61.9 -27.1 68.57 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 118.935 -2.353 . . . . 0.0 115.517 177.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -84.26 -54.64 4.66 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 126.994 2.118 . . . . 0.0 111.788 -178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.5 mt -46.74 -29.71 2.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 119.127 3.01 . . . . 0.0 119.127 164.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -72.86 -18.4 61.44 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.795 2.038 . . . . 0.0 114.53 173.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -91.99 -74.27 0.52 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.106 2.162 . . . . 0.0 110.628 160.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -66.22 -21.78 66.32 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 127.105 2.753 . . . . 0.0 112.238 -151.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 13.0 mt -120.07 -26.79 5.46 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 120.254 -1.529 . . . . 0.0 108.425 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.51 15.47 27.24 Favored Glycine 0 CA--C 1.526 0.774 0 C-N-CA 126.137 1.827 . . . . 0.0 115.993 170.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.52 126.79 35.12 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 126.248 1.793 . . . . 0.0 113.784 -164.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.21 157.16 49.63 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-O 122.079 0.821 . . . . 0.0 113.927 175.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.4 mt -57.09 -48.79 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.52 -33.42 66.04 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 117.561 -1.209 . . . . 0.0 113.562 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.6 p -67.64 -44.35 78.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 122.005 0.907 . . . . 0.0 111.091 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.3 mm -70.94 -33.79 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.276 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 15.0 m -56.14 -61.79 2.15 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 118.487 -2.633 . . . . 0.0 113.661 165.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -58.02 -36.49 72.78 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 130.673 3.589 . . . . 0.0 114.013 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.59 -36.76 32.56 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-O 115.008 -3.107 . . . . 0.0 108.172 -177.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 68.8 m -63.56 -52.97 58.76 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 119.368 1.584 . . . . 0.0 113.373 168.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -57.11 -31.52 65.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.754 -1.593 . . . . 0.0 110.285 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.7 m -77.06 -25.8 52.83 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 124.865 3.484 . . . . 0.0 113.479 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 29.3 tp -82.62 -42.43 18.24 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 119.222 3.045 . . . . 0.0 119.222 174.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -59.38 -39.88 84.73 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 125.179 1.391 . . . . 0.0 111.335 162.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.11 -35.77 78.67 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 117.283 -1.767 . . . . 0.0 113.762 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -50.47 142.59 15.04 Favored Pre-proline 0 N--CA 1.448 -0.532 0 CA-C-O 116.597 -1.668 . . . . 0.0 113.573 175.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.7 145.32 36.7 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 CA-C-N 121.472 1.561 . . . . 0.0 111.624 -168.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 m -57.26 -32.25 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -168.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -55.42 -36.03 66.03 Favored 'General case' 0 N--CA 1.445 -0.723 1 O-C-N 113.409 -5.807 . . . . 0.0 114.79 174.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 33.5 tp -67.31 -39.31 85.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 114.268 -2.777 . . . . 0.0 115.373 169.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 87.1 mtm-85 -66.82 -43.12 84.62 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 125.375 1.672 . . . . 0.0 110.467 168.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -61.63 -28.3 69.27 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 125.171 1.544 . . . . 0.0 108.7 -176.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 22.1 t90 -75.14 -61.74 1.79 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 170.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 92.1 mt -51.35 -38.47 53.35 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -58.25 -31.0 66.99 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 120.94 -1.1 . . . . 0.0 112.764 172.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -83.54 -19.28 35.95 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 120.144 -1.597 . . . . 0.0 114.743 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 21.2 t -95.81 -55.39 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 1 C-N-CA 133.105 4.562 . . . . 0.0 111.1 -176.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.6 mt -89.32 -15.56 33.15 Favored 'General case' 0 N--CA 1.448 -0.533 1 O-C-N 115.35 -4.594 . . . . 0.0 110.433 -171.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 59.4 mt -116.5 4.58 13.29 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 122.829 2.559 . . . . 0.0 113.634 -172.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mttp . . . . . 0 N--CA 1.451 -0.392 0 O-C-N 123.874 0.734 . . . . 0.0 112.886 179.142 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.709 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 51.7 mtt -69.39 -38.52 78.02 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 116.319 -1.801 . . . . 0.0 108.776 168.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.11 -41.38 98.17 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 124.126 3.148 . . . . 0.0 109.787 -173.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -71.98 -26.18 62.15 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 119.867 -1.771 . . . . 0.0 113.96 173.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -73.94 -36.27 64.62 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 117.974 -2.954 . . . . 0.0 112.135 169.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -72.43 -34.33 67.73 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 116.433 -1.746 . . . . 0.0 112.775 177.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 69.1 t60 -62.15 -46.14 90.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 127.862 3.226 . . . . 0.0 109.512 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -64.58 -35.19 80.2 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 117.374 -3.329 . . . . 0.0 115.805 168.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -70.06 -22.54 63.06 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 119.706 -1.872 . . . . 0.0 111.887 176.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -85.16 -47.69 9.88 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 128.361 2.664 . . . . 0.0 106.936 174.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . 0.253 45.5 mt -49.98 -24.57 2.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 118.12 2.637 . . . . 0.0 118.12 174.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 50.9 ttt180 -68.19 -33.63 74.8 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.938 -2.351 . . . . 0.0 112.196 173.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -66.28 -43.47 86.3 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 127.142 2.177 . . . . 0.0 110.971 176.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 38.6 t -58.97 -38.69 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 129.988 3.315 . . . . 0.0 115.545 173.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -71.44 -41.9 68.89 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 113.249 -1.796 . . . . 0.0 113.696 166.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 48.5 tp -60.38 -36.31 77.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 173.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.328 55.2 tp -80.77 -37.15 30.86 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 115.537 -2.173 . . . . 0.0 111.229 178.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . 0.412 ' HE3' ' OD1' ' B' ' 28' ' ' ASN . 32.7 ttpt -56.91 -44.41 82.37 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 116.491 -2.084 . . . . 0.0 114.398 167.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . 0.412 ' OD1' ' HE3' ' B' ' 27' ' ' LYS . 50.6 m-20 -73.45 -26.49 60.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 120.19 1.359 . . . . 0.0 111.929 -172.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.86 -36.21 62.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.494 1.918 . . . . 0.0 114.939 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -60.79 -33.75 73.46 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 116.21 -1.853 . . . . 0.0 114.813 159.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -67.55 -29.22 68.54 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 122.529 2.422 . . . . 0.0 112.221 171.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -96.8 -0.1 48.53 Favored 'General case' 0 N--CA 1.447 -0.599 1 CA-C-O 111.465 -4.112 . . . . 0.0 110.174 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.46 0.4 OUTLIER 57.92 14.09 2.43 Favored 'General case' 0 N--CA 1.445 -0.683 1 C-N-CA 131.94 4.096 . . . . 0.0 117.163 -178.438 . . . . . . . . 4 3 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 20.5 mt -88.96 22.08 2.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 129.115 2.966 . . . . 0.0 109.722 -177.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -88.39 -20.61 25.04 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 117.456 2.391 . . . . 0.0 117.456 -157.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 23.5 mt -73.2 -56.62 3.2 Favored Pre-proline 0 N--CA 1.449 -0.497 0 CA-C-N 112.089 -2.323 . . . . 0.0 111.747 170.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -62.62 -27.96 76.68 Favored 'Trans proline' 0 N--CA 1.448 -1.15 1 C-N-CA 125.698 4.265 . . . . 0.0 112.814 178.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 41.9 tp -73.35 -37.66 65.99 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.849 1.968 . . . . 0.0 106.903 -178.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 80.7 mt -70.84 -38.69 73.2 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 125.522 2.582 . . . . 0.0 112.189 175.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -57.39 -29.31 63.97 Favored 'General case' 0 N--CA 1.449 -0.5 1 O-C-N 114.531 -5.105 . . . . 0.0 113.578 165.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 45.0 tp -78.5 -48.02 16.16 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 117.283 -3.386 . . . . 0.0 111.904 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 11.4 mmt -82.89 -11.23 58.37 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -167.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 1.1 mp -140.61 128.32 21.65 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.287 1.835 . . . . 0.0 112.354 -169.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 66.8 p -80.19 160.63 67.72 Favored Pre-proline 0 N--CA 1.449 -0.48 0 CA-C-O 115.385 -2.245 . . . . 0.0 110.334 -178.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -55.16 -36.36 92.96 Favored 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 124.895 3.73 . . . . 0.0 113.784 -169.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.32 -26.28 38.87 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 124.468 1.105 . . . . 0.0 110.155 -172.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -67.49 -47.27 70.52 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 119.084 -2.26 . . . . 0.0 110.91 167.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 62.7 mtm-85 -63.58 -41.35 98.38 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 125.163 1.539 . . . . 0.0 115.064 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.57 -39.31 93.51 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 118.891 -2.38 . . . . 0.0 114.876 169.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.62 -46.96 65.03 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 18.8 mt -53.09 -34.93 58.83 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 117.04 -3.537 . . . . 0.0 116.492 169.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.96 -24.17 71.47 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 110.688 -2.96 . . . . 0.0 115.967 172.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.5 m -101.88 -22.35 14.35 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 114.926 -2.464 . . . . 0.0 110.969 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -63.32 -21.62 66.37 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 121.311 1.869 . . . . 0.0 112.643 166.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 10.5 t -54.16 -49.37 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 O-C-N 116.599 -3.813 . . . . 0.0 114.424 163.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 -74.07 -31.84 63.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 96.3 mt -70.73 -46.97 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 3.3 t -63.23 -36.2 75.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 O-C-N 116.975 -3.578 . . . . 0.0 111.634 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.16 -41.94 76.24 Favored 'General case' 0 N--CA 1.452 -0.35 1 O-C-N 115.861 -4.274 . . . . 0.0 116.396 169.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -80.08 -17.33 52.95 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 129.951 3.3 . . . . 0.0 112.468 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 54.6 mt -82.73 -9.78 59.2 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 117.183 -3.448 . . . . 0.0 111.027 168.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 89.3 mt -107.38 -31.33 8.22 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 128.413 2.685 . . . . 0.0 112.079 169.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 16.5 ttm105 -70.66 -54.46 11.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.692 1.738 . . . . 0.0 115.692 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.68 54.61 30.22 Favored Glycine 0 C--N 1.337 0.622 0 CA-C-O 115.301 -2.944 . . . . 0.0 117.111 -170.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -126.95 -17.01 4.99 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 117.152 2.278 . . . . 0.0 117.152 175.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 81.4 mtp -102.93 146.44 28.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.208 -2.183 . . . . 0.0 111.731 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -93.54 172.55 8.2 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 118.471 -2.643 . . . . 0.0 107.845 172.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -58.4 -37.41 75.25 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 175.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -55.25 -36.51 66.14 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 126.298 2.951 . . . . 0.0 118.208 172.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -85.08 -38.92 18.57 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 128.284 2.634 . . . . 0.0 106.681 -174.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 73.3 mt -58.56 -42.49 88.06 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 117.056 -3.527 . . . . 0.0 111.491 170.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 tptt -59.26 -65.92 0.59 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 127.757 2.423 . . . . 0.0 111.02 173.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -74.16 -29.75 61.93 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 114.687 -2.805 . . . . 0.0 114.147 -168.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . 0.31 39.6 mt-10 -115.91 -23.62 8.5 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 114.867 -2.492 . . . . 0.0 114.422 -162.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mt -104.85 -6.1 20.53 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 126.092 2.12 . . . . 0.0 114.389 162.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.94 16.8 70.91 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 119.672 -1.251 . . . . 0.0 113.496 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.55 134.72 34.18 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 122.833 3.316 . . . . 0.0 117.808 -179.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.17 -173.24 7.43 Favored Glycine 0 C--N 1.334 0.456 0 CA-C-O 124.527 2.181 . . . . 0.0 111.848 158.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 97.3 mt -83.13 -44.98 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 O-C-N 117.255 -3.497 . . . . 0.0 113.146 -177.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.97 -23.26 52.34 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 -169.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 17.2 m -66.04 -44.31 85.0 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.315 1.446 . . . . 0.0 113.841 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 21.1 mm -76.74 -30.14 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 C-N-CA 125.916 1.686 . . . . 0.0 107.663 173.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 6.7 m -59.4 -50.72 72.86 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 120.245 -1.534 . . . . 0.0 111.003 169.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -61.72 -42.18 98.61 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -48.55 -44.54 29.31 Favored Glycine 0 N--CA 1.446 -0.657 1 C-N-CA 131.038 4.161 . . . . 0.0 109.7 176.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 3.6 p -74.02 -35.83 64.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.361 1.465 . . . . 0.0 114.055 -178.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -69.59 -41.19 76.11 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 127.514 2.326 . . . . 0.0 107.702 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 6.0 m -72.51 -31.99 65.79 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 119.33 -2.107 . . . . 0.0 115.057 -176.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.09 -25.86 20.53 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 115.913 -1.994 . . . . 0.0 106.682 -177.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 58.1 tttm -64.4 -48.67 74.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 121.993 2.179 . . . . 0.0 105.234 172.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.18 3.94 25.29 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 117.368 -3.332 . . . . 0.0 116.671 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.7 141.71 64.91 Favored Pre-proline 0 N--CA 1.45 -0.425 0 O-C-N 117.49 -3.256 . . . . 0.0 113.157 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -49.03 124.99 12.35 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 123.192 2.595 . . . . 0.0 116.891 172.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.31 -23.56 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 1 O-C-N 115.887 -4.258 . . . . 0.0 115.571 -172.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -60.36 -30.25 69.43 Favored 'General case' 0 N--CA 1.453 -0.308 1 O-C-N 114.865 -4.897 . . . . 0.0 111.877 171.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 14.7 tp -79.35 -36.79 38.86 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 117.39 -1.291 . . . . 0.0 110.655 171.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 32.0 mtm-85 -65.78 -39.77 91.33 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.832 2.16 . . . . 0.0 116.832 171.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -58.23 -39.37 78.92 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 130.296 3.438 . . . . 0.0 112.013 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -61.44 -59.2 5.61 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 128.188 2.595 . . . . 0.0 114.347 163.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 50.5 mt -75.11 -25.4 58.45 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 122.036 2.198 . . . . 0.0 114.529 -165.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -52.53 -35.79 54.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 129.71 3.204 . . . . 0.0 110.814 170.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -95.47 -47.71 6.15 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.156 2.183 . . . . 0.0 114.021 175.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.9 t -68.16 -20.78 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 O-C-N 119.749 -1.844 . . . . 0.0 112.928 -170.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 50.9 mt -107.14 -42.99 4.72 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -176.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 11.5 mt -77.35 -5.76 50.8 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.007 -1.451 . . . . 0.0 114.066 -174.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -104.29 -2.56 25.41 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 117.268 2.322 . . . . 0.0 117.268 169.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 31.6 m -79.68 -1.13 36.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 114.338 -2.744 . . . . 0.0 114.051 164.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 . . . . . 0 C--O 1.25 1.107 0 CA-C-N 124.905 3.502 . . . . 0.0 109.523 -178.689 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 11.5 ttt . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 116.941 -1.504 . . . . 0.0 111.581 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.263 . . -57.39 141.96 45.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 129.049 2.94 . . . . 0.0 104.646 178.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -120.11 149.66 41.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 123.921 0.763 . . . . 0.0 111.301 -176.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -141.2 148.37 39.83 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 174.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 60.4 p -159.67 158.47 27.38 Favored Pre-proline 0 N--CA 1.446 -0.646 1 C-N-CA 132.77 4.428 . . . . 0.0 111.025 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -52.91 -47.82 25.45 Favored 'Trans proline' 0 N--CA 1.45 -1.076 0 C-N-CA 122.376 2.051 . . . . 0.0 113.58 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -139.88 141.52 36.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 117.308 -3.37 . . . . 0.0 110.951 -171.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 11.9 t -141.95 137.38 31.22 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 112.684 -2.053 . . . . 0.0 106.341 168.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.89 -42.76 94.51 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 117.546 2.424 . . . . 0.0 117.546 174.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.85 -33.38 23.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 168.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 47.6 mtt -83.44 -37.83 22.69 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 115.189 -2.338 . . . . 0.0 113.43 175.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.85 -37.31 71.11 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 123.224 2.738 . . . . 0.0 112.802 166.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -67.52 -38.36 84.12 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 119.389 -2.069 . . . . 0.0 114.661 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -72.22 -25.97 61.85 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.074 -1.641 . . . . 0.0 111.626 176.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -39.59 86.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 125.888 2.756 . . . . 0.0 113.237 169.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -69.54 -48.83 59.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 119.439 -2.038 . . . . 0.0 108.856 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -70.34 -24.85 63.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 115.265 -2.302 . . . . 0.0 110.552 -175.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -56.8 -48.9 76.89 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.482 2.313 . . . . 0.0 113.138 161.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 -56.29 -64.74 0.76 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 170.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -57.7 -33.08 68.01 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.901 2.08 . . . . 0.0 106.342 -175.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -66.74 -36.12 81.71 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 112.721 -3.514 . . . . 0.0 115.995 167.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -64.78 -37.57 88.05 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 122.747 2.521 . . . . 0.0 107.329 169.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.57 -23.38 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 O-C-N 116.647 -3.783 . . . . 0.0 111.521 176.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -83.6 -40.94 18.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 172.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 32.0 tp -56.13 -41.77 75.85 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 119.268 0.94 . . . . 0.0 111.674 171.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 37.3 tp -72.67 -31.58 65.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 123.962 1.839 . . . . 0.0 113.101 -177.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -83.81 -18.71 36.73 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 119.265 -2.147 . . . . 0.0 114.285 176.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -74.27 -38.87 63.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 116.665 -1.636 . . . . 0.0 112.714 160.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.3 -21.68 62.91 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.13 -5.76 37.81 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 120.34 1.427 . . . . 0.0 108.435 173.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -80.1 -38.55 31.42 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 121.936 2.153 . . . . 0.0 111.473 -176.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . 0.277 25.2 p-10 -120.5 33.11 5.71 Favored 'General case' 0 N--CA 1.451 -0.406 1 O-C-N 115.528 -4.483 . . . . 0.0 116.034 169.89 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 61.48 33.6 18.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 131.097 3.759 . . . . 0.0 117.499 171.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 42.0 mt -103.32 10.22 37.61 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.759 1.623 . . . . 0.0 109.593 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -74.04 -32.62 63.41 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 118.384 -2.698 . . . . 0.0 114.601 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 11.3 mt -78.04 -42.57 2.18 Favored Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-O 116.278 -1.82 . . . . 0.0 108.839 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -59.45 -34.64 97.23 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 CA-C-O 115.306 -2.039 . . . . 0.0 113.578 166.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 14.3 tp -61.66 -43.77 98.23 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.768 1.918 . . . . 0.0 113.654 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -67.01 -25.51 66.33 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 173.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -75.14 -19.08 60.07 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 169.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 38.2 tp -84.2 -55.17 4.33 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 126.027 2.079 . . . . 0.0 113.672 168.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 9.1 mmt -73.93 -24.41 59.66 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 119.13 -2.232 . . . . 0.0 110.973 -162.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 11.1 mp -127.25 132.6 50.33 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 129.743 3.217 . . . . 0.0 111.623 -171.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -73.06 157.23 88.81 Favored Pre-proline 0 N--CA 1.448 -0.532 0 C-N-CA 125.787 1.635 . . . . 0.0 108.622 172.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -45.94 -32.44 9.54 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 121.393 1.396 . . . . 0.0 113.451 168.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -39.88 87.35 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 122.097 0.951 . . . . 0.0 113.368 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -72.76 -47.12 49.47 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 129.797 3.239 . . . . 0.0 109.919 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 58.0 mtm-85 -56.95 -41.54 78.47 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 175.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -70.69 -33.08 70.52 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 172.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.16 -39.58 82.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 171.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 20.9 mt -61.84 -33.2 73.74 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 122.238 2.29 . . . . 0.0 113.612 167.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.42 -27.32 73.84 Favored Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.834 171.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 93.8 m -82.18 -43.61 17.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.034 -2.45 . . . . 0.0 112.131 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -57.25 -36.61 71.18 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 114.214 -2.803 . . . . 0.0 115.298 169.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 22.1 t -51.05 -44.53 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-O 113.585 -3.102 . . . . 0.0 113.926 162.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 16.0 mtp180 -62.14 -28.51 69.69 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 124.698 3.408 . . . . 0.0 112.846 171.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 67.7 mt -80.93 -32.88 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 C-N-CA 119.297 -0.961 . . . . 0.0 111.577 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . 0.408 ' HA ' HD22 ' C' ' 89' ' ' LEU . 92.4 t -66.98 -48.97 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 117.593 -1.194 . . . . 0.0 110.801 165.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -58.47 -50.77 72.55 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -177.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -66.81 -37.01 83.69 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 115.385 -2.245 . . . . 0.0 111.107 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 94.1 mt -70.0 -21.46 63.21 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 116.844 2.164 . . . . 0.0 116.844 173.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 19.7 mt -78.49 -23.69 46.27 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 169.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -71.48 -44.6 64.42 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.874 -2.391 . . . . 0.0 110.868 168.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 65.76 22.78 70.35 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-O 125.235 2.575 . . . . 0.0 116.87 174.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -99.03 -21.52 16.17 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 117.964 -3.08 . . . . 0.0 111.077 -176.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 12.0 mtt -71.89 127.19 31.76 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 120.529 -1.357 . . . . 0.0 112.223 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 60.4 p -74.64 163.01 28.2 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 126.146 2.154 . . . . 0.0 111.382 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -37.89 -41.9 0.57 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 116.191 1.923 . . . . 0.0 116.191 171.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 31.8 ttp-105 -60.75 -48.41 81.9 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 121.912 0.863 . . . . 0.0 111.687 176.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -67.47 -34.17 76.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.97 2.108 . . . . 0.0 106.565 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 68.5 mt -68.72 -30.94 69.68 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 119.069 -2.269 . . . . 0.0 111.82 172.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 39.7 tttp -73.99 -42.34 60.57 Favored 'General case' 0 N--CA 1.453 -0.283 1 O-C-N 115.093 -4.754 . . . . 0.0 116.341 170.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -76.13 -21.6 56.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.84 1.256 . . . . 0.0 109.535 -170.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -124.69 -39.71 2.27 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 117.422 -1.275 . . . . 0.0 114.238 -170.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.326 5.6 mp -102.01 -15.56 16.75 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 115.869 -2.015 . . . . 0.0 109.588 -168.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 48.2 -131.11 19.58 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 128.433 2.921 . . . . 0.0 117.328 158.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.25 -22.28 33.1 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.575 -2.133 . . . . 0.0 111.926 -174.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.23 -15.13 81.85 Favored Glycine 0 CA--C 1.523 0.588 0 C-N-CA 127.065 2.269 . . . . 0.0 112.032 -169.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 17.5 tt -58.64 -33.84 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 125.535 1.534 . . . . 0.0 110.155 -178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.6 -32.7 74.19 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 120.897 -1.127 . . . . 0.0 113.505 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 2.9 m -62.79 -44.03 97.23 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 117.462 -3.274 . . . . 0.0 109.454 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 39.0 mm -88.36 -18.26 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 129.385 3.074 . . . . 0.0 112.054 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 71.7 p -110.93 -11.05 14.37 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 120.701 3.593 . . . . 0.0 120.701 174.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 43.3 mtp85 -115.29 156.1 26.07 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.426 -3.296 . . . . 0.0 113.335 174.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.86 172.22 45.61 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 128.034 2.73 . . . . 0.0 112.783 -177.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 97.2 p -89.86 10.08 25.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 116.976 -3.661 . . . . 0.0 117.776 -176.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -104.55 0.85 29.13 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 118.002 -2.936 . . . . 0.0 114.215 161.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 99.9 p -59.23 172.83 0.55 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 126.459 3.028 . . . . 0.0 115.753 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' C' ' 58' ' ' VAL . 26.5 tp -70.72 -12.44 61.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 111.015 -2.811 . . . . 0.0 111.3 -170.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -124.02 0.98 8.58 Favored 'General case' 0 N--CA 1.451 -0.376 1 O-C-N 116.262 -4.024 . . . . 0.0 110.328 177.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -113.36 -21.33 10.96 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 121.535 3.902 . . . . 0.0 121.535 173.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.42 157.78 4.62 Favored Pre-proline 0 N--CA 1.452 -0.352 0 C-N-CA 129.499 3.12 . . . . 0.0 112.994 170.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -56.98 129.05 32.47 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 N-CA-C 114.389 0.88 . . . . 0.0 114.389 173.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 61.8 t -59.78 -30.84 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 C-N-CA 128.907 2.883 . . . . 0.0 112.0 -162.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -62.59 -24.42 67.55 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 176.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 4.6 tp -68.35 -55.77 10.87 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 115.594 -2.146 . . . . 0.0 110.136 168.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 59.6 mtp180 -48.49 -40.79 27.83 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 128.593 2.757 . . . . 0.0 108.589 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -70.89 -52.84 17.71 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.613 1.965 . . . . 0.0 112.46 -179.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 32.8 t90 -46.7 -40.71 13.79 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 116.833 -3.667 . . . . 0.0 117.829 168.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 27.9 mt -75.46 -22.02 57.64 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.237 -175.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -78.64 -34.34 46.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 117.696 -1.145 . . . . 0.0 108.658 172.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -68.94 -18.57 64.11 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 125.245 1.418 . . . . 0.0 110.869 -178.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 96.9 t -105.58 -40.77 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 C-N-CA 127.819 2.448 . . . . 0.0 115.808 -177.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -103.51 -16.37 15.58 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 128.743 2.817 . . . . 0.0 111.728 -167.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 23.9 mt -120.44 -3.47 9.91 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 121.317 1.871 . . . . 0.0 112.427 -177.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 58.9 pttt . . . . . 0 N--CA 1.451 -0.391 0 O-C-N 118.242 -2.786 . . . . 0.0 117.754 -171.739 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 66.9 p . . . . . 0 N--CA 1.446 -0.625 0 CA-C-O 114.699 -2.572 . . . . 0.0 115.084 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -61.96 -19.55 66.39 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 CA-C-N 122.709 2.003 . . . . 0.0 117.239 172.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . 0.354 49.5 t80 -173.78 148.1 1.43 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.386 2.274 . . . . 0.0 106.804 171.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 11.9 t -62.19 128.64 37.07 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 103.236 -2.875 . . . . 0.0 103.236 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.42 -25.26 61.41 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 112.826 -1.988 . . . . 0.0 111.205 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.93 -36.4 83.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 119.072 -2.267 . . . . 0.0 114.457 165.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -66.63 -33.91 76.71 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 177.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . 0.28 . . -60.86 -35.41 76.51 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 118.257 -2.777 . . . . 0.0 109.602 175.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -70.85 -50.88 30.49 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.292 -2.13 . . . . 0.0 106.726 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -54.77 -46.23 74.37 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.28 2.232 . . . . 0.0 108.15 -170.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -31.36 71.32 Favored 'General case' 0 N--CA 1.45 -0.459 1 O-C-N 115.872 -4.268 . . . . 0.0 110.647 -168.594 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.6 t60 -76.56 -27.67 55.98 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 164.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -67.67 -33.21 74.47 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 118.017 -2.927 . . . . 0.0 116.139 169.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -74.99 -26.55 59.65 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 128.833 2.853 . . . . 0.0 115.196 167.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 5.1 t-105 -70.58 -48.26 56.13 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 116.939 -3.6 . . . . 0.0 110.371 165.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 93.6 mt -68.56 -25.22 64.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 120.52 -1.363 . . . . 0.0 110.14 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 17.4 ttt180 -62.37 -33.97 75.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 118.047 -0.978 . . . . 0.0 112.039 168.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . 0.451 88.1 t80 -70.68 -36.56 73.38 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 171.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.99 -45.47 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 O-C-N 119.144 -2.223 . . . . 0.0 110.396 172.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -74.91 -33.48 62.02 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 118.033 2.605 . . . . 0.0 118.033 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 17.3 tp -60.62 -43.05 97.92 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 124.353 2.025 . . . . 0.0 111.099 167.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 42.3 tp -60.91 -44.0 97.77 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 118.272 -2.767 . . . . 0.0 109.546 175.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -59.36 -55.62 32.46 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 120.092 1.315 . . . . 0.0 107.89 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -58.14 -30.56 66.43 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 126.483 2.364 . . . . 0.0 115.858 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.34 -24.95 62.2 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.899 0.88 . . . . 0.0 112.048 175.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -76.81 -26.16 54.1 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 119.516 1.053 . . . . 0.0 110.428 168.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -84.54 -19.06 33.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 118.185 -2.822 . . . . 0.0 113.421 -176.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 53.7 p30 -114.97 10.38 16.27 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 114.889 1.441 . . . . 0.0 114.889 172.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 49.63 42.42 23.19 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.601 1.188 . . . . 0.0 112.024 -176.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 47.1 mt -102.03 11.99 37.56 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 121.476 1.944 . . . . 0.0 112.824 167.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . 0.366 0.0 OUTLIER -49.71 -67.16 0.28 Allowed 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 119.876 3.287 . . . . 0.0 119.876 177.296 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 6.2 mt -58.2 -48.63 96.69 Favored Pre-proline 0 N--CA 1.449 -0.505 0 CA-C-O 114.745 -2.55 . . . . 0.0 110.554 -177.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.33 -25.49 71.45 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 CA-C-N 125.36 2.95 . . . . 0.0 112.912 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 14.8 tp -79.48 -40.23 30.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 125.535 3.789 . . . . 0.0 116.575 177.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 89.0 mt -68.34 -42.56 79.11 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 11.8 m-20 -71.5 -28.21 63.75 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 113.844 -2.979 . . . . 0.0 117.009 177.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 28.1 tp -57.6 -52.1 66.8 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 114.063 -2.875 . . . . 0.0 114.149 156.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 19.4 mmt -75.88 -25.66 56.32 Favored 'General case' 0 N--CA 1.448 -0.529 1 C-N-CA 131.823 4.049 . . . . 0.0 117.704 -173.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 14.6 mt -132.95 129.63 38.52 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 126.012 2.07 . . . . 0.0 110.476 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 71.6 p -77.25 167.23 38.21 Favored Pre-proline 0 N--CA 1.451 -0.412 0 CA-C-O 114.927 -2.463 . . . . 0.0 109.369 -167.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -45.23 -42.18 16.88 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 O-C-N 125.938 2.546 . . . . 0.0 116.15 -173.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -92.01 -7.65 48.28 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.765 1.626 . . . . 0.0 111.387 -169.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -88.5 -36.17 16.58 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 168.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -66.48 -38.64 87.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 127.199 2.2 . . . . 0.0 111.864 169.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -79.35 -37.39 37.55 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 119.747 -1.846 . . . . 0.0 108.955 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -49.44 -58.71 4.65 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 121.812 2.097 . . . . 0.0 108.93 163.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 49.0 mt -64.13 -44.09 93.25 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 117.786 -3.071 . . . . 0.0 111.406 -165.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -33.64 -50.3 0.57 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-O 114.48 -3.4 . . . . 0.0 121.551 149.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 28.7 m -73.57 -29.71 62.58 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 120.944 2.372 . . . . 0.0 109.262 177.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.262 96.9 mtt180 -64.42 -28.66 69.83 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 120.509 -1.369 . . . . 0.0 113.573 -176.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 10.8 t -56.62 -51.86 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 120.6 1.545 . . . . 0.0 112.037 162.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -77.08 -11.06 59.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 117.227 -1.789 . . . . 0.0 113.905 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 36.9 mt -74.91 -47.73 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 122.223 2.283 . . . . 0.0 105.804 175.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 91.3 t -65.03 -41.61 92.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 173.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -56.26 -31.18 63.34 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.684 -2.51 . . . . 0.0 115.204 173.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -84.56 -29.69 25.67 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 120.34 1.427 . . . . 0.0 114.543 -176.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 25.0 mt -67.06 -20.46 65.83 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.999 1.719 . . . . 0.0 113.628 161.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 27.6 mt -94.64 -21.22 18.94 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 120.118 -1.614 . . . . 0.0 111.559 171.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . 0.256 32.0 ttm180 -79.95 -40.46 28.03 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.898 0.856 . . . . 0.0 111.295 176.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 73.24 6.63 69.84 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 127.652 2.548 . . . . 0.0 117.98 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -93.48 -32.8 14.05 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 124.872 0.983 . . . . 0.0 113.304 -170.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 39.0 mtt -80.28 42.54 0.58 Allowed 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 127.383 3.468 . . . . 0.0 114.03 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 89.0 p -67.86 163.0 22.89 Favored 'General case' 0 N--CA 1.446 -0.669 1 O-C-N 115.664 -4.398 . . . . 0.0 113.966 -176.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 67.83 -55.21 0.49 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 114.564 -2.636 . . . . 0.0 115.917 163.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 ttt85 -125.05 -29.27 3.34 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 122.327 2.33 . . . . 0.0 116.49 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -77.16 -37.32 54.09 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 118.346 -2.721 . . . . 0.0 111.081 -173.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 11.7 mt -53.71 -30.34 43.43 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.0 1.857 . . . . 0.0 115.405 168.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -91.73 -7.24 50.3 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -136.18 -17.43 1.59 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 114.926 -2.464 . . . . 0.0 117.65 -175.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -90.59 -35.43 15.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 126.549 2.405 . . . . 0.0 112.015 163.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.307 1.4 mm? -94.61 -57.2 2.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 127.352 2.261 . . . . 0.0 116.215 172.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.65 -162.83 44.43 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 116.249 -2.417 . . . . 0.0 114.612 174.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -33.3 -32.93 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 130.159 4.094 . . . . 0.0 118.084 -157.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.01 -19.43 56.7 Favored Glycine 0 C--N 1.337 0.632 1 C-N-CA 131.316 4.294 . . . . 0.0 110.491 174.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . 0.256 0.9 OUTLIER -58.65 -29.94 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 121.655 2.728 . . . . 0.0 114.778 175.508 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.62 -12.86 60.04 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 116.591 -1.671 . . . . 0.0 111.731 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 14.4 m -71.76 -37.16 70.54 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 118.322 2.712 . . . . 0.0 118.322 158.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 25.8 mm -82.93 -27.06 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 CA-C-N 113.645 -1.616 . . . . 0.0 111.573 -173.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 71.5 p -102.31 -19.03 15.17 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 127.261 2.224 . . . . 0.0 110.625 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.322 16.3 mtp180 -119.79 154.25 34.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.297 -2.752 . . . . 0.0 113.531 178.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 109.38 146.41 11.49 Favored Glycine 0 C--N 1.338 0.692 0 C-N-CA 119.922 -1.132 . . . . 0.0 111.355 -159.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 84.5 p -72.68 -21.62 61.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 129.606 3.163 . . . . 0.0 112.907 -160.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -130.09 38.78 3.75 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 128.344 3.527 . . . . 0.0 113.397 175.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 29.1 p -57.46 169.59 0.63 Allowed 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 127.365 2.916 . . . . 0.0 117.374 173.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.373 0.7 OUTLIER -65.77 -3.48 5.0 Favored 'General case' 0 C--O 1.223 -0.297 1 O-C-N 115.59 -4.444 . . . . 0.0 119.443 159.122 . . . . . . . . 4 3 . 1 . 005 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 66.2 tttt -76.68 -22.83 53.45 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 126.957 2.661 . . . . 0.0 114.625 162.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -105.21 -39.89 6.04 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 131.638 3.975 . . . . 0.0 115.448 -152.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . 0.523 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 55.33 85.49 0.19 Allowed Pre-proline 0 N--CA 1.448 -0.569 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 167.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . 0.523 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.357 0.0 OUTLIER 33.95 33.11 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.21 0 C-N-CA 119.468 -3.138 . . . . 0.0 118.857 40.047 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 91.8 t -65.32 -28.81 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 O-C-N 125.837 1.961 . . . . 0.0 107.215 -170.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.263 0.1 OUTLIER -81.82 -42.78 19.18 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 130.066 3.346 . . . . 0.0 109.979 -170.131 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 9.0 tp -63.26 -40.99 98.97 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 118.501 0.591 . . . . 0.0 111.95 165.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 -55.53 -53.59 54.46 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 116.823 -1.56 . . . . 0.0 115.193 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -57.65 -34.63 69.56 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 126.192 2.183 . . . . 0.0 114.41 177.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 59.5 t90 -75.74 -45.51 36.09 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 117.932 -2.98 . . . . 0.0 111.74 175.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 94.1 mt -55.99 -37.13 68.7 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 118.597 -2.564 . . . . 0.0 114.541 174.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -70.8 -21.24 62.5 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 -174.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -89.37 -48.99 6.97 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 123.674 1.702 . . . . 0.0 111.398 171.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 89.7 t -63.17 -38.78 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 O-C-N 118.261 -2.774 . . . . 0.0 113.136 178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 75.6 mt -84.94 -20.74 30.19 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 115.716 -2.394 . . . . 0.0 114.561 -174.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 55.0 mt -93.86 5.38 51.84 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 124.943 2.306 . . . . 0.0 116.078 177.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 19.1 pttp -60.93 147.28 43.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.657 1.983 . . . . 0.0 107.481 -172.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 34.3 m -65.88 -29.0 69.37 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 119.505 3.15 . . . . 0.0 119.505 -171.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 . . . . . 0 C--O 1.252 1.226 0 O-C-N 118.701 -2.5 . . . . 0.0 113.838 166.541 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.8 ttp . . . . . 0 N--CA 1.451 -0.415 0 N-CA-C 117.31 2.337 . . . . 0.0 117.31 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.04 -40.52 73.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 173.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -77.67 -39.8 43.73 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -42.23 -40.72 2.5 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 128.313 2.645 . . . . 0.0 113.048 168.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 67.0 mmt-85 -79.87 -25.71 40.58 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 125.401 1.688 . . . . 0.0 114.716 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 29.8 t60 -70.58 -39.16 74.04 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 121.63 2.014 . . . . 0.0 111.295 171.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -55.41 -43.13 74.99 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.108 1.363 . . . . 0.0 110.119 172.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -65.1 -37.47 87.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 118.362 2.727 . . . . 0.0 118.362 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 41.9 t-105 -65.94 -47.88 73.21 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.606 169.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 69.6 mt -57.68 -38.33 74.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 120.56 1.527 . . . . 0.0 109.693 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 43.5 ttt180 -62.75 -36.46 83.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 121.221 1.828 . . . . 0.0 114.658 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -61.76 -41.79 98.14 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 121.195 1.816 . . . . 0.0 108.8 173.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.5 t -67.42 -49.77 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 121.477 1.944 . . . . 0.0 105.912 -173.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -71.15 -32.27 68.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 118.997 -2.314 . . . . 0.0 113.899 -177.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 19.4 tp -55.68 -49.49 72.81 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.524 -2.61 . . . . 0.0 109.169 167.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.09 -31.3 72.44 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 118.649 -2.532 . . . . 0.0 114.331 176.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -57.96 -51.82 68.06 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.801 1.778 . . . . 0.0 115.801 169.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -60.8 -39.43 88.91 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 126.156 1.782 . . . . 0.0 112.93 173.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.72 -48.85 76.84 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 115.054 -2.403 . . . . 0.0 114.845 163.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -55.89 -43.42 77.23 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 124.338 3.244 . . . . 0.0 113.85 172.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -70.55 -21.23 62.73 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 125.071 1.482 . . . . 0.0 114.613 -177.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -95.7 5.87 50.32 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 118.95 2.945 . . . . 0.0 118.95 165.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.398 6.0 m-20 71.59 35.59 1.42 Allowed 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 118.467 -2.646 . . . . 0.0 113.769 -172.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.268 49.1 mt -125.61 14.26 8.13 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 119.975 -1.703 . . . . 0.0 112.86 -167.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -73.97 -41.73 61.53 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 118.715 -2.49 . . . . 0.0 114.81 -172.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.5 mt -64.58 -52.77 49.82 Favored Pre-proline 0 N--CA 1.448 -0.554 0 O-C-N 125.571 1.794 . . . . 0.0 110.386 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -71.67 -20.28 26.81 Favored 'Trans proline' 0 N--CA 1.448 -1.19 0 CA-C-N 121.132 1.44 . . . . 0.0 111.287 -170.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.6 tp -71.22 -56.62 5.68 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 129.132 2.973 . . . . 0.0 109.278 173.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.3 mt -61.3 -30.68 70.63 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 120.074 -1.641 . . . . 0.0 110.04 176.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -67.32 -10.87 55.19 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 117.055 -3.528 . . . . 0.0 113.977 176.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.4 tt -102.96 -36.94 8.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.448 1.499 . . . . 0.0 113.442 173.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 79.9 mmm -78.87 -33.16 46.04 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 127.733 2.413 . . . . 0.0 117.293 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.8 mt -119.03 143.05 47.3 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.948 2.899 . . . . 0.0 112.148 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.7 p -82.91 167.13 31.63 Favored Pre-proline 0 N--CA 1.45 -0.444 0 CA-C-O 115.748 -2.073 . . . . 0.0 114.44 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . 0.443 65.4 Cg_exo -47.24 -60.58 0.83 Allowed 'Trans proline' 0 N--CA 1.45 -1.083 0 N-CA-C 119.935 3.014 . . . . 0.0 119.935 -172.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.428 ' HA ' ' HB3' ' A' ' 49' ' ' GLU . 3.3 p30 -67.55 -6.15 18.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 119.585 3.18 . . . . 0.0 119.585 168.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -84.21 -49.28 8.96 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.061 2.209 . . . . 0.0 108.017 170.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.4 mtm-85 -46.34 -45.86 17.85 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.022 2.129 . . . . 0.0 112.861 163.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.428 ' HB3' ' HA ' ' A' ' 46' ' ' ASP . 30.2 tt0 -66.24 -46.18 78.04 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.953 1.408 . . . . 0.0 112.279 179.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.88 -41.43 87.1 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 130.321 3.448 . . . . 0.0 109.071 170.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.1 mt -54.76 -34.42 62.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 124.552 3.342 . . . . 0.0 112.88 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.05 -49.26 76.85 Favored Glycine 0 N--CA 1.446 -0.66 1 C-N-CA 131.72 4.486 . . . . 0.0 113.282 168.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.9 m -70.87 -34.37 71.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.692 1.197 . . . . 0.0 109.551 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -61.38 -37.18 82.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 117.178 2.288 . . . . 0.0 117.178 177.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.5 t -59.29 -38.9 77.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 125.33 1.452 . . . . 0.0 109.188 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.2 mtp180 -66.34 -31.91 72.98 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 128.389 2.675 . . . . 0.0 111.921 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 85.8 mt -77.29 -35.67 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 125.865 1.666 . . . . 0.0 110.49 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.8 t -67.02 -46.16 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-O 117.144 -1.408 . . . . 0.0 107.768 170.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -64.9 -36.53 84.68 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 121.219 1.827 . . . . 0.0 108.422 -170.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -84.59 -29.82 25.51 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.862 -2.399 . . . . 0.0 111.843 -175.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.277 50.0 mt -69.56 -31.53 69.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 118.432 -2.667 . . . . 0.0 113.046 164.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tt -77.54 -37.27 51.19 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 117.033 -1.867 . . . . 0.0 112.152 172.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -69.06 -31.16 69.72 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 128.261 2.624 . . . . 0.0 115.733 176.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.63 -23.73 8.42 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 121.203 3.241 . . . . 0.0 121.203 164.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -64.89 -51.29 62.77 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 176.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 37.8 ttm -90.94 135.9 33.43 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 -155.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 83.8 p -107.94 170.53 7.94 Favored 'General case' 0 CA--C 1.52 -0.191 0 O-C-N 119.499 -2.001 . . . . 0.0 113.627 -166.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -35.17 -61.55 0.42 Allowed 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 124.879 2.276 . . . . 0.0 110.582 -176.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.0 tpt85 -67.14 -14.98 63.43 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.57 3.148 . . . . 0.0 115.455 -174.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -97.93 -46.89 5.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 128.003 3.314 . . . . 0.0 109.608 175.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.2 mt -50.25 -40.17 47.05 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.3 tptp -46.68 -50.61 17.55 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 111.901 -2.409 . . . . 0.0 114.686 164.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -78.95 -24.89 43.64 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.839 2.056 . . . . 0.0 111.646 -177.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -103.01 -26.71 12.98 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 -171.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 37.1 mt -130.35 0.21 4.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.305 -2.747 . . . . 0.0 113.859 -173.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.57 4.2 17.6 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-N 111.936 -2.393 . . . . 0.0 113.868 -164.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.13 123.16 26.55 Favored 'General case' 0 N--CA 1.449 -0.517 1 O-C-N 115.895 -4.297 . . . . 0.0 110.487 -168.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.78 166.79 45.41 Favored Glycine 0 CA--C 1.524 0.595 1 CA-C-O 128.388 4.327 . . . . 0.0 113.392 173.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 60.3 mt -65.48 -27.44 41.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 110.73 -2.735 . . . . 0.0 109.805 -172.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.73 -37.59 73.5 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 120.414 1.461 . . . . 0.0 111.744 -175.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.6 p -86.94 -16.56 35.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.267 40.8 mm -71.07 -56.5 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 C-N-CA 129.939 3.296 . . . . 0.0 108.978 162.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.4 m -53.71 -44.47 69.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 121.573 1.988 . . . . 0.0 116.219 175.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.5 ttt180 -70.85 -54.59 10.98 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 123.142 1.449 . . . . 0.0 108.928 174.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -51.75 -25.74 15.87 Favored Glycine 0 C--N 1.337 0.608 0 O-C-N 118.647 -2.533 . . . . 0.0 116.797 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.3 m -75.59 -48.28 22.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.805 2.842 . . . . 0.0 110.717 171.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -76.73 -25.04 53.08 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 124.142 0.901 . . . . 0.0 112.079 -176.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 74.8 m -70.19 -35.76 74.16 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 126.22 1.808 . . . . 0.0 115.201 163.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 tp -68.49 -33.38 74.04 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 116.277 -4.014 . . . . 0.0 113.839 167.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -70.37 -43.01 71.03 Favored 'General case' 0 N--CA 1.45 -0.463 1 O-C-N 115.944 -4.223 . . . . 0.0 111.388 175.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.01 -11.22 27.03 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 174.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.86 157.12 42.16 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -61.2 153.23 66.43 Favored 'Trans proline' 0 N--CA 1.449 -1.09 1 C-N-CA 128.6 6.2 . . . . 0.0 115.27 160.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 31.2 m -78.7 -29.92 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 117.399 -1.72 . . . . 0.0 115.63 -165.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -61.38 -28.02 68.94 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.975 3.31 . . . . 0.0 112.651 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.61 -48.72 71.31 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.921 2.088 . . . . 0.0 111.106 178.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 80.0 mtm-85 -74.98 -35.98 62.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.117 -2.864 . . . . 0.0 113.946 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -70.04 -17.8 63.27 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 119.079 -2.263 . . . . 0.0 110.519 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 43.8 t90 -91.09 -44.86 9.02 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 85.2 mt -57.88 -38.16 75.27 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -41.55 -41.46 2.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 119.297 3.073 . . . . 0.0 119.297 159.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -96.84 -26.71 15.01 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 123.018 1.39 . . . . 0.0 109.85 -162.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.5 t -86.35 -44.07 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 128.902 2.881 . . . . 0.0 111.531 174.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.6 mt -89.37 -45.1 9.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.766 -1.834 . . . . 0.0 114.611 -171.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.1 mt -103.2 -26.4 13.0 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -167.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? . . . . . 0 N--CA 1.447 -0.583 0 O-C-N 119.688 -1.883 . . . . 0.0 111.911 177.973 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.383 0 CA-C-O 115.068 -2.396 . . . . 0.0 113.649 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 19.4 mtt -69.07 -35.24 76.31 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 126.983 2.677 . . . . 0.0 111.79 168.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.9 -32.25 69.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 122.565 2.438 . . . . 0.0 109.174 -175.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -73.51 -30.84 63.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 116.056 -1.926 . . . . 0.0 108.09 174.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -76.92 -31.47 56.69 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.794 1.179 . . . . 0.0 109.007 -175.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -71.0 -31.05 67.47 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 127.71 2.404 . . . . 0.0 113.517 173.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 45.3 t60 -66.61 -36.09 81.76 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.933 1.693 . . . . 0.0 112.186 164.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -83.63 -10.54 58.15 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 118.8 -2.437 . . . . 0.0 113.678 174.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -90.36 -23.31 21.13 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 118.3 -2.75 . . . . 0.0 110.12 171.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 1.8 t-105 -76.52 -34.96 58.55 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 120.097 1.317 . . . . 0.0 112.378 167.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 19.5 mt -70.11 -9.98 57.28 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 119.06 -1.056 . . . . 0.0 112.631 175.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -79.38 -32.28 43.07 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 129.024 2.93 . . . . 0.0 115.944 162.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -68.16 -29.84 68.81 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 115.066 -2.654 . . . . 0.0 112.939 163.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 98.1 t -73.37 -43.75 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 120.897 -1.127 . . . . 0.0 113.812 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -60.31 -52.72 64.05 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 171.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 14.4 tp -58.24 -34.87 70.92 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 114.737 -2.554 . . . . 0.0 110.994 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 55.5 tp -64.2 -57.07 10.57 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 128.762 2.825 . . . . 0.0 108.396 176.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -47.04 -53.24 13.04 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 119.102 -2.249 . . . . 0.0 115.396 167.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -56.09 -40.82 74.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 117.7 -1.6 . . . . 0.0 110.507 177.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.28 -35.05 76.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.368 1.08 . . . . 0.0 113.471 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -60.61 -47.27 86.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 127.249 2.219 . . . . 0.0 111.963 173.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -56.87 -24.5 52.14 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 170.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -108.73 -3.45 17.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 131.264 3.825 . . . . 0.0 112.933 -171.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 61.17 35.67 18.4 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 126.463 2.352 . . . . 0.0 117.29 -174.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.8 mt -123.35 12.82 9.48 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 127.645 2.378 . . . . 0.0 116.219 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -59.9 -38.2 81.59 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 119.39 3.107 . . . . 0.0 119.39 175.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 2.0 mt -71.96 -48.15 11.11 Favored Pre-proline 0 N--CA 1.451 -0.414 0 O-C-N 124.728 1.268 . . . . 0.0 114.421 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -63.21 -27.83 72.73 Favored 'Trans proline' 0 N--CA 1.447 -1.218 0 C-N-CA 123.971 3.114 . . . . 0.0 112.528 172.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.6 tp -67.26 -47.26 71.25 Favored 'General case' 0 N--CA 1.449 -0.522 1 O-C-N 115.007 -4.808 . . . . 0.0 112.883 167.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 89.2 mt -65.43 -16.9 64.11 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.505 1.522 . . . . 0.0 115.066 170.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -81.92 -28.97 32.53 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 130.458 3.503 . . . . 0.0 110.332 166.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 60.5 tp -89.52 -26.24 20.99 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 118.776 -1.17 . . . . 0.0 112.956 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . 0.259 15.4 mmt -95.97 -16.37 21.74 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 119.408 3.114 . . . . 0.0 119.408 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 31.9 mt -123.68 143.94 49.95 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.232 2.613 . . . . 0.0 109.797 174.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 40.0 p -93.95 174.88 3.39 Favored Pre-proline 0 N--CA 1.452 -0.353 0 O-C-N 126.754 2.534 . . . . 0.0 112.134 177.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -62.61 -46.42 11.6 Favored 'Trans proline' 0 N--CA 1.449 -1.1 0 CA-C-O 123.9 1.542 . . . . 0.0 112.714 -170.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -53.46 -40.6 65.4 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 116.108 -1.901 . . . . 0.0 115.329 172.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -75.36 -35.37 61.13 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 127.503 3.002 . . . . 0.0 117.305 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 43.9 mtm-85 -65.73 -47.93 73.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.245 2.218 . . . . 0.0 109.444 173.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -63.95 -35.86 82.08 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 176.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.98 -50.9 71.94 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.011 1.724 . . . . 0.0 113.629 160.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 30.6 mt -56.62 -45.59 81.43 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 116.396 -1.764 . . . . 0.0 107.531 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.51 -39.8 75.49 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-O 126.104 3.058 . . . . 0.0 119.717 174.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.5 m -74.61 -35.48 62.94 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 110.565 -2.817 . . . . 0.0 111.749 173.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . 0.305 96.6 mtt180 -56.58 -32.08 64.87 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 123.611 2.914 . . . . 0.0 112.971 170.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . 0.415 13.6 t -51.2 -51.46 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 120.619 1.554 . . . . 0.0 109.712 166.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -76.1 -33.09 59.49 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 117.308 2.336 . . . . 0.0 117.308 -174.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 42.1 mt -68.26 -39.62 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 CA-C-O 114.376 -2.726 . . . . 0.0 104.82 173.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.279 53.4 t -77.5 -35.44 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 1 CA-C-N 127.647 4.748 . . . . 0.0 112.08 -179.66 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -60.44 -34.0 73.35 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 125.736 2.684 . . . . 0.0 117.946 165.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -83.73 -33.73 25.02 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 114.185 -2.816 . . . . 0.0 107.84 -176.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 27.2 mt -43.15 -46.44 5.91 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 124.424 3.283 . . . . 0.0 114.43 157.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 17.1 mt -83.01 -21.09 33.97 Favored 'General case' 0 N--CA 1.451 -0.424 1 N-CA-C 122.756 4.354 . . . . 0.0 122.756 172.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 32.2 ttm105 -69.23 -49.22 58.4 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.83 47.36 8.68 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 118.417 2.127 . . . . 0.0 118.417 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . 0.284 66.4 mm-40 -117.66 -37.1 3.52 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 116.937 -1.506 . . . . 0.0 108.485 -171.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' MET . . . . . 0.461 ' HE2' ' HB3' ' B' ' 70' ' ' GLU . 90.8 mtp -100.12 123.3 44.2 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 123.623 2.92 . . . . 0.0 113.736 -162.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 97.4 p -64.18 162.66 14.07 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 125.077 1.486 . . . . 0.0 113.669 173.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -45.08 -33.66 2.25 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.659 1.984 . . . . 0.0 115.147 165.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -67.73 -52.01 42.55 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 127.062 3.315 . . . . 0.0 108.884 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . 0.461 ' HB3' ' HE2' ' B' ' 66' ' ' MET . 24.8 mt-10 -53.5 -48.12 69.25 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 118.073 -2.892 . . . . 0.0 116.237 173.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 59.8 mt -57.18 -39.22 74.91 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 123.316 1.532 . . . . 0.0 111.548 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 32.3 tptt -77.25 -51.79 10.32 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 112.036 -2.347 . . . . 0.0 109.724 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -82.54 -4.03 56.92 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 117.002 2.223 . . . . 0.0 117.002 -169.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -137.03 -12.02 1.69 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 113.241 -1.8 . . . . 0.0 111.442 -169.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 26.8 mt -134.53 7.73 3.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 113.388 -3.196 . . . . 0.0 111.74 177.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 60.65 16.66 46.07 Favored Glycine 0 CA--C 1.522 0.488 0 C-N-CA 129.742 3.544 . . . . 0.0 112.013 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.07 108.92 18.38 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 121.731 3.975 . . . . 0.0 121.731 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.0 175.54 53.07 Favored Glycine 0 CA--C 1.523 0.577 0 O-C-N 119.317 -2.114 . . . . 0.0 113.857 -174.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 6.4 mt -50.34 -43.16 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 O-C-N 120.061 -1.847 . . . . 0.0 115.361 176.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.76 -38.87 90.24 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.467 -2.645 . . . . 0.0 111.955 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 37.8 m -67.69 -52.04 42.56 Favored 'General case' 0 N--CA 1.444 -0.744 0 O-C-N 126.268 2.23 . . . . 0.0 109.223 -176.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 37.5 mm -65.91 -41.52 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-O 115.472 -2.204 . . . . 0.0 110.51 176.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 98.3 m -54.71 -65.63 0.54 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 124.034 3.107 . . . . 0.0 109.344 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -49.85 -42.03 46.57 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 117.215 2.302 . . . . 0.0 117.215 167.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -39.09 -60.86 1.51 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 118.634 2.214 . . . . 0.0 118.634 162.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 91.6 p -75.46 -21.06 58.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 128.902 2.881 . . . . 0.0 110.806 -175.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -71.54 -33.86 69.51 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 117.206 2.298 . . . . 0.0 117.206 163.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 2.4 m -72.7 -30.82 64.53 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 116.519 -1.705 . . . . 0.0 109.998 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 11.6 mt -59.59 -52.64 64.69 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 124.391 3.269 . . . . 0.0 116.473 166.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 50.5 tttm -63.81 -19.81 65.3 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -176.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.46 -22.1 32.68 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 114.842 -2.504 . . . . 0.0 116.892 167.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.99 151.01 97.58 Favored Pre-proline 0 N--CA 1.451 -0.394 0 CA-C-N 121.868 2.122 . . . . 0.0 114.629 -169.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . 0.274 52.4 Cg_exo -49.85 133.98 34.33 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 124.844 3.696 . . . . 0.0 114.154 163.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 22.4 m -73.41 -25.61 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -158.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 12.9 pm0 -62.09 -31.48 71.93 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 118.018 -0.992 . . . . 0.0 109.55 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 33.7 tp -74.27 -46.31 42.14 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 120.09 1.314 . . . . 0.0 107.472 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.3 mtm-85 -59.26 -34.06 71.8 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 176.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -71.41 -27.28 63.19 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 30.3 t90 -81.78 -50.1 9.63 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 131.454 3.902 . . . . 0.0 111.978 173.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 40.0 mt -69.29 -19.71 63.9 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 116.518 -1.706 . . . . 0.0 115.55 -170.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -60.29 -36.6 78.25 Favored 'General case' 0 N--CA 1.452 -0.355 1 CA-C-O 111.663 -4.018 . . . . 0.0 114.91 174.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -86.17 -36.88 19.24 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 123.574 2.897 . . . . 0.0 112.422 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 37.5 t -49.97 -61.74 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 126.292 1.837 . . . . 0.0 108.566 169.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 80.4 mt -78.16 -48.62 15.52 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 118.168 -1.413 . . . . 0.0 111.13 -165.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 57.4 mt -88.86 27.86 1.26 Allowed 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.886 -2.384 . . . . 0.0 110.642 -164.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -130.01 7.42 5.1 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 128.244 2.618 . . . . 0.0 111.983 171.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 71.2 m -87.73 -9.4 54.14 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.347 2.659 . . . . 0.0 115.098 163.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.683 2.793 . . . . 0.0 109.596 168.636 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 44.4 ttm . . . . . 0 N--CA 1.474 0.732 0 CA-C-O 117.787 -1.102 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.38 136.77 57.44 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.421 1.488 . . . . 0.0 110.296 175.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -104.27 163.15 12.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.969 2.508 . . . . 0.0 112.951 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -158.72 146.08 17.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 116.914 -3.616 . . . . 0.0 108.896 -169.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 59.0 p -154.66 173.81 4.44 Favored Pre-proline 0 N--CA 1.452 -0.326 0 C-N-CA 127.796 2.439 . . . . 0.0 117.512 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -69.62 -29.6 24.27 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 120.926 1.084 . . . . 0.0 113.412 171.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -150.1 145.99 26.66 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.696 2.398 . . . . 0.0 111.763 -171.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t -153.44 129.25 10.16 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 170.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.41 -24.98 67.7 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 114.783 -2.532 . . . . 0.0 112.138 176.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.27 -21.72 66.29 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 116.521 -1.704 . . . . 0.0 114.867 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 58.9 mtt -85.77 -34.35 21.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 127.179 2.799 . . . . 0.0 109.386 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.09 -33.06 75.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 123.347 1.546 . . . . 0.0 110.565 173.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -78.22 -23.75 47.32 Favored 'General case' 0 N--CA 1.449 -0.495 1 O-C-N 115.375 -4.578 . . . . 0.0 114.294 178.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -84.2 -38.11 20.99 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.685 -1.15 . . . . 0.0 111.797 175.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -37.78 82.42 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 118.603 0.638 . . . . 0.0 112.174 169.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -59.58 -35.68 74.76 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 116.637 -2.025 . . . . 0.0 113.762 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -75.04 -35.93 61.88 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 130.002 3.321 . . . . 0.0 110.056 -176.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -67.9 -50.53 55.68 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.559 1.144 . . . . 0.0 111.796 173.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 17.5 t-105 -58.39 -46.09 87.05 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 117.673 2.471 . . . . 0.0 117.673 167.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -66.11 -21.94 66.38 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 113.607 -3.092 . . . . 0.0 114.279 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -60.67 -44.76 96.1 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 122.148 2.249 . . . . 0.0 112.947 165.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -57.0 -44.03 82.33 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 128.108 2.563 . . . . 0.0 105.321 -176.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 34.2 t -67.2 -34.24 68.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 116.828 -1.558 . . . . 0.0 113.682 -177.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -84.19 -43.53 14.85 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 125.859 1.974 . . . . 0.0 109.139 -172.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 21.1 tp -56.97 -37.47 71.62 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 117.159 -1.4 . . . . 0.0 109.779 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 17.1 tp -76.83 -31.84 57.16 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 120.014 1.279 . . . . 0.0 109.529 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -59.2 -46.14 89.2 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 126.725 2.01 . . . . 0.0 114.989 169.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -60.96 -36.86 80.51 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 129.768 3.227 . . . . 0.0 113.644 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.28 -25.42 62.44 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 128.253 2.621 . . . . 0.0 114.271 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -61.52 -25.65 67.42 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.896 2.078 . . . . 0.0 112.754 169.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -93.44 -0.92 56.28 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 118.44 -2.663 . . . . 0.0 113.097 -174.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -134.97 18.42 3.47 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 120.759 1.618 . . . . 0.0 114.139 165.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 67.02 20.12 10.46 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.865 1.266 . . . . 0.0 113.885 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 94.2 mt -85.35 10.5 12.49 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 174.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -74.68 -40.11 61.59 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 118.243 -2.785 . . . . 0.0 112.872 -171.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.285 26.0 mt -62.61 -52.94 61.35 Favored Pre-proline 0 N--CA 1.446 -0.644 0 C-N-CA 129.405 3.082 . . . . 0.0 113.692 167.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -55.28 -41.93 73.51 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 N-CA-C 117.563 2.101 . . . . 0.0 117.563 170.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 64.0 tp -56.48 -37.85 70.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.132 1.373 . . . . 0.0 112.935 171.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 32.7 mt -92.08 -5.87 51.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -84.03 -21.51 31.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.463 1.905 . . . . 0.0 110.017 163.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 27.4 tp -83.26 -45.02 14.31 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 126.696 3.141 . . . . 0.0 116.524 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 3.9 mmt -87.2 -7.52 57.85 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 111.616 -2.538 . . . . 0.0 114.899 -162.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 10.0 mp -137.28 161.09 37.18 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 127.247 2.219 . . . . 0.0 109.28 -175.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 23.3 p -100.38 164.97 15.29 Favored Pre-proline 0 N--CA 1.449 -0.495 0 O-C-N 119.231 -2.168 . . . . 0.0 110.465 172.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -41.28 -46.55 5.57 Favored 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 123.352 2.701 . . . . 0.0 115.036 171.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.75 -13.54 58.89 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 127.162 2.789 . . . . 0.0 115.286 -174.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -87.78 -30.22 20.42 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 131.229 3.812 . . . . 0.0 112.132 174.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 87.5 mtm-85 -71.33 -43.03 67.79 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 116.762 -1.589 . . . . 0.0 113.738 163.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -64.21 -23.69 67.4 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 125.083 1.489 . . . . 0.0 111.759 172.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.45 -50.36 70.07 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 127.652 2.381 . . . . 0.0 109.838 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 17.0 mt -77.57 -32.44 53.78 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 118.174 -2.828 . . . . 0.0 114.364 176.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.58 -44.73 85.93 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 118.677 -1.725 . . . . 0.0 115.157 164.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 26.9 m -73.15 -30.73 63.79 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 113.932 -2.937 . . . . 0.0 114.421 169.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 23.0 mtt180 -68.71 -36.14 78.06 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 125.891 3.95 . . . . 0.0 115.288 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 14.3 t -57.24 -36.54 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 129.253 3.021 . . . . 0.0 108.786 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 24.1 mtp180 -78.7 -24.07 45.22 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 121.49 0.662 . . . . 0.0 110.545 -176.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 61.8 mt -65.95 -49.4 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 O-C-N 117.691 -3.13 . . . . 0.0 108.174 174.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 96.6 t -53.57 -53.25 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 C-N-CA 128.512 2.725 . . . . 0.0 112.637 173.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -58.56 -39.3 79.9 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.433 1.493 . . . . 0.0 112.333 174.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -80.11 -37.33 33.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 120.927 1.694 . . . . 0.0 111.918 -177.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 80.8 mt -59.43 -36.8 76.58 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 169.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 70.8 mt -84.47 -36.2 22.46 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 125.05 1.469 . . . . 0.0 111.378 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 34.1 ttm180 -52.69 -60.76 2.87 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 117.579 -3.201 . . . . 0.0 110.357 173.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.7 49.29 6.19 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 130.65 3.976 . . . . 0.0 114.594 174.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -123.95 18.85 9.3 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 126.132 2.873 . . . . 0.0 113.372 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 14.5 mtt -116.45 131.91 56.82 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 117.07 -3.519 . . . . 0.0 110.015 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 54.2 p -95.37 162.78 13.52 Favored 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 132.424 4.29 . . . . 0.0 110.935 175.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -50.03 -33.28 17.63 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 116.65 2.093 . . . . 0.0 116.65 -169.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -72.59 -40.03 66.89 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.032 0.933 . . . . 0.0 111.336 177.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -68.08 -36.95 80.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 172.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 48.3 mt -55.67 -37.73 68.68 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.072 1.749 . . . . 0.0 112.066 164.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . 0.363 83.7 tttt -66.75 -63.33 1.09 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.114 0.566 . . . . 0.0 112.45 170.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -70.14 -42.56 72.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 115.284 -2.293 . . . . 0.0 111.154 -169.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -86.41 -48.81 8.11 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 122.391 2.359 . . . . 0.0 116.025 176.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.413 5.3 mp -74.28 -46.4 41.53 Favored 'General case' 0 N--CA 1.451 -0.377 1 CA-C-N 126.611 4.278 . . . . 0.0 113.62 -173.09 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.23 -160.74 52.55 Favored Glycine 0 C--N 1.338 0.639 0 C-N-CA 129.574 3.464 . . . . 0.0 113.12 -175.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -52.77 -27.77 19.42 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 116.352 1.982 . . . . 0.0 116.352 171.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.58 -19.19 26.21 Favored Glycine 0 C--N 1.338 0.661 1 CA-C-O 110.691 -5.505 . . . . 0.0 115.127 175.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 6.3 tt -55.36 -33.66 32.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 1 O-C-N 130.606 4.357 . . . . 0.0 110.683 176.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.54 -40.62 61.59 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.901 -2.999 . . . . 0.0 113.195 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 22.0 m -47.52 -30.53 3.58 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 116.907 2.188 . . . . 0.0 116.907 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 30.8 mm -109.32 -6.63 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 128.318 2.647 . . . . 0.0 115.481 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.9 p -118.94 -17.58 9.03 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 118.483 2.771 . . . . 0.0 118.483 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -105.4 134.51 48.4 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.441 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 108.08 171.55 21.63 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 125.895 1.712 . . . . 0.0 114.584 168.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 89.3 p -65.94 -21.76 66.45 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.163 2.481 . . . . 0.0 116.868 -171.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 57.1 m-80 -95.45 13.44 25.92 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 127.136 2.772 . . . . 0.0 115.754 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 48.7 p -77.73 172.22 13.75 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 128.459 3.981 . . . . 0.0 113.607 -173.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 40.9 tp -59.91 -28.94 68.02 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 117.621 -3.174 . . . . 0.0 113.737 -165.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -108.2 13.04 26.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.214 -2.179 . . . . 0.0 111.4 -177.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -132.09 -33.86 1.3 Allowed 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -27.92 149.14 0.03 OUTLIER Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 127.514 2.326 . . . . 0.0 115.199 147.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -62.27 153.81 67.58 Favored 'Trans proline' 0 N--CA 1.45 -1.077 0 CA-C-O 125.577 2.241 . . . . 0.0 110.722 -175.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 47.8 t -69.08 -50.53 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 C-N-CA 129.91 3.284 . . . . 0.0 106.762 -172.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -46.19 -36.96 6.49 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 123.301 1.524 . . . . 0.0 113.277 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 23.1 tp -76.07 -43.26 44.49 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 117.443 -3.286 . . . . 0.0 108.474 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -66.1 -37.85 86.79 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 115.042 -2.409 . . . . 0.0 106.428 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -66.05 -55.81 14.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 128.707 2.803 . . . . 0.0 110.003 178.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -52.64 -47.36 67.11 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 128.193 3.433 . . . . 0.0 112.362 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 45.3 mt -61.31 -35.76 78.23 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 129.212 3.005 . . . . 0.0 111.913 173.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -72.21 -42.52 65.67 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 116.781 -3.699 . . . . 0.0 112.64 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -56.48 -47.23 79.69 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 129.52 3.128 . . . . 0.0 106.368 176.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 96.4 t -82.2 -62.12 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 124.631 2.158 . . . . 0.0 113.602 -173.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 69.0 mt -71.42 -14.64 62.22 Favored 'General case' 0 N--CA 1.443 -0.775 0 O-C-N 117.318 -3.364 . . . . 0.0 118.214 -172.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 70.6 mt -129.73 39.83 3.66 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 115.375 1.621 . . . . 0.0 115.375 -177.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 46.6 pttt . . . . . 0 N--CA 1.449 -0.502 0 O-C-N 120.966 -1.084 . . . . 0.0 113.766 -173.385 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 61.2 p . . . . . 0 N--CA 1.447 -0.624 0 CA-C-O 114.026 -2.892 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -74.67 -54.97 0.08 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.039 0 CA-C-N 124.473 2.633 . . . . 0.0 108.127 -172.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -125.33 146.56 49.52 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-O 116.674 -1.632 . . . . 0.0 111.403 147.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 38.4 t -76.49 133.45 39.79 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 115.778 -2.058 . . . . 0.0 109.778 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.24 -15.3 0.89 Allowed 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 117.904 2.557 . . . . 0.0 117.904 162.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . 0.262 . . -81.95 -35.81 28.65 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 128.257 3.885 . . . . 0.0 113.727 177.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 2.0 mmm -79.59 -31.07 41.74 Favored 'General case' 0 N--CA 1.452 -0.34 1 O-C-N 116.177 -4.077 . . . . 0.0 113.182 167.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.45 94.94 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 118.205 -2.809 . . . . 0.0 112.793 173.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -46.3 -54.66 8.51 Favored 'General case' 0 N--CA 1.45 -0.425 1 CA-C-O 130.069 4.747 . . . . 0.0 115.953 165.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -64.67 -39.94 94.56 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 109.563 -3.471 . . . . 0.0 113.362 -169.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -16.23 63.08 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 176.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -85.0 -35.86 21.68 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -94.43 -29.36 15.01 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.603 1.961 . . . . 0.0 113.517 -166.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -69.02 -10.15 56.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 113.91 -2.948 . . . . 0.0 110.442 156.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . 0.35 2.7 t-105 -82.8 -38.04 23.67 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 124.4 3.273 . . . . 0.0 110.501 173.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 41.7 mt -71.14 -20.01 62.36 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 113.306 -1.77 . . . . 0.0 111.379 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 36.2 ttt180 -64.11 -35.34 80.45 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 121.356 1.889 . . . . 0.0 112.855 167.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -72.85 -47.2 48.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.591 1.957 . . . . 0.0 111.455 168.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . 0.439 18.4 t -58.25 -41.48 81.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 O-C-N 117.447 -3.283 . . . . 0.0 107.782 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -71.7 -31.66 66.99 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 176.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 22.6 tp -70.94 -36.59 72.66 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 123.587 1.661 . . . . 0.0 113.553 171.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 25.1 tp -68.51 -38.72 81.18 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 119.535 -1.978 . . . . 0.0 112.302 172.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 ttpp -58.75 -50.89 72.23 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.749 -3.095 . . . . 0.0 111.009 174.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -60.17 -21.08 61.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.181 -2.199 . . . . 0.0 115.677 175.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.64 -46.47 17.13 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 127.004 2.122 . . . . 0.0 110.012 174.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -58.29 -21.8 50.29 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 121.706 2.048 . . . . 0.0 112.943 173.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -85.46 -14.68 45.35 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.156 1.382 . . . . 0.0 114.587 -171.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -128.3 10.12 6.23 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 120.163 -1.585 . . . . 0.0 113.915 173.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 52.45 38.14 24.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 -172.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 21.1 mt -99.2 16.9 21.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 119.175 3.028 . . . . 0.0 119.175 159.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -67.58 -60.88 2.2 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.319 3.448 . . . . 0.0 108.839 -171.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.98 -29.6 3.17 Favored Pre-proline 0 N--CA 1.449 -0.511 0 CA-C-O 116.372 -1.775 . . . . 0.0 114.104 -174.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.286 53.9 Cg_exo -68.13 -29.89 32.48 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 N-CA-C 116.044 1.517 . . . . 0.0 116.044 164.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 18.7 tp -71.77 -46.87 57.0 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 115.445 -2.217 . . . . 0.0 112.49 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 20.4 mt -55.28 -44.03 75.28 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 126.144 2.153 . . . . 0.0 116.577 170.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -77.32 -27.65 52.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.833 3.208 . . . . 0.0 112.153 -176.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 23.9 tp -54.39 -50.3 67.86 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 117.209 -3.432 . . . . 0.0 111.76 162.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 16.9 mmt -73.19 -39.42 65.61 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 119.604 3.187 . . . . 0.0 119.604 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 21.5 mt -114.52 129.73 56.69 Favored 'General case' 0 N--CA 1.447 -0.587 1 O-C-N 116.056 -4.153 . . . . 0.0 109.695 -167.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 70.8 p -77.38 159.44 77.5 Favored Pre-proline 0 N--CA 1.449 -0.518 0 C-N-CA 126.526 1.93 . . . . 0.0 109.545 176.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -46.37 -38.38 20.56 Favored 'Trans proline' 0 N--CA 1.449 -1.11 1 C-N-CA 125.982 4.455 . . . . 0.0 116.557 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -76.2 -29.09 57.49 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 117.58 -3.2 . . . . 0.0 110.953 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -70.94 -43.85 67.32 Favored 'General case' 0 N--CA 1.446 -0.665 1 O-C-N 116.091 -4.13 . . . . 0.0 104.376 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 13.4 mtm-85 -61.69 -37.64 84.86 Favored 'General case' 0 N--CA 1.448 -0.54 1 O-C-N 114.985 -4.822 . . . . 0.0 114.012 169.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -69.88 -38.35 76.35 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.11 -28.32 66.37 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 116.604 -1.665 . . . . 0.0 111.019 165.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . 0.271 21.3 mt -74.26 -39.46 62.99 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 123.921 3.055 . . . . 0.0 113.699 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -56.0 -39.51 79.51 Favored Glycine 0 C--N 1.333 0.385 0 CA-C-O 122.445 1.025 . . . . 0.0 113.885 167.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 73.7 m -80.17 -28.02 38.86 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.574 -0.813 . . . . 0.0 110.813 -174.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -71.04 -20.87 62.33 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 116.99 -3.569 . . . . 0.0 112.074 175.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.95 -45.52 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 166.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.579 2.7 ptm180 -68.74 -37.34 79.35 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 128.05 2.54 . . . . 0.0 115.698 173.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 27.8 mt -60.1 -46.21 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 119.945 -1.722 . . . . 0.0 108.3 172.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 47.0 t -66.0 -38.54 82.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 CA-C-N 122.669 2.486 . . . . 0.0 113.387 178.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -62.65 -40.9 98.49 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.343 -1.313 . . . . 0.0 109.179 -177.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -82.31 -22.92 35.41 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 115.189 -2.339 . . . . 0.0 108.32 -176.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 25.9 mt -62.65 -37.6 87.03 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 120.774 1.624 . . . . 0.0 111.219 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 32.1 mt -70.3 -43.63 69.99 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 125.653 1.846 . . . . 0.0 114.3 172.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . 0.37 32.0 ttm180 -74.1 -37.9 64.01 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 128.437 2.695 . . . . 0.0 111.744 -172.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 48.31 46.04 28.32 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 122.593 3.797 . . . . 0.0 122.593 170.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -126.94 -35.99 2.23 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 127.485 2.314 . . . . 0.0 110.032 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 20.5 mtt -74.7 51.1 0.46 Allowed 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 147.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 49.6 p -76.13 -172.88 2.18 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -173.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.333 35.5 tp60 68.23 -78.33 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 115.545 -2.169 . . . . 0.0 114.73 159.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 20.1 ttt85 -106.09 -35.76 7.14 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 128.918 2.887 . . . . 0.0 111.668 176.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -76.64 -18.4 58.61 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -168.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -38.61 65.34 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 124.591 1.182 . . . . 0.0 109.217 176.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -78.25 -21.79 49.35 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 118.181 -2.824 . . . . 0.0 115.941 172.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -121.8 -7.31 9.03 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 126.905 2.628 . . . . 0.0 113.503 -156.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -119.0 -41.02 2.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 128.489 2.716 . . . . 0.0 109.607 168.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.08 -29.1 27.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 119.246 0.93 . . . . 0.0 109.344 177.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 76.76 179.53 48.04 Favored Glycine 0 CA--C 1.523 0.545 0 O-C-N 118.899 -2.376 . . . . 0.0 114.296 157.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.06 -8.49 30.78 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.546 -2.738 . . . . 0.0 116.229 -148.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.75 -19.19 73.02 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-O 117.22 -1.878 . . . . 0.0 108.793 173.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 11.5 tt -47.95 -18.44 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 121.15 2.475 . . . . 0.0 114.715 167.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.2 -25.19 12.56 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 118.777 -2.452 . . . . 0.0 109.061 -168.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 7.6 m -64.6 -35.9 82.49 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 116.995 -3.566 . . . . 0.0 113.767 150.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 19.0 mm -82.64 -14.63 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 118.266 -2.771 . . . . 0.0 112.867 -171.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 77.6 p -120.68 -16.86 8.16 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.621 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -99.46 173.53 6.71 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 123.241 2.746 . . . . 0.0 106.811 169.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.01 151.67 26.9 Favored Glycine 0 C--N 1.337 0.612 0 O-C-N 119.979 -1.701 . . . . 0.0 113.566 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 5.7 p -69.46 -11.37 60.77 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 118.976 -2.485 . . . . 0.0 115.437 -151.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -150.27 42.46 0.84 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 127.164 3.364 . . . . 0.0 112.427 -176.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 1.4 p -64.2 168.82 5.07 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 127.42 2.288 . . . . 0.0 115.057 166.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.316 7.0 tt -64.16 -30.51 71.57 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 120.11 -1.619 . . . . 0.0 112.933 171.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 62.5 tttt -62.32 -38.46 89.54 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 127.581 2.352 . . . . 0.0 108.977 169.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -85.28 -27.27 26.09 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 120.477 -1.389 . . . . 0.0 111.383 -163.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . 0.285 . . 62.67 77.79 0.32 Allowed Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 127.075 2.15 . . . . 0.0 108.453 163.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_exo 21.62 29.29 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.18 0 N-CA-C 122.223 3.893 . . . . 0.0 122.223 46.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -57.09 -36.42 51.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 C-N-CA 130.717 3.607 . . . . 0.0 110.546 -171.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.61 -40.28 49.87 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 113.217 -1.81 . . . . 0.0 114.225 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 48.3 tp -52.19 -53.15 46.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 130.667 3.587 . . . . 0.0 106.857 165.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -50.42 -45.63 55.86 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 174.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -63.35 -32.31 73.7 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 128.373 2.669 . . . . 0.0 114.126 -176.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 77.2 t90 -80.85 -44.08 18.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 125.69 2.662 . . . . 0.0 114.47 -178.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 70.1 mt -61.94 -32.19 72.58 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 117.236 -3.415 . . . . 0.0 111.324 165.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -69.59 -19.58 63.66 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 118.902 2.927 . . . . 0.0 118.902 178.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -90.02 -44.93 9.51 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 119.164 -2.21 . . . . 0.0 108.856 171.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 37.6 t -84.42 -34.33 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 O-C-N 119.517 -1.99 . . . . 0.0 110.682 -168.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 64.2 mt -90.34 -34.41 15.7 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 117.848 -3.033 . . . . 0.0 110.225 -172.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 22.5 mt -91.2 15.58 11.57 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 128.494 2.717 . . . . 0.0 111.328 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 7.4 pttp -55.32 158.88 2.92 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 130.6 3.56 . . . . 0.0 108.294 154.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 75.1 m -116.4 23.26 12.22 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 116.854 -1.546 . . . . 0.0 109.812 -164.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 C--O 1.25 1.097 0 C-N-CA 129.409 3.084 . . . . 0.0 115.232 153.98 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 41.2 ttp . . . . . 0 N--CA 1.448 -0.538 0 CA-C-O 113.949 -2.929 . . . . 0.0 111.915 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -50.56 -48.36 57.44 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 121.731 2.06 . . . . 0.0 112.554 169.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -67.86 -39.41 83.79 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 126.157 2.884 . . . . 0.0 113.471 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -62.72 -42.96 99.91 Favored 'General case' 0 N--CA 1.449 -0.491 1 O-C-N 116.196 -4.065 . . . . 0.0 112.239 -178.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.3 22.6 mmt180 -74.38 -38.14 63.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 125.597 1.811 . . . . 0.0 111.723 -171.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -53.76 -40.52 66.27 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 161.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -40.98 96.47 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 117.422 -3.299 . . . . 0.0 111.998 177.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -60.73 -27.37 67.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.835 1.654 . . . . 0.0 112.395 177.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 8.6 t-105 -83.84 -49.52 8.97 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.777 1.631 . . . . 0.0 111.77 171.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.9 mt -58.17 -24.73 60.0 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.946 -1.721 . . . . 0.0 113.447 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -63.74 -45.16 91.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 114.527 -1.215 . . . . 0.0 112.013 173.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.432 ' CE2' ' HE2' ' A' ' 42' ' ' MET . 10.0 t80 -61.26 -45.04 96.18 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 124.649 1.218 . . . . 0.0 109.52 172.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.5 t -60.55 -32.0 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 125.23 1.581 . . . . 0.0 111.58 -176.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.91 -38.01 69.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 118.841 2.904 . . . . 0.0 118.841 160.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 28.1 tp -57.54 -49.69 75.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.359 1.063 . . . . 0.0 110.263 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 54.0 tp -70.22 -31.45 68.88 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 113.645 -3.074 . . . . 0.0 113.998 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -61.58 -44.43 97.03 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 128.165 3.416 . . . . 0.0 111.527 168.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -71.33 -26.82 62.99 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 114.022 -1.444 . . . . 0.0 113.05 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.1 -40.56 78.31 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 118.887 -2.383 . . . . 0.0 112.215 167.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.429 ' CE1' ' CD2' ' A' ' 35' ' ' HIS . 53.8 m-85 -55.58 -40.53 72.1 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 116.454 -3.904 . . . . 0.0 113.999 159.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -64.0 -32.97 74.7 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.71 2.05 . . . . 0.0 112.359 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -109.09 10.68 25.99 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 128.376 2.671 . . . . 0.0 114.64 -172.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 63.65 25.26 14.22 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 124.191 1.948 . . . . 0.0 114.911 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.9 mt -107.14 20.98 18.24 Favored 'General case' 0 N--CA 1.449 -0.488 1 O-C-N 116.13 -4.106 . . . . 0.0 115.866 164.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.429 ' CD2' ' CE1' ' A' ' 30' ' ' TYR . 46.7 p-80 -67.62 -32.63 73.47 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.824 -3.048 . . . . 0.0 113.483 175.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.286 14.4 mt -73.0 -43.63 7.87 Favored Pre-proline 0 N--CA 1.448 -0.553 0 CA-C-O 114.636 -2.602 . . . . 0.0 110.588 176.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -59.19 -37.84 89.46 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 CA-C-N 123.195 2.177 . . . . 0.0 111.993 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.0 tp -64.34 -40.54 96.09 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 116.241 -1.837 . . . . 0.0 112.631 175.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.8 mt -77.5 -17.09 58.31 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 121.573 1.988 . . . . 0.0 114.661 -171.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -74.96 -29.89 61.05 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 169.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tt -88.44 -42.87 11.87 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.933 -2.461 . . . . 0.0 106.747 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.432 ' HE2' ' CE2' ' A' ' 22' ' ' PHE . 90.4 mmm -67.55 -25.01 65.6 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 113.474 -3.155 . . . . 0.0 118.433 176.082 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.2 mt -129.25 140.62 51.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 126.279 2.237 . . . . 0.0 109.435 177.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.2 p -72.44 157.35 89.24 Favored Pre-proline 0 N--CA 1.452 -0.369 0 C-N-CA 127.103 2.161 . . . . 0.0 111.608 175.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -51.18 -42.85 51.87 Favored 'Trans proline' 0 N--CA 1.447 -1.253 1 C-N-CA 127.51 5.473 . . . . 0.0 117.746 172.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -70.73 -39.81 73.15 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 116.49 -1.719 . . . . 0.0 115.543 169.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . 0.299 71.9 mt-10 -50.52 -54.26 23.72 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 168.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.7 mtm-85 -61.67 -41.91 98.2 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 117.584 -3.197 . . . . 0.0 112.352 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -73.3 -10.12 59.42 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 120.473 1.488 . . . . 0.0 108.607 -176.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.43 -35.15 12.46 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 119.469 -2.02 . . . . 0.0 113.425 170.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.14 -24.63 62.3 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 178.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.03 -40.62 99.16 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 118.133 -1.984 . . . . 0.0 115.862 157.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 74.8 m -74.18 -29.55 61.81 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 118.634 1.217 . . . . 0.0 111.421 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -59.75 -29.18 67.98 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 116.513 -3.867 . . . . 0.0 112.213 171.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.8 t -75.74 -36.93 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-N 119.87 1.214 . . . . 0.0 109.512 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.2 mtp180 -59.1 -40.94 86.88 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 118.886 -2.384 . . . . 0.0 109.752 168.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.271 74.9 mt -65.18 -50.07 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 C-N-CA 126.163 1.785 . . . . 0.0 110.485 -177.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.1 -39.64 86.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 120.399 -1.438 . . . . 0.0 109.747 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -52.93 -55.37 23.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 121.51 1.959 . . . . 0.0 111.209 173.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -67.95 -22.72 65.03 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 117.159 -3.463 . . . . 0.0 110.638 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.8 mt -87.75 -24.4 23.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 177.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.311 29.3 tp -81.25 -22.94 38.35 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.999 2.12 . . . . 0.0 115.062 163.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . 0.292 45.7 ttm180 -77.57 -55.16 5.6 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.687 -2.508 . . . . 0.0 112.615 175.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.92 10.17 84.39 Favored Glycine 0 CA--C 1.521 0.432 1 N-CA-C 123.72 4.248 . . . . 0.0 123.72 -175.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.306 74.6 mm-40 -106.48 -24.4 12.22 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -172.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.7 ttm -78.27 126.43 30.78 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 126.418 2.324 . . . . 0.0 111.158 155.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.3 p -81.01 162.66 23.72 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 119.389 -2.069 . . . . 0.0 115.667 177.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -55.21 -35.29 64.71 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 120.67 1.577 . . . . 0.0 111.078 172.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.7 tpt85 -72.99 -21.75 60.79 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 119.122 -2.236 . . . . 0.0 110.318 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -86.79 -33.11 20.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 122.028 2.194 . . . . 0.0 110.428 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.3 mt -63.27 -30.88 71.94 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 118.62 -2.55 . . . . 0.0 109.45 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -62.65 -31.15 71.97 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 128.594 2.758 . . . . 0.0 111.133 176.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -101.22 -37.58 8.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 121.72 2.054 . . . . 0.0 112.563 175.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -98.03 -20.53 17.33 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 119.149 -2.219 . . . . 0.0 110.412 -157.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.6 mt -114.27 -8.92 12.88 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 127.72 2.408 . . . . 0.0 110.018 162.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 86.73 10.56 72.57 Favored Glycine 0 CA--C 1.523 0.539 1 O-C-N 114.822 -4.924 . . . . 0.0 115.676 170.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -96.17 121.32 37.82 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 130.401 3.48 . . . . 0.0 115.894 -162.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.16 153.33 51.87 Favored Glycine 0 C--N 1.339 0.713 0 N-CA-C 118.79 2.276 . . . . 0.0 118.79 -176.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 14.5 mt -58.5 -34.92 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 O-C-N 117.036 -3.626 . . . . 0.0 114.202 -164.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.04 -34.06 50.73 Favored 'General case' 0 N--CA 1.452 -0.363 1 O-C-N 115.944 -4.223 . . . . 0.0 116.085 -168.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 48.3 p -78.14 -30.69 49.43 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 119.713 -1.867 . . . . 0.0 108.548 173.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.286 14.5 mm -65.18 -48.17 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 O-C-N 126.04 2.088 . . . . 0.0 110.224 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 45.7 m -58.51 -43.73 89.21 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.047 -0.977 . . . . 0.0 112.824 170.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -61.14 -50.47 73.05 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 -176.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -59.96 -35.94 88.65 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-N 122.336 2.335 . . . . 0.0 113.097 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 71.0 m -60.93 -45.67 93.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -58.22 -43.4 87.68 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 117.139 -3.475 . . . . 0.0 114.784 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.0 m -63.85 -26.44 68.61 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.888 1.675 . . . . 0.0 111.421 176.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.3 tp -83.28 -35.33 25.38 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 113.114 -3.327 . . . . 0.0 109.015 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -70.34 -29.26 65.91 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 127.894 3.247 . . . . 0.0 112.662 170.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.74 3.01 56.41 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.667 1.187 . . . . 0.0 110.71 173.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.99 145.4 77.39 Favored Pre-proline 0 N--CA 1.447 -0.578 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.65 152.37 78.09 Favored 'Trans proline' 0 N--CA 1.451 -0.99 0 C-N-CA 117.17 -1.42 . . . . 0.0 114.628 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -57.76 -42.04 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-O 115.665 -2.112 . . . . 0.0 114.212 -174.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -48.11 -40.98 25.16 Favored 'General case' 0 N--CA 1.453 -0.289 1 O-C-N 130.585 4.928 . . . . 0.0 115.794 173.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 39.3 tp -75.71 -50.01 16.62 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.974 1.368 . . . . 0.0 111.248 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -57.02 -46.76 82.1 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 117.971 -2.956 . . . . 0.0 111.317 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -66.09 -34.51 78.22 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 120.467 -1.395 . . . . 0.0 111.128 -174.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 60.2 t90 -77.34 -34.69 55.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.425 -2.672 . . . . 0.0 109.336 -178.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.7 mt -78.66 -22.98 46.0 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 117.951 -2.968 . . . . 0.0 104.856 -174.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -63.59 -32.61 74.13 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 128.74 2.816 . . . . 0.0 111.733 170.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -87.78 -19.21 27.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 129.098 2.959 . . . . 0.0 112.431 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.8 t -101.37 -61.83 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 80.3 mt -87.4 -19.93 27.39 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 118.006 -2.934 . . . . 0.0 115.331 -162.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.2 mt -106.67 0.51 24.38 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 118.707 -2.496 . . . . 0.0 114.809 178.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.0 tttp . . . . . 0 N--CA 1.45 -0.475 0 N-CA-C 117.669 2.47 . . . . 0.0 117.669 -176.565 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.727 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 38.6 mtt -69.06 -35.32 76.43 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 121.681 2.037 . . . . 0.0 110.245 168.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.22 -35.87 80.23 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.048 0.928 . . . . 0.0 111.681 178.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -64.6 -52.99 54.64 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 115.715 -2.088 . . . . 0.0 112.632 164.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 42.6 tp60 -60.53 -28.09 68.14 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 123.598 2.908 . . . . 0.0 117.192 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -77.22 -38.3 51.59 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 126.333 2.968 . . . . 0.0 117.096 172.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -52.24 -51.72 56.71 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.007 -2.933 . . . . 0.0 107.812 169.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -53.79 -36.14 62.11 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 126.468 2.355 . . . . 0.0 115.301 166.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -76.92 -35.25 57.46 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 117.191 -3.443 . . . . 0.0 114.534 -175.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . 0.253 47.9 t-105 -57.68 -50.74 72.19 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.334 -1.479 . . . . 0.0 113.375 158.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 70.8 mt -68.41 -12.16 60.73 Favored 'General case' 0 N--CA 1.452 -0.375 0 O-C-N 116.841 -3.662 . . . . 0.0 110.219 -176.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -83.12 -26.42 31.03 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 122.477 2.399 . . . . 0.0 111.53 169.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -71.25 -42.17 69.18 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.021 160.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 53.6 t -69.02 -43.24 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 1 O-C-N 115.917 -4.239 . . . . 0.0 113.582 -178.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -63.87 -47.51 80.4 Favored 'General case' 0 N--CA 1.454 -0.265 1 C-N-CA 131.997 4.119 . . . . 0.0 111.643 169.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.76 -40.86 85.16 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 120.606 1.548 . . . . 0.0 111.211 176.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 67.8 tp -72.27 -36.69 69.06 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 119.316 -2.115 . . . . 0.0 105.5 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -58.83 -47.8 83.56 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 116.27 -1.824 . . . . 0.0 108.176 175.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -76.97 -30.35 55.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 122.707 2.503 . . . . 0.0 114.314 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.8 -45.86 88.93 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 170.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . 0.264 41.0 m-85 -47.8 -39.39 18.07 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 119.73 3.233 . . . . 0.0 119.73 166.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -66.93 -35.59 80.33 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.724 1.21 . . . . 0.0 109.211 177.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -94.35 -0.7 54.74 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 123.24 1.495 . . . . 0.0 113.127 -173.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.334 8.3 m-20 56.6 36.52 27.75 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 127.726 2.411 . . . . 0.0 116.482 -166.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 61.8 mt -100.26 4.86 44.47 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 29.1 p-80 -61.48 -38.74 88.39 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 128.714 2.806 . . . . 0.0 116.232 -173.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 14.7 mt -70.04 -49.37 19.05 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-O 114.492 -2.671 . . . . 0.0 110.477 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -58.01 -33.32 97.09 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 O-C-N 125.758 2.452 . . . . 0.0 117.228 174.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 37.8 tp -74.62 -45.82 42.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 113.433 -3.175 . . . . 0.0 114.814 173.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 56.8 mt -54.24 -42.3 69.73 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 126.387 2.304 . . . . 0.0 115.927 168.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -62.45 -41.25 98.61 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 31.5 tp -72.47 -36.19 68.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 115.392 -2.242 . . . . 0.0 111.928 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 22.3 mmt -88.78 -19.46 25.99 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 115.656 -2.116 . . . . 0.0 112.52 -170.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 17.1 mt -134.99 146.11 48.75 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 126.761 2.538 . . . . 0.0 111.236 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 30.0 p -88.18 158.1 49.95 Favored Pre-proline 0 N--CA 1.449 -0.482 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -176.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -36.58 -47.46 1.31 Allowed 'Trans proline' 0 N--CA 1.447 -1.207 1 C-N-CA 127.046 5.164 . . . . 0.0 115.823 173.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.89 -29.74 63.4 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 173.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -70.13 -42.49 72.52 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 126.903 3.24 . . . . 0.0 110.911 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -66.13 -51.37 58.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.452 -2.655 . . . . 0.0 112.967 178.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -55.45 -41.2 72.55 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.796 2.438 . . . . 0.0 114.457 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.0 -28.88 60.71 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.5 mt -67.11 -44.14 80.7 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 116.162 1.912 . . . . 0.0 116.162 169.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.86 -46.01 69.12 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.584 166.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 17.9 m -63.6 -51.96 62.98 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 113.834 -2.984 . . . . 0.0 107.627 -175.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -40.9 -33.82 0.34 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.585 2.754 . . . . 0.0 112.424 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 40.7 t -65.1 -42.17 93.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-O 116.27 -1.824 . . . . 0.0 107.302 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 38.4 mtp180 -72.31 -33.06 67.09 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 120.172 1.351 . . . . 0.0 111.334 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 59.5 mt -54.17 -62.62 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 123.449 2.84 . . . . 0.0 112.007 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.338 77.1 t -66.7 -33.07 61.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 C-N-CA 126.212 1.805 . . . . 0.0 110.77 -170.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.93 -28.49 68.97 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 115.223 -2.322 . . . . 0.0 116.928 165.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . 0.291 20.7 tp10 -90.07 -27.36 19.73 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 127.929 3.268 . . . . 0.0 113.157 -179.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 56.9 mt -65.87 -30.41 71.01 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 114.989 -1.005 . . . . 0.0 112.153 166.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 24.0 mt -77.85 -41.74 35.92 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.126 1.371 . . . . 0.0 113.66 170.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 28.5 ttm105 -77.13 -64.07 1.22 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 115.144 -2.36 . . . . 0.0 113.612 -174.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.66 93.25 0.04 OUTLIER Glycine 0 CA--C 1.521 0.45 0 C-N-CA 129.847 3.594 . . . . 0.0 114.172 -165.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -134.48 -60.04 0.8 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 130.762 3.625 . . . . 0.0 114.505 168.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 38.6 mtt -64.08 139.27 58.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 115.875 1.805 . . . . 0.0 115.875 -164.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 82.9 p -72.45 161.5 30.73 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 118.124 2.639 . . . . 0.0 118.124 156.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -54.16 -32.5 55.53 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 117.677 2.473 . . . . 0.0 117.677 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -65.39 -46.77 78.75 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 114.614 -2.612 . . . . 0.0 111.046 173.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -62.48 -43.92 97.65 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 127.063 2.727 . . . . 0.0 116.795 172.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 70.3 mt -56.27 -39.67 73.01 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 117.765 -1.112 . . . . 0.0 112.092 174.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -83.84 -20.91 32.33 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 121.417 1.917 . . . . 0.0 112.648 -171.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -111.67 -34.98 5.89 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 115.57 -2.157 . . . . 0.0 109.113 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -91.29 -24.63 19.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 18.6 mt -112.35 -7.84 13.95 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 130.616 3.566 . . . . 0.0 111.375 169.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.59 18.67 72.19 Favored Glycine 0 C--N 1.336 0.564 0 CA-C-N 121.815 2.098 . . . . 0.0 114.556 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.03 130.1 46.99 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -165.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.85 165.91 44.34 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 128.265 2.84 . . . . 0.0 115.276 169.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 43.1 mt -61.43 -50.7 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-O 118.483 -0.77 . . . . 0.0 112.459 -170.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.13 73.65 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.004 1.483 . . . . 0.0 115.004 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 16.1 m -62.41 -44.37 96.59 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 116.244 -1.836 . . . . 0.0 111.03 174.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 36.2 mm -73.15 -38.97 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 CA-C-N 121.911 2.141 . . . . 0.0 112.449 -178.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 30.2 m -62.38 -45.52 92.76 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 125.199 1.4 . . . . 0.0 111.878 178.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -53.77 -26.05 21.79 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 130.502 3.521 . . . . 0.0 109.751 171.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.14 -43.96 62.13 Favored Glycine 0 C--N 1.337 0.617 0 CA-C-O 124.817 2.343 . . . . 0.0 116.392 177.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . 0.381 7.1 p -61.26 -39.88 91.99 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 117.81 2.522 . . . . 0.0 117.81 175.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -67.79 -25.89 65.82 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.191 2.182 . . . . 0.0 112.899 168.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 44.9 m -78.64 -41.34 31.68 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 103.792 -2.67 . . . . 0.0 103.792 -174.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 mt -68.84 -27.2 65.62 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 117.123 -3.486 . . . . 0.0 108.901 178.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -65.1 -46.22 81.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 124.334 3.243 . . . . 0.0 115.976 174.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.33 -4.28 50.15 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 108.678 -3.874 . . . . 0.0 114.85 174.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.23 156.39 81.42 Favored Pre-proline 0 N--CA 1.449 -0.479 0 CA-C-N 122.66 2.482 . . . . 0.0 114.512 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -59.99 129.88 32.25 Favored 'Trans proline' 0 N--CA 1.45 -1.045 1 C-N-CA 126.345 4.697 . . . . 0.0 110.353 164.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.253 2.7 m -72.29 -17.09 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 116.174 -1.869 . . . . 0.0 114.314 -171.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 13.8 pm0 -74.15 -21.86 59.68 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 125.445 1.715 . . . . 0.0 113.583 171.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.6 tp -70.32 -42.0 72.52 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 118.276 -1.37 . . . . 0.0 112.624 173.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -52.47 -51.64 58.32 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 128.113 2.565 . . . . 0.0 109.371 177.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -56.27 -41.93 76.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.056 -1.429 . . . . 0.0 112.385 172.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 17.1 t90 -70.59 -42.66 70.73 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 118.32 -2.738 . . . . 0.0 112.933 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' B' ' 100' ' ' LEU . 17.4 mt -78.03 -25.42 47.86 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -168.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -49.6 -34.93 19.22 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.674 1.99 . . . . 0.0 113.296 158.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -100.4 -32.11 10.98 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 118.853 0.751 . . . . 0.0 112.643 -175.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 56.7 t -91.87 -8.91 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -177.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 40.4 mt -103.58 -43.39 5.39 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 120.293 -1.504 . . . . 0.0 114.302 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 57.5 mt -90.07 -24.7 21.08 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.848 -154.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.46 -11.79 60.58 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 113.574 -3.107 . . . . 0.0 111.356 168.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 51.2 m -76.08 5.58 6.52 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 123.533 2.879 . . . . 0.0 115.027 169.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 . . . . . 0 C--O 1.249 1.05 0 N-CA-C 121.58 3.919 . . . . 0.0 121.58 174.992 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 53.2 ttm . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 125.853 2.74 . . . . 0.0 108.229 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -53.87 139.8 32.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 -159.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -100.95 126.17 47.58 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 116.955 -3.59 . . . . 0.0 116.413 -158.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -130.24 122.27 27.74 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 129.574 3.15 . . . . 0.0 111.589 -168.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 80.7 p -151.5 146.2 18.66 Favored Pre-proline 0 N--CA 1.45 -0.429 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -171.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.45 -30.58 72.11 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 122.751 2.3 . . . . 0.0 112.987 175.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -139.49 156.56 46.85 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 117.797 -3.064 . . . . 0.0 111.316 171.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 10.7 t -148.11 132.19 17.28 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.23 -1.804 . . . . 0.0 110.674 171.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.26 -28.06 59.68 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.846 -1.549 . . . . 0.0 112.164 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.23 -38.86 88.92 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.437 1.926 . . . . 0.0 112.757 172.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 57.3 mtt -70.27 -40.07 74.56 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.158 0.983 . . . . 0.0 108.796 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.45 -24.1 60.18 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 119.998 3.333 . . . . 0.0 119.998 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -71.56 -45.79 61.27 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.131 0.972 . . . . 0.0 110.605 163.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -59.16 -32.68 70.11 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 123.888 1.804 . . . . 0.0 111.817 174.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -38.94 65.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 117.466 -3.271 . . . . 0.0 113.782 169.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -54.16 -43.15 70.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 118.44 2.755 . . . . 0.0 118.44 164.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -69.21 -39.12 78.78 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 116.102 -1.904 . . . . 0.0 112.444 172.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -60.39 -43.03 97.02 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.172 -1.871 . . . . 0.0 110.152 174.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . 0.466 ' CZ2' ' HD2' ' D' ' 48' ' ' ARG . 19.9 t-105 -69.3 -40.89 77.4 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 122.179 2.263 . . . . 0.0 111.661 176.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.62 -17.01 64.03 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 119.255 -2.153 . . . . 0.0 114.728 173.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -65.7 -34.68 78.76 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 118.552 2.797 . . . . 0.0 118.552 159.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -59.24 -43.72 92.38 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 121.762 2.074 . . . . 0.0 115.583 176.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 11.7 t -56.9 -53.59 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 O-C-N 124.41 1.069 . . . . 0.0 112.606 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -75.1 -30.93 61.04 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 126.894 2.621 . . . . 0.0 110.747 -171.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 43.3 tp -67.94 -36.09 79.52 Favored 'General case' 0 N--CA 1.453 -0.321 1 O-C-N 116.061 -4.149 . . . . 0.0 112.531 170.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . 0.284 53.4 tp -74.62 -28.57 60.94 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 130.573 3.549 . . . . 0.0 108.339 174.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -60.58 -34.33 74.03 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 124.858 3.481 . . . . 0.0 110.844 168.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -73.24 -36.88 66.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 125.787 2.708 . . . . 0.0 112.434 176.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.68 -24.4 58.78 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 112.852 -1.976 . . . . 0.0 113.331 -169.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -65.09 -21.42 66.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 119.442 -2.036 . . . . 0.0 111.797 171.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -71.78 -33.74 68.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 119.955 1.252 . . . . 0.0 113.065 -178.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -123.98 33.45 5.29 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 124.557 2.123 . . . . 0.0 115.379 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.34 0.5 OUTLIER 59.76 13.38 3.47 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 118.704 2.853 . . . . 0.0 118.704 178.01 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 18.0 mt -87.59 6.58 33.78 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 123.804 0.69 . . . . 0.0 110.399 -177.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -67.71 -32.17 72.63 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.081 0.952 . . . . 0.0 110.239 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 mt -80.18 -50.44 1.16 Allowed Pre-proline 0 N--CA 1.453 -0.298 0 O-C-N 117.346 -3.346 . . . . 0.0 111.627 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -50.23 -44.32 39.01 Favored 'Trans proline' 0 N--CA 1.446 -1.273 1 C-N-CA 126.6 4.867 . . . . 0.0 112.629 171.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 33.2 tp -63.72 -51.31 65.53 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 121.562 -0.711 . . . . 0.0 112.448 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 75.7 mt -49.05 -34.76 14.2 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 121.377 3.843 . . . . 0.0 121.377 160.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -71.22 -25.52 62.53 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 121.036 1.744 . . . . 0.0 114.704 167.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 33.3 tp -76.19 -55.5 5.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 21.1 mmt -68.86 -35.17 76.6 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 123.752 1.739 . . . . 0.0 114.696 -165.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 3.8 mp -113.33 130.53 56.25 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 119.411 -2.055 . . . . 0.0 107.113 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 49.8 p -54.83 155.9 7.42 Favored Pre-proline 0 N--CA 1.448 -0.538 0 O-C-N 128.551 3.657 . . . . 0.0 111.931 164.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . 0.305 2.1 Cg_endo -54.86 -26.92 50.68 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 124.347 3.365 . . . . 0.0 116.466 168.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -61.65 -57.06 13.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 124.321 1.013 . . . . 0.0 111.148 166.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -65.39 -27.44 68.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 -178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 69.8 mtm-85 -77.08 -47.3 20.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 123.133 1.444 . . . . 0.0 107.188 174.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -55.55 -36.72 67.1 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.586 -3.196 . . . . 0.0 113.61 171.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.16 -45.09 86.35 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 119.852 -1.78 . . . . 0.0 112.679 176.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 32.5 mt -65.12 -31.05 72.06 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 121.995 2.179 . . . . 0.0 111.918 175.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.71 -17.31 66.92 Favored Glycine 0 N--CA 1.444 -0.809 0 O-C-N 117.77 -3.081 . . . . 0.0 119.459 163.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 6.6 m -89.54 -43.53 10.74 Favored 'General case' 0 N--CA 1.45 -0.425 0 O-C-N 127.147 2.322 . . . . 0.0 109.069 178.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -67.44 -26.96 66.66 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 115.578 1.695 . . . . 0.0 115.578 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 4.6 t -62.75 -24.39 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 120.415 1.461 . . . . 0.0 111.066 168.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -97.81 -27.83 14.13 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 117.657 -3.152 . . . . 0.0 109.148 -175.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . 0.294 9.9 mt -49.23 -51.04 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 C-N-CA 127.045 2.138 . . . . 0.0 114.419 159.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 82.6 t -59.79 -64.12 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-N 113.482 -1.69 . . . . 0.0 109.839 170.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -43.87 -50.21 8.05 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 114.907 -2.473 . . . . 0.0 117.07 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -73.8 -19.24 60.81 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 112.798 -3.477 . . . . 0.0 115.712 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 16.4 mt -73.88 -36.15 64.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 128.333 2.653 . . . . 0.0 114.269 162.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 94.8 mt -73.02 -39.36 66.06 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.897 2.079 . . . . 0.0 111.318 169.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 38.0 ttm105 -70.31 -44.21 68.76 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 116.082 -1.913 . . . . 0.0 112.477 171.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.44 15.73 68.55 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 126.101 1.81 . . . . 0.0 116.425 171.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -85.26 42.45 0.95 Allowed 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 116.716 -3.814 . . . . 0.0 113.016 -177.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 46.6 mtt -125.36 143.69 50.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 117.509 2.411 . . . . 0.0 117.509 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 7.3 p -72.89 175.54 6.48 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 119.716 -1.865 . . . . 0.0 108.828 171.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -65.3 -34.9 79.44 Favored 'General case' 0 N--CA 1.45 -0.449 1 O-C-N 116.177 -4.077 . . . . 0.0 111.116 172.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 20.6 ttp-105 -55.98 -60.63 3.2 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 130.704 3.602 . . . . 0.0 110.525 172.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -60.25 -35.54 75.72 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 125.726 1.61 . . . . 0.0 115.291 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 48.5 mt -56.09 -51.84 66.46 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 125.705 1.878 . . . . 0.0 112.579 167.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -67.11 -33.12 74.78 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 118.132 -2.855 . . . . 0.0 113.356 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -95.61 14.34 23.26 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.973 -171.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -150.6 -40.06 0.13 Allowed 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 116.39 -3.944 . . . . 0.0 111.688 -165.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mp -84.29 -33.23 24.02 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.909 -1.12 . . . . 0.0 113.105 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 52.97 -159.29 3.54 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 115.34 -2.922 . . . . 0.0 117.832 -173.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.57 -18.61 62.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 120.483 3.512 . . . . 0.0 120.483 -174.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.7 -20.84 62.25 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 129.542 3.448 . . . . 0.0 114.039 172.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 19.3 tt -46.73 -29.88 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 126.656 2.033 . . . . 0.0 116.4 171.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -85.24 -8.47 58.53 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.563 3.145 . . . . 0.0 108.339 -173.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 70.0 m -76.46 -43.64 39.08 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.564 -3.21 . . . . 0.0 112.469 172.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 31.4 mm -81.99 -39.61 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 112.508 -2.133 . . . . 0.0 115.11 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . 0.292 13.9 p -95.72 -11.8 26.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 120.774 3.62 . . . . 0.0 120.774 -175.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -114.09 146.26 40.49 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 117.526 -3.234 . . . . 0.0 109.988 175.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 99.48 -175.91 28.42 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 129.724 3.535 . . . . 0.0 117.276 169.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 3.6 m -68.78 -21.21 64.36 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 126.57 1.948 . . . . 0.0 116.243 -168.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -101.81 -3.0 28.76 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 25.5 p -67.39 162.19 23.54 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 124.04 1.876 . . . . 0.0 112.167 -163.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 7.8 tp -52.82 -39.38 62.38 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 120.365 3.468 . . . . 0.0 120.365 -164.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.353 90.5 mttt -69.97 -28.9 65.92 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 118.693 -2.505 . . . . 0.0 116.551 168.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.49 -24.94 17.08 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -166.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.23 163.2 19.12 Favored Pre-proline 0 N--CA 1.447 -0.594 0 C-N-CA 128.148 2.579 . . . . 0.0 113.44 -159.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.62 134.46 46.73 Favored 'Trans proline' 0 N--CA 1.445 -1.377 0 CA-C-N 126.066 3.202 . . . . 0.0 112.069 176.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 18.1 t -53.17 -37.9 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 130.495 3.518 . . . . 0.0 109.384 -177.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pm0 -79.01 -14.09 59.4 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 128.809 2.844 . . . . 0.0 113.353 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 37.2 tp -86.99 -47.51 8.89 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 118.971 -2.33 . . . . 0.0 111.76 166.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 34.4 mtp-105 -56.93 -43.41 81.46 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 113.03 -1.896 . . . . 0.0 114.2 171.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . 0.28 90.4 mt-30 -59.1 -26.56 64.77 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 117.135 -3.478 . . . . 0.0 117.543 168.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -86.17 -47.89 9.07 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 116.3 -4.0 . . . . 0.0 110.936 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 32.4 mt -53.07 -31.93 44.32 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 116.818 -3.676 . . . . 0.0 114.235 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -75.64 -31.25 59.75 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 122.47 2.396 . . . . 0.0 112.349 172.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -75.42 -22.18 57.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 125.178 2.418 . . . . 0.0 115.165 178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 39.2 t -98.34 -49.95 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 O-C-N 117.295 -3.378 . . . . 0.0 114.927 172.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 60.6 mt -82.42 -19.29 39.32 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 116.075 -1.917 . . . . 0.0 113.97 -171.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 88.0 mt -127.97 18.32 6.65 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 125.639 1.837 . . . . 0.0 109.456 -174.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 47.5 pttt . . . . . 0 N--CA 1.449 -0.517 0 N-CA-C 119.712 3.227 . . . . 0.0 119.712 178.053 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 54.0 p . . . . . 0 N--CA 1.453 -0.283 0 CA-C-O 115.213 -2.327 . . . . 0.0 113.602 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -82.07 -37.74 0.23 Allowed 'Trans proline' 0 N--CA 1.448 -1.185 0 C-N-CA 124.326 3.351 . . . . 0.0 114.42 -177.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -143.68 139.37 29.51 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 114.656 -2.592 . . . . 0.0 114.192 -172.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 14.5 t -59.24 123.95 18.38 Favored 'General case' 0 N--CA 1.451 -0.396 1 CA-C-N 126.513 4.233 . . . . 0.0 114.359 171.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.32 -28.85 69.6 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 128.313 2.645 . . . . 0.0 109.749 173.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.8 -50.33 51.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 130.889 3.676 . . . . 0.0 105.587 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 11.1 mmt -61.45 -37.4 83.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.7 -42.43 83.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 117.999 -1.0 . . . . 0.0 113.468 174.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -65.24 -62.47 1.52 Allowed 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 168.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -44.71 -30.83 1.01 Allowed 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 120.511 1.505 . . . . 0.0 114.841 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.385 0.0 OUTLIER -83.72 -14.74 50.93 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 118.789 -2.444 . . . . 0.0 116.569 -174.401 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -82.76 -32.8 27.63 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 127.249 2.22 . . . . 0.0 111.869 157.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -74.82 -40.46 61.07 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 126.044 2.09 . . . . 0.0 111.023 -175.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -69.9 -6.99 36.65 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 125.92 2.013 . . . . 0.0 115.678 169.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -85.27 -52.7 5.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 128.735 2.814 . . . . 0.0 110.715 170.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 65.6 mt -57.07 -18.5 14.65 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 118.996 2.962 . . . . 0.0 118.996 168.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 59.5 ttt180 -66.94 -31.2 71.63 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 127.531 2.332 . . . . 0.0 109.197 169.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -87.59 -30.03 20.8 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 126.715 2.51 . . . . 0.0 108.89 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 81.5 t -65.78 -33.72 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 118.144 -2.848 . . . . 0.0 110.948 169.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -73.16 -46.07 52.95 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 127.918 2.487 . . . . 0.0 112.343 169.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 15.5 tp -56.74 -40.77 76.35 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 120.653 1.57 . . . . 0.0 113.626 175.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 tp -77.95 -39.54 42.29 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 115.744 -2.074 . . . . 0.0 114.849 175.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp -53.12 -57.24 11.12 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 122.362 2.346 . . . . 0.0 117.249 165.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -57.95 -32.81 68.19 Favored 'General case' 0 N--CA 1.446 -0.634 1 O-C-N 129.913 4.508 . . . . 0.0 111.456 173.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.48 -23.8 50.3 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 121.285 1.857 . . . . 0.0 113.525 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -64.34 -34.15 77.49 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 124.08 3.127 . . . . 0.0 110.72 162.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -89.23 3.5 51.79 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 129.677 3.191 . . . . 0.0 114.279 -173.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 57.3 p30 -135.28 13.68 3.53 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 119.331 0.968 . . . . 0.0 112.945 155.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.262 0.6 OUTLIER 54.24 38.6 29.62 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 117.114 -1.422 . . . . 0.0 111.471 -178.704 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 92.6 mt -86.0 13.68 7.27 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.404 2.366 . . . . 0.0 116.778 155.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.21 -47.7 55.86 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 125.395 1.478 . . . . 0.0 112.086 -164.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 3.6 mt -64.14 -52.32 56.12 Favored Pre-proline 0 N--CA 1.448 -0.53 0 CA-C-O 114.733 -2.556 . . . . 0.0 111.283 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.61 -34.21 14.74 Favored 'Trans proline' 0 N--CA 1.447 -1.233 0 C-N-CA 124.487 3.458 . . . . 0.0 116.642 166.247 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 51.9 tp -85.8 -34.04 21.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.863 2.172 . . . . 0.0 116.863 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 19.9 mt -71.34 -34.31 70.41 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 126.436 3.017 . . . . 0.0 111.676 169.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 19.5 m-20 -72.68 -35.31 67.64 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 117.626 -3.171 . . . . 0.0 111.913 174.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 14.6 tp -68.2 -38.72 82.27 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 123.746 1.736 . . . . 0.0 109.584 169.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.2 mmt -79.03 -38.15 37.26 Favored 'General case' 0 N--CA 1.452 -0.371 1 O-C-N 116.171 -4.081 . . . . 0.0 115.198 -176.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 17.2 mt -109.94 140.22 44.17 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.251 1.42 . . . . 0.0 112.839 -179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 64.0 p -68.51 168.12 15.73 Favored Pre-proline 0 N--CA 1.453 -0.282 0 C-N-CA 128.1 2.56 . . . . 0.0 112.451 167.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -57.8 -42.24 61.33 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.552 3.501 . . . . 0.0 115.831 177.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -81.99 -18.27 43.98 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 126.2 2.187 . . . . 0.0 114.791 -175.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -71.12 -44.21 66.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 170.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . 0.466 ' HD2' ' CZ2' ' C' ' 19' ' ' TRP . 41.1 mtm-85 -68.36 -40.42 81.47 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 171.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.06 -38.28 79.04 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 116.377 1.991 . . . . 0.0 116.377 167.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.329 . . -61.51 -43.23 99.24 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.956 -1.715 . . . . 0.0 113.135 168.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.27 -45.77 92.15 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.773 -1.829 . . . . 0.0 115.282 175.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.26 -40.12 91.28 Favored Glycine 0 CA--C 1.525 0.658 0 O-C-N 126.762 2.539 . . . . 0.0 114.279 169.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 8.1 m -61.7 -43.53 98.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.286 1.835 . . . . 0.0 114.661 166.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.274 96.7 mtt180 -59.69 -41.98 91.93 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 175.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 9.1 t -41.28 -59.87 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 O-C-N 120.316 -1.49 . . . . 0.0 113.851 164.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -72.32 -24.11 61.26 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 55.9 mt -71.0 -46.22 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 C-N-CA 127.338 2.255 . . . . 0.0 107.545 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . 0.322 18.7 t -62.68 -39.19 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 174.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -66.91 -52.1 47.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 119.666 -1.896 . . . . 0.0 111.57 170.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -62.38 -31.18 71.8 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 33.1 mt -61.28 -40.45 94.18 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 118.126 2.639 . . . . 0.0 118.126 167.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 42.1 mt -69.84 -34.47 73.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 116.953 -3.592 . . . . 0.0 111.241 167.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -64.96 -47.56 77.18 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 117.351 -3.343 . . . . 0.0 114.945 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 44.93 62.57 2.93 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-O 124.512 2.173 . . . . 0.0 116.884 -174.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -124.63 -35.37 2.74 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.0 -3.059 . . . . 0.0 112.888 170.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 28.6 mtt -75.97 58.75 1.21 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 124.284 3.22 . . . . 0.0 106.797 155.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 88.5 p -82.3 168.1 17.92 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 119.542 -1.974 . . . . 0.0 113.785 -175.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.298 8.0 tp60 69.54 -53.62 0.6 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 120.842 3.645 . . . . 0.0 120.842 167.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . 0.285 74.1 ttt180 -120.92 -33.12 3.82 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.396 2.279 . . . . 0.0 112.567 171.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.77 -26.73 40.58 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 122.675 2.489 . . . . 0.0 112.557 -167.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mt -63.23 -52.78 60.82 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.949 0.9 . . . . 0.0 111.39 174.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -68.19 -26.55 65.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 116.604 -3.81 . . . . 0.0 115.156 173.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -109.86 -26.1 9.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 124.977 3.535 . . . . 0.0 118.502 -173.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -104.52 -44.9 4.78 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 116.422 -1.751 . . . . 0.0 115.599 176.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.77 -41.09 88.27 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 124.29 0.994 . . . . 0.0 110.666 158.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 93.6 -171.05 31.56 Favored Glycine 0 C--N 1.337 0.597 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 155.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -40.13 -32.39 0.17 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 129.281 3.032 . . . . 0.0 117.357 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.73 -23.13 49.29 Favored Glycine 0 C--N 1.338 0.676 0 CA-C-O 116.52 -2.267 . . . . 0.0 118.334 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 6.5 tt -50.01 -16.25 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 131.163 3.785 . . . . 0.0 117.611 170.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . 0.276 . . -84.75 -42.46 15.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 116.546 -3.846 . . . . 0.0 114.052 174.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 96.8 m -59.17 -27.55 65.78 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 125.348 2.499 . . . . 0.0 111.754 171.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 39.0 mm -100.12 -25.32 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 O-C-N 120.204 -1.56 . . . . 0.0 112.262 -170.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 44.9 p -109.54 5.19 22.94 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 173.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 41.4 mtp85 -125.05 159.96 30.13 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.664 0.745 . . . . 0.0 109.844 172.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 87.98 151.66 22.58 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-O 125.247 2.582 . . . . 0.0 113.236 -170.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 35.7 p -84.68 2.47 41.63 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 109.58 -3.31 . . . . 0.0 116.971 -153.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -123.41 29.5 6.62 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.268 1.027 . . . . 0.0 112.888 159.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 2.1 p -63.16 173.86 1.34 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 117.198 -1.801 . . . . 0.0 114.571 169.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.6 -21.82 54.39 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 119.846 3.276 . . . . 0.0 119.846 163.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -78.49 -12.41 60.01 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 122.78 1.276 . . . . 0.0 113.328 169.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -123.75 1.07 8.76 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 113.331 -1.759 . . . . 0.0 112.536 -169.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . 0.435 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 39.55 95.86 0.04 OUTLIER Pre-proline 0 N--CA 1.451 -0.392 0 C-N-CA 127.727 2.411 . . . . 0.0 108.76 144.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . 0.435 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 84.9 Cg_exo 32.15 35.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.257 0 N-CA-C 119.587 2.88 . . . . 0.0 119.587 32.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 39.8 t -60.32 -25.9 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-O 117.263 -1.351 . . . . 0.0 107.665 -176.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -84.9 -25.21 28.08 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 126.252 2.22 . . . . 0.0 110.886 -171.94 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 29.4 tp -72.42 -35.75 68.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 124.038 0.836 . . . . 0.0 113.092 162.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -62.61 -53.15 58.93 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 123.205 1.478 . . . . 0.0 113.789 176.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -51.88 -39.94 59.83 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 118.776 -2.453 . . . . 0.0 111.031 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -73.4 -33.39 64.97 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 120.44 -1.412 . . . . 0.0 108.298 -166.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 61.2 mt -81.11 -31.98 34.05 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -174.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.19 -31.12 72.18 Favored 'General case' 0 N--CA 1.447 -0.577 1 CA-C-O 111.471 -4.109 . . . . 0.0 109.828 175.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -89.76 -36.71 15.0 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 126.727 2.517 . . . . 0.0 111.12 -177.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.377 41.8 t -78.8 -36.0 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 C-N-CA 128.508 2.723 . . . . 0.0 113.509 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 60.5 mt -96.15 -39.09 9.87 Favored 'General case' 0 N--CA 1.447 -0.61 1 CA-C-O 111.285 -4.198 . . . . 0.0 108.109 -175.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 17.6 mt -90.93 14.74 12.96 Favored 'General case' 0 N--CA 1.452 -0.347 1 CA-C-N 127.333 4.606 . . . . 0.0 113.453 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -44.46 156.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 162.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -7.76 52.48 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 127.917 3.722 . . . . 0.0 117.148 -160.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 129.555 3.142 . . . . 0.0 109.434 -179.772 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.6 ttp . . . . . 0 N--CA 1.45 -0.442 0 N-CA-C 111.216 0.08 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.58 -54.44 45.9 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -51.15 -44.04 61.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.229 2.611 . . . . 0.0 114.054 166.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -66.7 -41.02 88.7 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 113.317 -3.23 . . . . 0.0 111.951 173.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -67.47 -23.27 65.48 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 122.756 2.525 . . . . 0.0 112.647 168.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 25.1 t60 -71.82 -44.38 64.0 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 119.06 2.985 . . . . 0.0 119.06 177.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -56.15 -26.64 51.16 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 166.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -70.85 -36.9 73.07 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 123.308 2.776 . . . . 0.0 111.302 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -58.92 -42.6 90.09 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 125.944 1.698 . . . . 0.0 114.845 166.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.8 mt -70.3 -8.69 52.34 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 -71.45 -36.74 71.35 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.784 1.633 . . . . 0.0 107.996 177.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.66 -51.24 58.39 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.977 1.711 . . . . 0.0 111.886 174.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 t -57.39 -41.07 77.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 117.952 2.575 . . . . 0.0 117.952 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -61.19 -50.45 73.1 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 118.29 2.7 . . . . 0.0 118.29 161.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.9 tp -58.28 -36.55 73.45 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.115 -1.857 . . . . 0.0 109.589 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 54.2 tp -72.98 -43.93 61.66 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 116.345 -1.788 . . . . 0.0 108.846 -177.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -44.62 -60.8 1.82 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.854 1.262 . . . . 0.0 109.42 167.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -71.32 -19.2 62.34 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -171.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.54 -33.06 62.66 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 117.708 -3.12 . . . . 0.0 111.861 173.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -63.43 -26.07 68.56 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 116.762 -1.59 . . . . 0.0 112.823 170.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -91.38 12.95 18.87 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.128 1.786 . . . . 0.0 111.48 -176.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -137.9 3.16 2.44 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 130.14 3.376 . . . . 0.0 112.695 173.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 61.77 32.12 18.29 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 120.564 -1.335 . . . . 0.0 111.765 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.274 28.6 mt -105.54 -0.78 25.51 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 126.045 1.738 . . . . 0.0 114.306 172.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -58.35 -42.01 85.92 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 114.941 -2.457 . . . . 0.0 116.212 -176.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.292 6.5 mt -66.54 -47.89 56.45 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-N 123.281 2.764 . . . . 0.0 111.618 172.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -49.2 -46.63 25.05 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 122.496 2.13 . . . . 0.0 115.616 163.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . 0.265 26.4 tp -68.63 -41.23 79.74 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.986 1.374 . . . . 0.0 110.741 -177.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.8 mt -74.8 -14.36 60.68 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 117.975 -2.953 . . . . 0.0 116.862 175.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . 0.351 3.9 m-80 -72.44 -23.99 61.15 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 117.503 -3.248 . . . . 0.0 112.727 163.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.0 tt -85.7 -52.49 5.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 128.863 2.865 . . . . 0.0 112.808 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.323 83.4 mmm -68.42 -42.84 78.37 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 109.891 -3.322 . . . . 0.0 112.46 -168.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.9 mt -110.4 142.51 42.01 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.939 1.296 . . . . 0.0 109.406 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 p -84.75 151.64 58.48 Favored Pre-proline 0 N--CA 1.447 -0.579 0 C-N-CA 127.888 2.475 . . . . 0.0 113.787 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -58.34 -40.71 73.07 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 CA-C-N 126.351 3.304 . . . . 0.0 116.756 -157.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -65.34 -16.31 63.46 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 116.901 -3.624 . . . . 0.0 113.483 172.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -87.64 -28.66 21.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 119.796 1.18 . . . . 0.0 112.711 169.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 38.0 mtm-85 -75.18 -44.93 43.83 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 124.523 1.139 . . . . 0.0 108.225 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.72 -38.48 69.79 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 116.341 1.978 . . . . 0.0 116.341 167.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.64 -37.95 62.63 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.465 HD21 ' CE2' ' B' ' 22' ' ' PHE . 73.5 mt -62.3 -32.98 73.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 114.796 -2.526 . . . . 0.0 115.058 166.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.72 -32.0 68.74 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 123.065 2.666 . . . . 0.0 109.614 168.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.1 m -89.62 -28.42 19.53 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 115.578 -2.449 . . . . 0.0 110.149 -164.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -62.48 -21.23 65.31 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 126.152 2.158 . . . . 0.0 111.244 174.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.81 -49.39 82.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 115.178 -2.344 . . . . 0.0 109.76 169.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -68.33 -24.66 64.86 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 126.272 2.233 . . . . 0.0 116.711 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 55.8 mt -73.26 -47.57 46.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 116.539 -1.696 . . . . 0.0 109.267 168.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 17.1 t -65.12 -20.52 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 122.784 2.538 . . . . 0.0 110.958 171.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -74.73 -49.84 19.62 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 117.982 -2.949 . . . . 0.0 109.64 167.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -79.39 -25.67 42.08 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 120.375 1.443 . . . . 0.0 111.168 -169.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.31 -43.1 98.78 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.081 1.352 . . . . 0.0 111.266 161.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 51.7 tp -76.29 -38.69 55.78 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 123.083 2.674 . . . . 0.0 109.037 -172.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.1 ttm105 -60.34 -31.68 70.54 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 117.254 2.316 . . . . 0.0 117.254 165.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.27 2.36 4.03 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 120.877 3.111 . . . . 0.0 120.877 177.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -85.48 -47.78 9.59 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 129.927 3.291 . . . . 0.0 110.695 -166.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 36.3 ttm -73.65 142.29 46.47 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 126.509 2.38 . . . . 0.0 110.484 167.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.2 p -102.27 170.1 8.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 119.581 3.178 . . . . 0.0 119.581 175.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -58.12 -38.14 75.94 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 113.707 1.002 . . . . 0.0 113.707 -174.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -63.48 -39.84 95.51 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 116.879 2.177 . . . . 0.0 116.879 175.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -70.73 -35.14 72.55 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 127.495 2.318 . . . . 0.0 113.493 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . 0.285 56.0 mt -63.15 -40.94 99.04 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 123.284 1.516 . . . . 0.0 111.795 175.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -63.5 -17.72 63.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 114.049 -2.881 . . . . 0.0 111.251 -175.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -89.63 -64.34 1.15 Allowed 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 120.54 1.518 . . . . 0.0 109.5 158.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -65.98 -21.0 66.38 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 118.472 2.768 . . . . 0.0 118.472 -159.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.5 mt -130.49 7.33 4.89 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.875 1.27 . . . . 0.0 110.77 168.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.33 31.73 80.32 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-O 114.852 -3.193 . . . . 0.0 113.132 173.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -94.21 118.48 31.64 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.084 2.554 . . . . 0.0 110.18 -168.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.09 125.78 38.48 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 128.655 3.026 . . . . 0.0 108.477 172.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 92.3 mt -54.84 -47.08 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 120.3 2.05 . . . . 0.0 112.055 -163.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -50.73 -41.0 55.9 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 122.197 2.271 . . . . 0.0 114.564 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 19.1 p -69.83 -25.89 63.97 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 127.61 2.364 . . . . 0.0 113.719 -174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 25.7 mm -76.5 -40.16 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 165.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.6 m -62.66 -31.36 72.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.695 -2.503 . . . . 0.0 109.21 -173.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -78.81 -40.05 33.97 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 124.878 2.275 . . . . 0.0 111.962 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.61 -26.14 72.87 Favored Glycine 0 N--CA 1.449 -0.491 0 O-C-N 119.653 -1.904 . . . . 0.0 114.393 175.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.5 m -64.45 -48.33 75.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.496 2.318 . . . . 0.0 112.807 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.401 ' HA ' ' HB2' ' A' ' 90' ' ' LYS . 75.2 m-20 -75.49 -21.08 58.35 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 114.711 -2.796 . . . . 0.0 114.514 173.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.3 m -73.69 -28.93 61.99 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 117.601 -3.187 . . . . 0.0 114.571 168.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.3 tp -77.52 -27.38 51.72 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 117.631 -3.168 . . . . 0.0 109.138 172.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 41.3 mttm -69.05 -20.43 64.11 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 112.138 -3.792 . . . . 0.0 108.398 166.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -99.37 -26.9 13.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 125.579 3.809 . . . . 0.0 119.27 177.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.27 140.81 97.75 Favored Pre-proline 0 N--CA 1.449 -0.481 0 O-C-N 125.685 1.866 . . . . 0.0 108.56 168.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -83.83 158.42 13.89 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 121.537 1.491 . . . . 0.0 111.974 -165.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.6 m -61.11 -35.08 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 114.572 -2.632 . . . . 0.0 112.887 178.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.446 24.2 pm0 -53.05 -33.7 53.12 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 122.409 2.368 . . . . 0.0 116.378 163.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 15.6 tp -81.69 -51.12 8.52 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.908 -2.995 . . . . 0.0 108.453 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.3 mtm180 -60.35 -49.67 76.67 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.385 1.564 . . . . 0.0 112.933 -173.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.03 -17.8 64.93 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 126.288 2.947 . . . . 0.0 114.05 -177.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -91.44 -27.64 18.16 Favored 'General case' 0 N--CA 1.447 -0.602 1 O-C-N 114.885 -4.884 . . . . 0.0 110.366 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.5 mt -68.65 -18.01 64.21 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 118.11 2.633 . . . . 0.0 118.11 161.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -67.06 -28.04 67.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 120.36 1.437 . . . . 0.0 111.676 176.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -82.82 -4.51 58.13 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 118.757 -1.177 . . . . 0.0 113.99 -176.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 42.5 t -114.0 -47.71 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 124.443 1.097 . . . . 0.0 113.25 -173.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.5 mt -97.42 -23.67 15.97 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.319 1.048 . . . . 0.0 111.611 -172.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 14.5 mt -112.59 -25.57 9.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.1 tttp . . . . . 0 N--CA 1.45 -0.471 0 CA-C-N 122.245 2.293 . . . . 0.0 114.435 -165.033 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 116.767 2.136 . . . . 0.0 116.767 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 27.4 mtt -67.99 -36.1 79.43 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 122.228 2.285 . . . . 0.0 114.216 165.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.08 -49.37 60.8 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 118.216 2.673 . . . . 0.0 118.216 167.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 tp10 -57.48 -42.18 82.13 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 112.719 -2.037 . . . . 0.0 113.968 168.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -63.39 -42.49 98.8 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 112.657 -3.544 . . . . 0.0 112.028 176.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -69.88 -34.76 73.99 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.673 2.483 . . . . 0.0 114.405 174.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -60.61 -36.61 79.0 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.039 1.745 . . . . 0.0 110.998 170.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -83.85 -31.16 25.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 126.2 1.8 . . . . 0.0 109.635 -174.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -72.92 -34.22 66.46 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 115.491 -2.195 . . . . 0.0 107.902 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -67.34 -25.81 66.18 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 122.329 2.331 . . . . 0.0 112.975 167.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 49.7 mt -65.18 -23.04 66.99 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 123.212 2.733 . . . . 0.0 115.095 176.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -72.49 -20.86 61.3 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.119 1.767 . . . . 0.0 113.208 174.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . 0.465 ' CE2' HD21 ' A' ' 51' ' ' LEU . 84.7 t80 -71.61 -47.87 51.76 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 117.571 -1.205 . . . . 0.0 112.11 168.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 33.8 t -61.96 -41.57 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 C-N-CA 126.439 1.896 . . . . 0.0 113.908 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -68.28 -45.18 73.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 173.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 37.2 tp -61.88 -42.28 98.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 -174.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 25.9 tp -76.21 -31.4 58.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.749 2.02 . . . . 0.0 108.628 -177.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -50.41 -42.72 54.22 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 123.406 2.821 . . . . 0.0 112.767 168.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -89.38 -9.42 50.4 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 127.452 2.97 . . . . 0.0 115.102 -177.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.59 -42.85 21.54 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.826 2.05 . . . . 0.0 110.261 178.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -63.36 -34.94 78.8 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 118.041 -2.912 . . . . 0.0 107.262 170.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -75.77 4.36 8.09 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 118.846 -2.409 . . . . 0.0 116.305 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -128.91 -1.03 5.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 113.889 -1.505 . . . . 0.0 110.235 168.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.417 46.5 m-20 64.7 23.04 12.71 Favored 'General case' 0 N--CA 1.447 -0.582 2 O-C-N 115.117 -4.739 . . . . 0.0 116.749 -168.33 . . . . . . . . 3 2 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.278 83.4 mt -99.02 5.48 47.08 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.063 1.745 . . . . 0.0 111.793 174.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 14.3 p-80 -58.14 -54.31 48.36 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.797 1.239 . . . . 0.0 113.435 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 28.0 mt -62.88 -47.82 86.29 Favored Pre-proline 0 N--CA 1.448 -0.526 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.67 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -60.02 -24.03 75.17 Favored 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 124.497 3.465 . . . . 0.0 116.057 171.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . 0.329 43.2 tp -76.03 -52.07 10.97 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 125.594 1.809 . . . . 0.0 114.779 169.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . 0.307 17.3 mt -53.28 -49.69 66.42 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 124.925 1.391 . . . . 0.0 110.833 174.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -64.64 -17.77 64.34 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 119.898 -1.751 . . . . 0.0 112.831 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 12.0 tp -93.67 -30.28 15.0 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 9.0 mmt -84.05 -26.13 29.31 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 5.0 mt -126.75 134.38 50.65 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 126.288 1.835 . . . . 0.0 111.688 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 81.5 p -85.17 160.3 54.99 Favored Pre-proline 0 N--CA 1.45 -0.434 0 C-N-CA 126.006 1.723 . . . . 0.0 107.758 176.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -52.11 -30.66 41.78 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 N-CA-C 121.111 3.466 . . . . 0.0 121.111 -172.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.62 -32.66 64.17 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 124.579 1.174 . . . . 0.0 110.788 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.33 -32.7 62.92 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.567 1.947 . . . . 0.0 109.339 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 -70.6 -45.04 66.03 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 127.663 2.385 . . . . 0.0 110.102 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -63.98 -38.36 90.79 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.6 1.56 . . . . 0.0 114.014 168.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.31 -53.56 56.9 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 120.632 1.56 . . . . 0.0 112.879 167.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 27.4 mt -52.22 -38.87 59.24 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 114.631 -2.604 . . . . 0.0 117.33 175.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.75 -56.65 24.11 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 127.679 2.561 . . . . 0.0 111.768 166.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 13.6 m -74.67 -22.82 58.68 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 124.419 2.057 . . . . 0.0 113.927 -169.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 58.8 mtt180 -58.38 -37.14 74.64 Favored 'General case' 0 N--CA 1.449 -0.486 1 O-C-N 114.887 -4.883 . . . . 0.0 113.352 169.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 97.9 t -68.91 -36.81 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 124.057 0.943 . . . . 0.0 109.757 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -75.72 -33.3 60.29 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.038 -1.039 . . . . 0.0 110.304 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 54.0 mt -69.62 -47.14 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 120.401 1.455 . . . . 0.0 110.611 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.258 59.5 t -74.86 -21.01 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 O-C-N 124.479 1.112 . . . . 0.0 113.527 177.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -72.44 -38.53 68.29 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 119.286 -2.134 . . . . 0.0 113.01 175.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -61.71 -30.62 70.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.562 1.145 . . . . 0.0 109.127 171.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 1.1 mt -78.49 -26.19 45.93 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 117.893 -3.004 . . . . 0.0 111.153 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 89.4 mt -83.93 -19.92 33.86 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 119.606 3.188 . . . . 0.0 119.606 166.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 23.5 ttm105 -89.53 -71.75 0.59 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 115.976 -1.964 . . . . 0.0 111.022 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.59 75.11 1.22 Allowed Glycine 0 C--N 1.335 0.478 0 C-N-CA 125.928 1.728 . . . . 0.0 109.68 -171.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -140.5 9.62 2.24 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 121.04 2.42 . . . . 0.0 112.338 173.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 22.1 mtt -119.02 143.77 46.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 116.368 -3.957 . . . . 0.0 114.266 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 26.7 p -77.61 162.25 27.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 130.71 3.604 . . . . 0.0 112.739 164.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . 0.258 45.4 mt-30 -67.08 -33.5 75.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 -171.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -58.86 -45.31 90.45 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 160.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -59.71 -36.9 77.46 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 121.075 1.761 . . . . 0.0 112.53 171.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 90.9 mt -63.49 -33.04 74.7 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.458 175.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -84.72 -31.5 24.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.91 2.084 . . . . 0.0 112.956 -177.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -130.54 -19.69 3.01 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 117.61 -3.181 . . . . 0.0 114.422 -167.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -87.17 -13.37 44.2 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 160.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 96.6 mt -132.56 -43.74 0.91 Allowed 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.671 -3.143 . . . . 0.0 114.848 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 98.69 4.04 57.09 Favored Glycine 0 CA--C 1.522 0.476 0 CA-C-O 124.136 1.964 . . . . 0.0 110.257 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.72 80.02 6.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 117.218 -3.519 . . . . 0.0 113.066 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.42 -179.33 5.22 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-O 126.593 3.33 . . . . 0.0 110.97 159.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 45.5 mt -61.68 -40.5 86.98 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 O-C-N 117.354 -3.439 . . . . 0.0 112.407 -168.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.26 87.77 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 120.667 -1.271 . . . . 0.0 114.208 171.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 21.6 m -66.43 -34.83 78.83 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.927 1.291 . . . . 0.0 114.121 -178.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mm -81.36 -41.01 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 115.278 -2.296 . . . . 0.0 106.731 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 4.7 m -64.25 -47.54 79.24 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 131.256 3.823 . . . . 0.0 113.055 174.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 19.4 ttt180 -57.59 -51.09 70.89 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 117.237 -1.785 . . . . 0.0 114.691 167.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -45.63 -44.87 12.33 Favored Glycine 0 C--N 1.334 0.471 0 CA-C-O 115.508 -2.829 . . . . 0.0 114.94 173.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 4.3 p -77.86 -36.93 49.3 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 126.542 1.966 . . . . 0.0 112.37 -176.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -62.63 -37.57 86.83 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 106.552 -1.648 . . . . 0.0 106.552 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 68.5 m -67.31 -29.03 68.5 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 126.934 3.254 . . . . 0.0 114.712 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 70.6 mt -77.7 -38.44 47.38 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 117.706 -3.121 . . . . 0.0 116.377 173.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 52.6 tttm -64.48 -41.76 96.28 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.309 1.444 . . . . 0.0 108.801 168.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.15 -23.08 62.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 118.591 -2.568 . . . . 0.0 113.474 177.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.41 147.56 98.56 Favored Pre-proline 0 N--CA 1.448 -0.575 0 CA-C-N 121.6 2.0 . . . . 0.0 113.474 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -72.03 162.11 42.79 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 123.989 3.126 . . . . 0.0 113.315 167.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 28.0 m -82.86 -16.31 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 1 O-C-N 115.586 -4.446 . . . . 0.0 117.274 -170.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -65.24 -8.15 16.28 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.779 1.632 . . . . 0.0 114.23 163.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 31.7 tp -112.66 -52.14 2.8 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 104.457 -2.423 . . . . 0.0 104.457 -177.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . 0.275 17.8 mtp180 -58.16 -37.29 74.41 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 124.437 1.086 . . . . 0.0 112.42 -175.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -79.41 -33.91 42.24 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 127.281 2.233 . . . . 0.0 112.822 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 81.3 t90 -71.59 -39.39 70.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 121.284 -0.885 . . . . 0.0 112.359 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 86.8 mt -63.3 -30.34 71.49 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.659 170.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -54.73 -40.75 69.59 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 119.192 3.034 . . . . 0.0 119.192 169.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -97.09 -1.61 44.91 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.521 1.528 . . . . 0.0 113.797 -170.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 25.8 t -113.59 -36.9 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 O-C-N 118.226 -2.797 . . . . 0.0 109.174 176.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 55.7 mt -84.26 -75.71 0.33 Allowed 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 119.979 -1.701 . . . . 0.0 107.18 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 20.9 mt -47.73 -41.1 22.17 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 -165.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.01 3.32 4.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 115.048 -2.406 . . . . 0.0 113.674 178.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 56.4 m -94.92 9.12 40.5 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 115.213 1.561 . . . . 0.0 115.213 166.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 . . . . . 0 C--O 1.251 1.146 0 O-C-N 117.709 -3.12 . . . . 0.0 115.433 164.584 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 22.6 ttt . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.66 172.58 10.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 118.097 2.629 . . . . 0.0 118.097 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -89.67 152.27 21.45 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 66.3 tt0 -130.66 141.13 50.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 120.623 1.556 . . . . 0.0 113.464 155.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 7.9 p -124.74 148.73 60.23 Favored Pre-proline 0 N--CA 1.448 -0.53 0 O-C-N 120.076 -1.64 . . . . 0.0 114.567 -173.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -67.18 -19.8 50.35 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.259 1.973 . . . . 0.0 115.848 169.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -156.02 148.48 23.72 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 128.546 2.738 . . . . 0.0 111.36 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.8 t -147.81 127.72 13.56 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 125.301 1.626 . . . . 0.0 113.021 174.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.78 62.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 126.953 2.658 . . . . 0.0 110.807 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.53 -22.48 63.57 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 129.368 3.067 . . . . 0.0 114.034 167.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 23.0 mtt -81.57 -44.3 17.48 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 118.123 -2.861 . . . . 0.0 113.202 164.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.55 69.18 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 118.998 2.962 . . . . 0.0 118.998 177.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -76.62 -38.67 54.33 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 113.808 -1.542 . . . . 0.0 113.213 168.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -56.54 -43.41 79.86 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.909 -2.369 . . . . 0.0 113.9 170.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -47.74 83.86 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 130.107 3.363 . . . . 0.0 113.538 168.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -45.78 -49.36 15.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 162.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -69.9 -33.98 72.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 176.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.22 -27.7 67.45 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 115.955 -2.298 . . . . 0.0 113.462 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -73.13 -52.75 13.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 126.671 1.988 . . . . 0.0 112.869 169.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . 0.272 1.0 OUTLIER -62.03 -18.91 62.11 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 115.551 -2.166 . . . . 0.0 110.085 178.598 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -81.55 -44.23 17.61 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 114.935 -2.46 . . . . 0.0 112.644 176.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -48.89 -38.84 23.78 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 118.629 2.826 . . . . 0.0 118.629 171.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 43.7 t -75.04 -34.65 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 C-N-CA 127.526 2.33 . . . . 0.0 113.673 177.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -74.86 -39.54 61.5 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 122.662 2.483 . . . . 0.0 115.908 172.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 37.4 tp -55.59 -34.18 64.61 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 117.631 -3.168 . . . . 0.0 114.661 169.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . 0.283 30.5 tp -71.72 -32.52 67.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.52 1.928 . . . . 0.0 113.166 170.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -69.15 -34.3 74.76 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 125.603 1.814 . . . . 0.0 111.911 172.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 30.1 m-20 -73.17 -38.17 66.27 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 116.448 -3.907 . . . . 0.0 109.627 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.4 -32.64 65.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.723 2.809 . . . . 0.0 118.171 176.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -68.11 -18.25 64.59 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.642 1.977 . . . . 0.0 115.341 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -76.08 -23.32 55.0 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -174.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 19.5 p-10 -141.06 39.08 1.78 Allowed 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 127.417 2.287 . . . . 0.0 112.432 -166.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.345 0.8 OUTLIER 31.86 46.86 0.06 Allowed 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 118.405 2.743 . . . . 0.0 118.405 -176.073 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 27.3 mt -99.3 -2.49 36.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.619 2.081 . . . . 0.0 116.619 163.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 -58.28 -49.73 76.11 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 126.726 3.155 . . . . 0.0 110.875 -174.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 18.6 mt -74.03 -41.1 5.16 Favored Pre-proline 0 N--CA 1.447 -0.604 0 O-C-N 116.325 -3.985 . . . . 0.0 110.633 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -56.93 -39.87 88.25 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 124.26 3.306 . . . . 0.0 108.536 170.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 54.7 tp -77.96 -29.14 49.68 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 117.554 2.428 . . . . 0.0 117.554 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . 0.406 HD13 ' CH2' ' D' ' 19' ' ' TRP . 51.5 mt -67.03 -23.31 65.89 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 117.254 -1.355 . . . . 0.0 113.758 161.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -91.31 -25.12 19.59 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 118.773 -1.171 . . . . 0.0 111.605 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.32 -54.34 46.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 119.029 -2.294 . . . . 0.0 112.038 159.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 21.5 mmt -72.05 -36.92 69.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 119.169 3.025 . . . . 0.0 119.169 -171.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.2 mp -105.66 144.21 32.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 117.837 2.532 . . . . 0.0 117.837 -175.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 67.0 p -78.38 161.7 69.02 Favored Pre-proline 0 N--CA 1.448 -0.527 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 166.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -47.8 -43.31 29.39 Favored 'Trans proline' 0 N--CA 1.447 -1.255 0 C-N-CA 124.81 3.673 . . . . 0.0 112.725 166.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -58.0 -42.49 85.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 172.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -68.6 -35.43 77.33 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 127.296 3.427 . . . . 0.0 114.239 -174.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 39.5 mtm-85 -73.52 -37.64 65.58 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 118.901 -2.374 . . . . 0.0 111.735 172.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -66.04 -36.59 83.64 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 125.444 1.715 . . . . 0.0 114.818 170.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.08 96.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 128.998 2.919 . . . . 0.0 107.975 177.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 57.4 mt -84.86 -31.73 23.61 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 117.19 -3.444 . . . . 0.0 111.969 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.52 -37.85 50.38 Favored Glycine 0 CA--C 1.526 0.725 0 O-C-N 126.768 2.542 . . . . 0.0 115.049 158.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 25.8 m -77.49 -40.11 44.08 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 33.5 mtt180 -72.99 -24.95 60.83 Favored 'General case' 0 N--CA 1.448 -0.525 1 CA-C-O 110.55 -4.548 . . . . 0.0 113.405 -173.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 80.3 t -62.54 -41.93 93.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 122.623 2.465 . . . . 0.0 111.991 163.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -76.06 -29.58 58.05 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 118.574 2.805 . . . . 0.0 118.574 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 63.5 mt -59.14 -42.1 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 O-C-N 118.805 -2.434 . . . . 0.0 111.942 166.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 66.8 t -59.41 -49.26 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 C-N-CA 126.176 1.791 . . . . 0.0 111.591 174.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -64.51 -38.5 91.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 113.172 -1.831 . . . . 0.0 110.585 -172.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -73.08 -33.7 65.77 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 117.391 -3.318 . . . . 0.0 114.93 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 87.1 mt -76.36 -13.57 60.13 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 169.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 55.7 mt -93.07 -15.92 25.56 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 120.738 1.608 . . . . 0.0 108.759 170.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -94.41 -34.91 12.57 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 120.51 1.505 . . . . 0.0 113.121 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.71 3.9 74.48 Favored Glycine 0 C--N 1.339 0.739 1 CA-C-O 110.552 -5.582 . . . . 0.0 113.827 165.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -93.24 58.36 2.85 Favored 'General case' 0 N--CA 1.444 -0.758 1 CA-C-N 124.327 4.064 . . . . 0.0 112.365 -154.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 20.3 mtt -147.16 144.4 28.95 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 125.073 1.483 . . . . 0.0 111.62 -167.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . 0.275 83.0 p -64.83 162.2 16.69 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 158.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -52.21 -41.74 62.95 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 129.44 3.096 . . . . 0.0 112.952 166.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 34.0 ttp-105 -53.2 -62.98 1.3 Allowed 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 128.644 3.715 . . . . 0.0 110.022 170.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -51.84 -51.82 53.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 123.931 0.77 . . . . 0.0 113.034 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 53.7 mt -50.94 -48.46 60.86 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 121.417 1.917 . . . . 0.0 114.278 174.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 54.5 tttt -62.31 -46.78 87.2 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 121.465 1.939 . . . . 0.0 106.536 -171.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -77.18 -35.45 55.82 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 115.784 -2.055 . . . . 0.0 116.535 -177.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -79.67 -36.95 36.91 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 118.155 2.65 . . . . 0.0 118.155 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.252 7.3 mp -94.39 -27.81 15.86 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 126.011 2.07 . . . . 0.0 110.728 -176.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.18 -149.33 49.94 Favored Glycine 0 CA--C 1.523 0.581 0 O-C-N 119.946 -1.721 . . . . 0.0 113.134 -175.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -52.82 -23.06 6.19 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 116.062 1.875 . . . . 0.0 116.062 163.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.28 -7.61 84.96 Favored Glycine 0 C--N 1.337 0.595 0 CA-C-O 114.855 -3.192 . . . . 0.0 112.794 -169.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 7.4 tt -59.05 -44.15 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 1 CA-C-O 111.512 -4.089 . . . . 0.0 113.155 167.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.53 -22.66 60.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 124.682 3.401 . . . . 0.0 113.871 172.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 8.5 m -64.66 -39.14 93.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.882 1.273 . . . . 0.0 107.665 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 36.8 mm -83.11 -33.73 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 119.327 -2.108 . . . . 0.0 114.384 170.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.6 p -105.06 9.56 34.31 Favored 'General case' 0 N--CA 1.449 -0.482 1 N-CA-C 122.846 4.387 . . . . 0.0 122.846 -164.152 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 20.7 mtp85 -128.14 145.56 50.98 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 118.032 -2.917 . . . . 0.0 113.086 -178.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 96.01 166.95 34.46 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 67.3 m -65.29 -30.97 71.88 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -171.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -98.79 6.48 46.87 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -173.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 51.6 p -55.86 158.67 3.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 130.946 3.699 . . . . 0.0 114.627 165.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 48.9 tp -61.81 -32.57 72.89 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 129.664 3.186 . . . . 0.0 111.066 -151.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.25 87.1 mttt -98.59 12.39 35.43 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 120.006 3.336 . . . . 0.0 120.006 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -136.19 -11.45 1.93 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 130.457 3.503 . . . . 0.0 115.217 -179.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.5 161.38 0.33 Allowed Pre-proline 0 N--CA 1.45 -0.47 0 C-N-CA 129.815 3.246 . . . . 0.0 113.14 166.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -49.66 138.61 32.4 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 123.745 2.964 . . . . 0.0 113.46 162.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 87.5 t -61.89 -31.7 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 128.841 2.856 . . . . 0.0 110.021 -177.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 12.7 pm0 -67.44 -34.6 77.54 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 116.853 -3.654 . . . . 0.0 114.288 -176.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 9.2 tp -73.0 -42.91 62.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.689 1.996 . . . . 0.0 110.1 174.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 70.0 mtp180 -61.53 -49.43 76.72 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 125.654 1.846 . . . . 0.0 112.082 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -73.51 -37.69 65.6 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 127.406 2.282 . . . . 0.0 109.289 -176.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.1 t90 -51.6 -56.9 10.93 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 163.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 55.6 mt -65.75 -17.51 64.67 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 120.107 -1.621 . . . . 0.0 111.975 -174.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -88.98 -25.95 21.75 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 122.819 2.554 . . . . 0.0 114.954 166.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.46 -12.89 61.28 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 169.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.16 -48.7 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 C-N-CA 127.005 2.122 . . . . 0.0 113.659 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 96.1 mt -85.12 -31.02 23.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 121.888 2.131 . . . . 0.0 112.635 -169.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.1 27.74 8.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 121.034 1.743 . . . . 0.0 113.695 -168.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 14.8 pttp . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 117.214 -1.374 . . . . 0.0 113.049 -169.1 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 53.6 p . . . . . 0 N--CA 1.445 -0.697 0 CA-C-O 117.718 -1.134 . . . . 0.0 110.767 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . 0.275 15.7 Cg_exo -68.01 -24.25 39.46 Favored 'Trans proline' 0 N--CA 1.451 -0.992 1 C-N-CA 125.851 4.367 . . . . 0.0 114.147 177.171 . . . . . . . . 3 2 . 1 . 008 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -149.75 145.32 26.58 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-O 113.449 -3.167 . . . . 0.0 109.362 169.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 1.9 t -79.8 130.39 35.28 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 127.424 2.952 . . . . 0.0 108.112 173.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.37 -40.58 59.5 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 128.011 3.319 . . . . 0.0 110.905 162.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.03 -36.06 77.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 115.938 1.829 . . . . 0.0 115.938 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.269 14.0 mmt -62.05 -39.79 93.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.718 -1.134 . . . . 0.0 109.746 165.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.21 -20.46 62.81 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 122.371 2.35 . . . . 0.0 116.504 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -88.6 -44.6 10.52 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 119.152 -2.218 . . . . 0.0 107.381 171.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -62.0 -44.0 97.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.045 -1.659 . . . . 0.0 110.703 -172.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -27.97 69.78 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.27 1.952 . . . . 0.0 116.27 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -74.65 -34.21 62.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.107 1.763 . . . . 0.0 109.2 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -81.73 -23.11 36.91 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 118.003 -2.936 . . . . 0.0 112.123 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . 0.253 59.4 mt-10 -70.39 -26.03 63.52 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 117.836 -3.04 . . . . 0.0 111.848 161.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . 0.406 ' CH2' HD13 ' C' ' 39' ' ' LEU . 5.9 t-105 -82.04 -35.89 28.31 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 117.019 -1.467 . . . . 0.0 113.44 174.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.49 -25.99 68.51 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 117.0 -1.476 . . . . 0.0 110.336 173.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -73.55 -20.77 60.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 130.58 3.552 . . . . 0.0 107.949 177.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -97.52 -24.66 15.47 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 120.965 1.711 . . . . 0.0 113.014 167.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 79.6 t -65.14 -41.65 92.3 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 O-C-N 117.936 -2.977 . . . . 0.0 110.252 169.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -65.95 -40.62 91.51 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 121.945 2.157 . . . . 0.0 115.351 171.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 16.3 tp -57.76 -43.84 85.74 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 120.095 -1.628 . . . . 0.0 111.274 174.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 23.8 tp -60.02 -45.75 91.76 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 ttpp -56.05 -45.0 79.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 126.564 3.078 . . . . 0.0 110.809 176.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -69.9 -15.67 63.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 112.139 -2.3 . . . . 0.0 114.574 174.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.03 -34.87 26.17 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 127.911 2.484 . . . . 0.0 117.404 167.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -62.84 -33.45 75.28 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 121.049 -1.032 . . . . 0.0 111.416 170.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -73.8 -25.98 60.4 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 129.595 3.158 . . . . 0.0 115.489 -171.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.9 p30 -116.79 1.35 12.73 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.907 1.379 . . . . 0.0 112.788 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 70.01 29.01 4.0 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 129.825 3.25 . . . . 0.0 115.019 -178.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 61.3 mt -99.29 10.31 41.66 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 119.979 -1.701 . . . . 0.0 109.896 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.91 -57.95 9.55 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 3.1 mt -64.95 -36.93 17.93 Favored Pre-proline 0 N--CA 1.449 -0.509 0 O-C-N 121.221 -0.925 . . . . 0.0 110.786 -172.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.81 -40.25 65.18 Favored 'Trans proline' 0 N--CA 1.447 -1.221 0 N-CA-C 119.207 2.734 . . . . 0.0 119.207 162.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 16.5 tp -68.41 -43.07 78.02 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 117.073 -3.517 . . . . 0.0 112.096 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 77.1 mt -57.52 -48.38 79.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 126.515 2.384 . . . . 0.0 110.137 171.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -78.96 -29.24 43.8 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 117.439 -3.288 . . . . 0.0 108.734 -166.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.38 -54.8 41.24 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.181 0.992 . . . . 0.0 109.348 161.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 5.1 mmt -57.53 -49.16 77.24 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 114.424 -2.703 . . . . 0.0 114.624 -177.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 23.0 mt -111.09 133.03 53.78 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.464 1.906 . . . . 0.0 114.212 -164.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 76.5 p -68.1 151.0 97.53 Favored Pre-proline 0 N--CA 1.448 -0.543 0 O-C-N 126.061 2.101 . . . . 0.0 112.016 173.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -46.46 -43.82 21.64 Favored 'Trans proline' 0 N--CA 1.447 -1.215 1 C-N-CA 129.252 6.634 . . . . 0.0 114.904 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.89 -24.07 62.42 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 174.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -73.46 -25.3 60.43 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 114.187 -2.816 . . . . 0.0 112.986 166.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 26.0 mtm180 -89.31 -26.58 21.04 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 125.072 3.578 . . . . 0.0 111.743 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -51.78 -48.89 63.58 Favored 'General case' 0 N--CA 1.45 -0.455 1 C-N-CA 132.703 4.401 . . . . 0.0 111.761 159.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.3 -38.39 35.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 126.552 2.407 . . . . 0.0 115.272 -179.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.18 -34.74 78.29 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 118.214 2.672 . . . . 0.0 118.214 165.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.34 -41.62 99.74 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-O 117.665 -1.631 . . . . 0.0 115.86 166.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 52.1 m -59.58 -46.8 87.86 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 123.658 1.694 . . . . 0.0 110.016 168.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -59.16 -31.94 69.44 Favored 'General case' 0 N--CA 1.45 -0.453 2 O-C-N 114.297 -5.252 . . . . 0.0 111.011 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 99.0 t -57.37 -57.5 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 CA-C-N 122.116 2.234 . . . . 0.0 110.38 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -68.94 -27.24 65.56 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 115.63 -2.128 . . . . 0.0 114.451 176.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 79.6 mt -54.26 -66.14 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-N 121.27 1.85 . . . . 0.0 106.803 167.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 61.2 t -42.87 -51.01 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 O-C-N 120.818 -1.176 . . . . 0.0 113.765 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.36 -48.75 76.19 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -68.35 -22.51 64.67 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 117.474 -1.251 . . . . 0.0 113.505 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 31.8 mt -77.33 -3.13 38.41 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 125.397 2.522 . . . . 0.0 116.96 174.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 77.6 mt -104.01 -28.63 11.42 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.573 1.949 . . . . 0.0 111.946 168.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 39.4 ttm105 -77.49 -51.11 11.29 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.882 -3.011 . . . . 0.0 113.313 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.37 41.51 91.0 Favored Glycine 0 C--N 1.337 0.637 0 CA-C-O 116.173 -2.46 . . . . 0.0 111.362 163.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -115.95 -42.07 3.12 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 121.342 2.571 . . . . 0.0 108.212 -174.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 15.0 mmt -77.73 61.37 2.4 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 113.584 -1.644 . . . . 0.0 111.67 159.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 75.2 p -93.42 -176.49 4.13 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.192 1.397 . . . . 0.0 114.032 -173.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.371 2.8 tp-100 69.22 -109.0 0.08 Allowed 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 119.193 -2.192 . . . . 0.0 114.903 165.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -73.88 -37.29 64.78 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 116.545 -1.693 . . . . 0.0 110.477 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -69.84 -45.1 68.54 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 130.477 3.511 . . . . 0.0 113.631 -169.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.03 -18.03 59.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 113.824 -2.989 . . . . 0.0 111.377 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -106.25 -12.27 15.77 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 123.07 2.668 . . . . 0.0 116.318 174.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -119.76 -15.62 8.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 118.885 2.92 . . . . 0.0 118.885 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -124.59 -17.9 5.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 123.123 2.692 . . . . 0.0 112.204 172.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.99 -52.9 5.65 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.604 -1.665 . . . . 0.0 111.652 161.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 109.19 -167.14 12.81 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 119.257 -1.449 . . . . 0.0 112.206 146.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.09 -34.79 63.94 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -173.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -38.16 -24.14 0.02 OUTLIER Glycine 0 CA--C 1.523 0.548 0 CA-C-O 117.023 -1.987 . . . . 0.0 114.966 165.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 19.8 tt -60.64 -25.77 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 120.373 2.086 . . . . 0.0 112.847 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.85 -33.54 34.43 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 117.293 -1.337 . . . . 0.0 109.03 -176.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 33.9 m -70.57 -20.24 62.8 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 122.159 2.254 . . . . 0.0 109.929 170.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 25.1 mm -95.49 -30.64 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -173.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 7.1 p -105.19 -26.01 12.23 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 114.495 -2.669 . . . . 0.0 113.883 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.275 22.9 mtp85 -82.6 168.77 16.99 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 125.376 3.716 . . . . 0.0 112.493 167.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.92 154.24 29.37 Favored Glycine 0 C--N 1.337 0.618 0 CA-C-O 122.952 1.306 . . . . 0.0 114.617 177.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 92.5 p -74.17 -16.66 60.98 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.974 -1.113 . . . . 0.0 111.448 -147.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -135.3 64.48 1.58 Allowed 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 125.612 2.625 . . . . 0.0 107.735 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 24.8 p -97.62 -169.4 1.83 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 127.106 2.163 . . . . 0.0 112.389 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.21 -21.39 56.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 119.25 -2.156 . . . . 0.0 111.479 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 19.6 tttt -84.96 0.07 52.55 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.953 2.901 . . . . 0.0 109.748 174.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.45 -34.43 6.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 120.28 -1.513 . . . . 0.0 110.854 175.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 53.1 76.52 0.52 Allowed Pre-proline 0 N--CA 1.449 -0.519 0 CA-C-N 122.794 2.543 . . . . 0.0 111.389 164.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.283 98.5 Cg_exo 17.2 40.53 0.0 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.002 0 N-CA-C 116.941 1.862 . . . . 0.0 116.941 53.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 72.8 t -43.61 -26.33 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 128.564 2.746 . . . . 0.0 115.897 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.49 -30.29 8.01 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.695 1.998 . . . . 0.0 110.337 -160.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 24.2 tp -57.5 -46.4 83.81 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.744 -2.472 . . . . 0.0 111.223 147.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -60.38 -43.82 96.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 115.742 1.756 . . . . 0.0 115.742 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -62.62 -36.58 83.22 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.116 2.167 . . . . 0.0 113.616 166.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 80.6 t90 -65.45 -44.42 87.34 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 118.351 -2.718 . . . . 0.0 110.137 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 47.2 mt -60.69 -36.3 78.45 Favored 'General case' 0 N--CA 1.446 -0.663 1 O-C-N 116.103 -4.123 . . . . 0.0 109.744 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -57.41 -29.26 63.97 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -101.74 -22.14 14.47 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 129.712 3.205 . . . . 0.0 110.79 -173.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 50.6 t -86.69 -38.53 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-O 123.78 1.752 . . . . 0.0 111.761 175.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . 0.294 15.3 mt -96.58 -28.73 14.23 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 114.002 -2.904 . . . . 0.0 116.062 -175.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 12.3 mt -102.05 34.71 2.6 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.754 1.615 . . . . 0.0 107.883 172.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . 0.313 17.6 pttp -62.15 165.69 5.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.828 178.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.37 -42.48 15.05 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.668 3.587 . . . . 0.0 113.232 -177.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.249 1.032 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 176.756 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 17.0 ttp . . . . . 0 N--CA 1.451 -0.417 0 CA-C-O 122.74 1.257 . . . . 0.0 111.805 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.44 -31.62 68.87 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 114.121 -2.847 . . . . 0.0 110.499 -173.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.271 26.6 tp10 -58.97 -43.63 91.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 125.85 1.969 . . . . 0.0 114.334 168.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -59.8 -50.7 72.77 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 125.783 2.706 . . . . 0.0 114.554 174.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -62.78 -24.74 67.88 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 117.253 -3.404 . . . . 0.0 114.396 170.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . 0.271 1.8 t60 -66.99 -43.17 83.66 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.433 1.493 . . . . 0.0 113.38 171.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -76.38 -30.71 57.64 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 125.955 2.034 . . . . 0.0 107.749 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -65.86 -41.59 91.48 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 122.053 2.206 . . . . 0.0 111.448 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 12.8 t-105 -70.0 -52.96 19.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 127.651 2.38 . . . . 0.0 108.063 176.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 mt -62.17 -21.45 65.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 114.264 -2.779 . . . . 0.0 115.378 177.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -53.28 -43.04 67.15 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 118.439 2.755 . . . . 0.0 118.439 161.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -62.38 -39.31 92.77 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 129.17 2.988 . . . . 0.0 107.429 172.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.4 t -79.68 -24.11 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 120.465 1.484 . . . . 0.0 109.997 -176.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . 0.26 6.1 m-20 -59.92 -61.25 2.75 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 116.716 -3.74 . . . . 0.0 115.937 160.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 47.9 tp -44.73 -53.22 7.56 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 131.533 3.933 . . . . 0.0 114.154 173.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.6 tp -67.24 -36.29 81.32 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -64.73 -38.37 90.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.349 176.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -75.06 -32.8 61.6 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 114.956 -2.45 . . . . 0.0 111.516 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.96 -25.14 52.46 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 120.763 1.62 . . . . 0.0 114.863 172.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.407 ' CE1' ' HB2' ' B' ' 27' ' ' LYS . 57.4 m-85 -59.8 -44.85 93.77 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 122.361 2.346 . . . . 0.0 112.042 162.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -78.31 16.68 0.74 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 113.978 -2.915 . . . . 0.0 113.348 176.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -131.76 7.39 4.42 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 121.461 1.937 . . . . 0.0 113.659 162.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.28 14.3 m-20 46.58 32.6 1.71 Allowed 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 128.138 2.575 . . . . 0.0 117.576 -165.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.1 mt -90.09 4.42 50.37 Favored 'General case' 0 N--CA 1.452 -0.368 1 O-C-N 115.877 -4.264 . . . . 0.0 113.235 166.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 p-80 -58.11 -43.73 87.31 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 116.968 -3.583 . . . . 0.0 115.164 -177.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.406 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 56.7 mt -64.06 -47.02 80.53 Favored Pre-proline 0 N--CA 1.452 -0.326 0 CA-C-O 117.087 -1.435 . . . . 0.0 111.676 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.406 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 15.0 Cg_exo -53.09 -40.2 77.54 Favored 'Trans proline' 0 N--CA 1.448 -1.187 1 C-N-CA 125.667 4.245 . . . . 0.0 114.471 174.512 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 24.7 tp -74.19 -39.4 63.19 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 117.196 -3.44 . . . . 0.0 110.277 -175.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.8 mt -83.44 3.06 33.63 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 126.334 2.271 . . . . 0.0 112.837 176.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -103.96 -9.04 19.17 Favored 'General case' 0 N--CA 1.446 -0.635 1 O-C-N 115.398 -4.564 . . . . 0.0 116.225 162.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 tt -97.0 -55.77 2.76 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.827 2.051 . . . . 0.0 108.385 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 57.8 mmm -72.69 -10.9 60.34 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 123.693 1.711 . . . . 0.0 115.41 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.5 mt -134.82 135.07 41.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 118.404 -2.685 . . . . 0.0 110.62 -176.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 74.2 p -87.27 162.18 43.9 Favored Pre-proline 0 N--CA 1.448 -0.536 0 O-C-N 116.744 -3.723 . . . . 0.0 111.64 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -56.7 -51.83 8.22 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 124.139 3.226 . . . . 0.0 112.593 -169.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -68.94 -16.76 63.83 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 127.454 2.302 . . . . 0.0 113.452 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -87.14 -39.41 15.56 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 118.237 -2.789 . . . . 0.0 112.344 170.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.266 78.5 mtm-85 -64.2 -40.5 96.2 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 117.386 -3.321 . . . . 0.0 114.205 167.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -61.4 -45.65 93.44 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 116.054 -1.927 . . . . 0.0 111.946 176.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.28 -37.78 78.03 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 128.778 3.799 . . . . 0.0 112.247 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 70.6 mt -69.34 -26.08 64.52 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 121.236 1.834 . . . . 0.0 114.401 172.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.84 -45.49 57.58 Favored Glycine 0 C--N 1.336 0.537 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 173.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.1 m -64.15 -30.26 71.34 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 115.795 -2.05 . . . . 0.0 113.18 171.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.476 HH12 ' CD ' ' B' ' 47' ' ' GLU . 32.0 ttm180 -56.8 -34.78 68.02 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 120.438 1.472 . . . . 0.0 113.099 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 65.5 t -59.03 -37.41 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 116.411 -1.757 . . . . 0.0 113.019 172.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -67.63 -31.84 72.14 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 122.749 2.522 . . . . 0.0 114.236 171.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.276 64.4 mt -63.57 -39.42 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 O-C-N 120.019 -1.676 . . . . 0.0 107.846 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.6 t -79.13 -37.19 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 127.648 2.379 . . . . 0.0 113.369 -177.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -47.16 -60.9 2.16 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 125.711 1.882 . . . . 0.0 110.87 158.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -70.6 -14.05 62.33 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 126.685 3.136 . . . . 0.0 116.204 -175.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.9 mt -82.45 -39.35 22.68 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 116.739 -3.726 . . . . 0.0 111.673 167.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 tp -68.96 -47.48 65.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.354 1.433 . . . . 0.0 111.439 172.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.1 ttm105 -57.21 -62.19 1.94 Allowed 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.521 -3.237 . . . . 0.0 108.39 173.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.06 7.53 64.05 Favored Glycine 0 CA--C 1.522 0.506 0 O-C-N 119.756 -1.84 . . . . 0.0 117.404 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -97.11 -12.7 22.82 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 -165.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 22.1 ttm -138.41 134.68 34.42 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 127.394 2.933 . . . . 0.0 114.285 -167.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -97.56 157.9 15.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.099 -2.251 . . . . 0.0 115.845 -152.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -48.67 -37.19 17.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -174.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.3 tpt85 -75.83 -13.78 60.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 118.18 -2.825 . . . . 0.0 113.509 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -102.0 -36.56 8.55 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 117.159 -3.463 . . . . 0.0 105.778 -173.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 29.0 mt -67.78 -22.11 65.21 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 117.87 -3.019 . . . . 0.0 116.32 170.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.0 tptt -50.44 -29.98 11.53 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 115.502 1.668 . . . . 0.0 115.502 159.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -103.94 -50.74 3.31 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 174.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -66.46 -16.0 63.78 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 116.89 2.181 . . . . 0.0 116.89 -175.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 95.7 mt -129.63 -5.54 4.67 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 115.313 -2.279 . . . . 0.0 112.299 170.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 73.79 6.48 72.52 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-N 119.989 1.268 . . . . 0.0 115.839 -172.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.15 157.09 22.91 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 124.321 2.01 . . . . 0.0 113.404 -160.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.71 130.12 9.61 Favored Glycine 0 N--CA 1.446 -0.689 0 O-C-N 120.436 -1.415 . . . . 0.0 115.971 172.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 16.4 mt -61.32 -38.32 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 128.346 2.658 . . . . 0.0 114.12 -168.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.12 -13.15 62.27 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 117.686 2.476 . . . . 0.0 117.686 171.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.0 p -82.67 -48.3 11.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 120.83 -1.169 . . . . 0.0 111.992 169.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.5 mm -49.13 -39.42 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 123.147 1.451 . . . . 0.0 114.013 164.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.0 m -68.55 -49.2 61.31 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 120.74 -1.225 . . . . 0.0 108.496 -174.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.9 ttt180 -64.2 -37.32 87.04 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 125.411 1.695 . . . . 0.0 113.816 174.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.38 -47.48 62.3 Favored Glycine 0 C--N 1.338 0.64 0 C-N-CA 127.18 2.324 . . . . 0.0 109.791 172.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.6 m -58.99 -54.19 49.92 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 118.966 2.95 . . . . 0.0 118.966 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -59.13 -27.53 65.7 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 126.126 1.77 . . . . 0.0 113.49 168.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 56.1 m -67.0 -43.88 81.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 120.931 1.696 . . . . 0.0 112.011 168.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.7 tp -62.33 -41.94 98.97 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.811 2.044 . . . . 0.0 109.2 176.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -60.37 -34.97 74.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 124.405 3.275 . . . . 0.0 110.29 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.33 -5.72 59.23 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.735 -1.853 . . . . 0.0 115.956 177.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.86 140.52 58.42 Favored Pre-proline 0 N--CA 1.449 -0.521 0 O-C-N 125.207 1.567 . . . . 0.0 110.605 -176.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -57.98 139.12 89.29 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 C-N-CA 125.218 3.946 . . . . 0.0 110.037 173.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.9 m -57.23 -29.52 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 119.705 -1.872 . . . . 0.0 111.738 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -70.16 -36.49 74.75 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 124.362 1.039 . . . . 0.0 113.145 -177.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 14.8 tp -60.18 -49.61 76.93 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 166.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -54.15 -42.52 69.66 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.61 1.564 . . . . 0.0 107.928 177.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -74.53 -31.1 62.03 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 123.571 1.653 . . . . 0.0 114.131 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . 0.296 65.4 t90 -70.73 -42.42 70.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 116.411 -3.93 . . . . 0.0 109.884 173.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.1 mt -60.83 -37.28 81.5 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 118.75 -2.469 . . . . 0.0 116.88 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . 0.274 44.2 mt-10 -60.65 -14.06 18.3 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 118.407 2.743 . . . . 0.0 118.407 -178.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -99.38 -12.81 19.94 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.433 2.293 . . . . 0.0 113.782 176.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.4 t -117.99 -31.98 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 O-C-N 118.106 -2.871 . . . . 0.0 116.807 -174.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.2 mt -84.08 -35.04 24.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 126.309 2.957 . . . . 0.0 118.808 174.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.283 21.3 mt -112.02 -18.83 12.53 Favored 'General case' 0 N--CA 1.448 -0.553 1 N-CA-C 122.516 4.265 . . . . 0.0 122.516 -160.289 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.6 tttt . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 117.843 2.535 . . . . 0.0 117.843 -176.943 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.275 . . . . . . . 0 N--CA 1.453 -0.308 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 90.4 mtp -74.67 -47.58 30.98 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 120.503 -1.373 . . . . 0.0 110.204 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.4 -37.73 70.53 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 170.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -73.88 -33.62 64.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.779 2.082 . . . . 0.0 116.133 172.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -55.58 -59.11 5.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 163.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -48.75 -33.19 9.82 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 120.462 3.504 . . . . 0.0 120.462 172.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -60.27 -40.27 89.78 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 121.269 1.85 . . . . 0.0 112.664 170.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -72.6 -38.61 67.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 118.06 2.615 . . . . 0.0 118.06 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -59.87 -23.49 63.47 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.263 -0.975 . . . . 0.0 113.532 169.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 6.4 t-105 -82.22 -46.74 13.33 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.72 2.408 . . . . 0.0 109.167 172.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 76.9 mt -57.82 -27.21 62.96 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 119.567 -1.958 . . . . 0.0 115.727 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -59.5 -45.32 92.04 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 119.154 -2.216 . . . . 0.0 111.963 174.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -59.31 -51.58 69.32 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 114.942 -2.456 . . . . 0.0 110.96 176.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 89.1 t -67.6 -27.54 38.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 O-C-N 127.957 3.286 . . . . 0.0 110.327 -173.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -77.21 -39.74 47.6 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 116.547 -3.846 . . . . 0.0 111.397 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 31.7 tp -70.07 -37.24 75.44 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 117.659 -3.151 . . . . 0.0 110.961 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.61 -47.57 85.05 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 118.793 2.886 . . . . 0.0 118.793 165.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . 0.407 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 71.2 tttt -61.02 -29.66 69.85 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 128.338 3.524 . . . . 0.0 111.698 173.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -91.57 -24.69 19.52 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 117.073 2.249 . . . . 0.0 117.073 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.41 -26.34 63.15 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.253 1.946 . . . . 0.0 116.253 164.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -61.56 -32.09 72.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 126.205 1.802 . . . . 0.0 115.547 169.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -81.64 -2.16 49.29 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 123.744 1.735 . . . . 0.0 111.52 -170.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -128.71 7.96 5.75 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 119.039 -2.288 . . . . 0.0 109.893 -173.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.392 14.5 m-20 58.36 21.58 8.49 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 119.732 -1.855 . . . . 0.0 115.144 -167.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 mt -102.26 20.02 17.61 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 120.582 3.549 . . . . 0.0 120.582 178.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -76.52 -46.46 26.46 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 118.692 -2.505 . . . . 0.0 112.779 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 25.7 mt -63.57 -41.66 67.66 Favored Pre-proline 0 N--CA 1.448 -0.569 0 CA-C-N 121.737 2.062 . . . . 0.0 113.18 174.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.287 40.1 Cg_exo -49.08 -47.97 19.93 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 124.941 3.76 . . . . 0.0 115.887 162.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -65.78 -35.01 79.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.267 -2.771 . . . . 0.0 108.688 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 57.2 mt -70.04 -40.75 74.95 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 118.087 2.625 . . . . 0.0 118.087 177.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -52.03 -25.54 8.77 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.4 1.88 . . . . 0.0 113.129 162.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 19.0 tp -91.96 -35.31 14.07 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.587 1.555 . . . . 0.0 112.853 178.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 21.8 mmt -94.46 -8.88 37.22 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 118.507 2.78 . . . . 0.0 118.507 -176.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 53.4 mt -141.94 126.85 18.24 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.786 1.634 . . . . 0.0 113.501 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 44.7 p -61.08 154.93 58.37 Favored Pre-proline 0 N--CA 1.449 -0.501 1 O-C-N 113.841 -5.537 . . . . 0.0 110.541 169.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -50.28 -22.8 8.96 Favored 'Trans proline' 0 N--CA 1.447 -1.213 0 N-CA-C 120.498 3.23 . . . . 0.0 120.498 174.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -81.68 -36.77 28.36 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 117.483 -3.261 . . . . 0.0 114.554 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.476 ' CD ' HH12 ' A' ' 54' ' ' ARG . 19.5 mt-10 -62.23 -43.63 98.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 114.469 -2.682 . . . . 0.0 111.366 162.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -65.81 -33.99 77.13 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 125.587 1.804 . . . . 0.0 112.045 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -60.48 -43.45 96.94 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.885 -1.052 . . . . 0.0 113.276 168.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . 0.347 . . -65.91 -56.56 11.15 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 115.72 -2.086 . . . . 0.0 109.677 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.302 10.6 mt -59.0 -30.95 68.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 121.196 1.816 . . . . 0.0 111.427 -178.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.03 -52.86 44.65 Favored Glycine 0 CA--C 1.523 0.582 0 CA-C-O 114.747 -3.252 . . . . 0.0 110.929 170.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 25.8 m -66.78 -28.63 68.54 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.189 2.195 . . . . 0.0 108.713 -174.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -63.08 -26.03 68.64 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.937 1.695 . . . . 0.0 111.809 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 79.6 t -64.89 -48.89 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 125.032 1.457 . . . . 0.0 111.225 169.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 24.7 mtp180 -66.33 -33.53 75.95 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 118.121 -2.862 . . . . 0.0 109.624 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 85.2 mt -64.07 -59.27 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 O-C-N 121.022 -1.049 . . . . 0.0 111.7 172.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 39.6 t -56.33 -40.01 63.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 O-C-N 121.399 -0.813 . . . . 0.0 111.449 178.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -67.01 -32.43 73.65 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.228 -0.92 . . . . 0.0 111.828 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -80.79 -18.78 46.45 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.828 1.299 . . . . 0.0 108.935 176.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . 0.334 76.1 mt -88.93 10.18 22.28 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 114.699 -2.572 . . . . 0.0 110.95 170.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 15.1 mt -112.8 -29.33 7.44 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 118.931 2.937 . . . . 0.0 118.931 150.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.37 21.5 ttm105 -58.83 -70.0 0.17 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 127.533 2.333 . . . . 0.0 111.639 176.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.67 27.89 9.35 Favored Glycine 0 C--N 1.336 0.538 1 CA-C-O 112.905 -4.275 . . . . 0.0 112.273 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -113.41 -22.19 10.5 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 119.496 3.147 . . . . 0.0 119.496 -176.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . 0.277 13.5 mtt -84.82 147.48 26.8 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 126.364 2.29 . . . . 0.0 111.313 -174.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 87.4 p -95.1 169.55 10.03 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 116.799 -1.961 . . . . 0.0 112.322 168.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -62.56 -31.85 72.73 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 116.883 -1.532 . . . . 0.0 112.51 -176.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 31.3 ttt180 -63.1 -50.88 68.77 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 126.345 2.278 . . . . 0.0 106.052 176.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -61.53 -44.39 97.14 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 127.672 2.389 . . . . 0.0 109.232 -174.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 31.1 mt -63.49 -46.42 86.2 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.82 -1.086 . . . . 0.0 113.48 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -63.93 -43.14 96.78 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.725 1.266 . . . . 0.0 110.954 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -68.58 -59.35 3.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.102 0.961 . . . . 0.0 110.421 -176.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -93.21 -61.11 1.64 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.42 -1.276 . . . . 0.0 111.444 -161.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 30.1 mt -74.23 -14.66 60.96 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 92.89 -1.29 70.76 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-O 124.188 1.993 . . . . 0.0 112.033 162.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.07 114.72 26.67 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -162.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.7 171.1 53.65 Favored Glycine 0 C--N 1.332 0.312 0 O-C-N 119.42 -2.05 . . . . 0.0 116.074 -176.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 11.4 mm -52.91 -43.62 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-O 115.319 -2.276 . . . . 0.0 111.368 -174.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.58 -27.52 62.24 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 123.366 2.803 . . . . 0.0 113.91 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 30.3 m -67.45 -49.62 62.88 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 121.252 1.842 . . . . 0.0 112.822 173.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 15.6 mm -64.5 -39.6 86.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 C-N-CA 125.827 1.651 . . . . 0.0 112.777 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 98.3 m -49.25 -52.63 25.98 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 162.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 42.5 ttt180 -63.22 -34.56 77.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 125.91 1.684 . . . . 0.0 114.498 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -60.49 -46.76 93.76 Favored Glycine 0 CA--C 1.521 0.438 0 O-C-N 126.125 2.141 . . . . 0.0 114.198 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 2.4 p -76.02 -27.36 57.32 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.614 1.166 . . . . 0.0 107.855 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -67.26 -43.09 82.74 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 119.71 1.141 . . . . 0.0 112.314 170.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . 0.26 51.5 m -79.66 -22.6 43.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.728 2.411 . . . . 0.0 109.886 -168.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 15.0 mt -78.13 -39.92 39.68 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 118.993 -2.317 . . . . 0.0 109.102 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 47.8 tttm -70.44 -24.32 62.88 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.873 1.269 . . . . 0.0 110.483 -172.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.9 -23.67 31.11 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 115.25 -2.309 . . . . 0.0 113.502 166.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.93 150.2 88.48 Favored Pre-proline 0 N--CA 1.45 -0.46 0 CA-C-N 121.391 1.905 . . . . 0.0 115.098 -164.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -46.52 132.56 16.17 Favored 'Trans proline' 0 N--CA 1.451 -1.024 0 O-C-N 122.944 0.971 . . . . 0.0 110.641 163.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 1.1 m -61.93 -26.38 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 O-C-N 119.583 -1.948 . . . . 0.0 113.322 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pm0 -67.84 -25.04 65.35 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 124.372 2.034 . . . . 0.0 114.829 176.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 21.3 tp -73.33 -46.94 46.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 117.046 -3.534 . . . . 0.0 109.478 167.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 48.8 mtp85 -60.75 -38.63 85.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 126.743 2.527 . . . . 0.0 115.386 -175.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -60.45 -45.14 94.78 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.967 2.107 . . . . 0.0 112.182 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -77.28 -46.19 23.88 Favored 'General case' 0 N--CA 1.449 -0.525 1 C-N-CA 131.731 4.013 . . . . 0.0 108.264 -170.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 38.3 mt -54.77 -49.23 71.39 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 174.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -49.24 -55.35 12.87 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 126.099 2.125 . . . . 0.0 109.614 172.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -72.59 -18.03 61.64 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 121.037 3.717 . . . . 0.0 121.037 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 56.3 t -87.8 -42.28 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 115.639 -2.124 . . . . 0.0 111.281 171.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 52.7 mt -88.19 -65.57 1.0 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 120.405 1.457 . . . . 0.0 112.752 -167.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 83.9 mt -57.0 -30.52 64.24 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 120.054 -1.654 . . . . 0.0 114.022 -167.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -66.38 -10.26 41.65 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 117.78 2.511 . . . . 0.0 117.78 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 45.8 m -104.81 7.07 34.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 124.38 2.038 . . . . 0.0 114.651 -177.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 . . . . . 0 C--O 1.25 1.119 1 O-C-N 115.555 -4.466 . . . . 0.0 113.697 163.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ttt . . . . . 0 N--CA 1.469 0.51 0 N-CA-C 104.306 -2.479 . . . . 0.0 104.306 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.24 155.68 20.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.502 1.921 . . . . 0.0 112.77 176.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -122.6 161.88 22.9 Favored 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 125.825 1.953 . . . . 0.0 110.219 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -123.59 164.64 18.62 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.737 1.215 . . . . 0.0 110.157 165.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -151.83 154.25 32.66 Favored Pre-proline 0 N--CA 1.447 -0.592 0 O-C-N 127.25 2.843 . . . . 0.0 115.479 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.92 -14.24 13.83 Favored 'Trans proline' 0 N--CA 1.446 -1.307 1 C-N-CA 125.591 4.194 . . . . 0.0 113.321 174.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -147.48 135.31 21.15 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.766 -2.459 . . . . 0.0 106.33 172.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 15.4 t -138.19 134.47 34.53 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 123.15 1.452 . . . . 0.0 109.819 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.38 -34.54 78.19 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 116.39 -3.944 . . . . 0.0 115.198 177.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.96 -35.38 72.14 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.622 1.569 . . . . 0.0 113.018 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 59.2 mtt -64.0 -40.71 96.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 122.264 1.03 . . . . 0.0 109.374 171.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.29 -20.46 61.5 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 176.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -66.14 -50.86 62.52 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 120.456 -1.403 . . . . 0.0 107.86 162.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -60.96 -40.42 93.3 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -170.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -44.57 83.08 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 128.737 2.815 . . . . 0.0 113.906 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -62.65 -28.83 70.19 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 170.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -68.68 -24.81 64.55 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 119.01 2.967 . . . . 0.0 119.01 169.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -80.92 -42.05 21.99 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 125.729 1.893 . . . . 0.0 110.544 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . 0.619 ' CZ2' ' HD2' ' D' ' 48' ' ' ARG . 28.9 t-105 -62.96 -46.7 86.47 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 125.674 1.59 . . . . 0.0 112.997 169.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 5.7 mp -60.89 -36.8 80.17 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 116.358 -1.782 . . . . 0.0 109.551 175.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -70.24 -31.59 69.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 118.852 2.908 . . . . 0.0 118.852 171.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -53.34 -42.93 67.25 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.564 1.945 . . . . 0.0 111.175 161.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.312 42.6 t -65.63 -50.23 72.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 124.89 1.369 . . . . 0.0 112.287 174.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -70.44 -29.54 66.14 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 117.569 2.433 . . . . 0.0 117.569 -175.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 24.0 tp -70.19 -61.2 1.87 Allowed 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 126.453 3.025 . . . . 0.0 104.501 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 36.0 tp -52.12 -30.35 25.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 118.155 -2.84 . . . . 0.0 113.695 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -62.52 -39.5 93.75 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.804 1.241 . . . . 0.0 113.631 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -81.71 -20.52 39.24 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 125.868 1.667 . . . . 0.0 111.265 178.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.14 71.26 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.377 1.071 . . . . 0.0 112.102 -176.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -61.03 -35.68 77.54 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 120.059 1.3 . . . . 0.0 112.406 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -59.42 -29.22 67.6 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 126.922 2.639 . . . . 0.0 110.552 -157.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 34.7 p-10 -128.68 35.36 4.37 Favored 'General case' 0 N--CA 1.447 -0.587 1 C-N-CA 132.886 4.474 . . . . 0.0 115.339 172.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.415 79.3 m-20 61.98 18.3 9.76 Favored 'General case' 0 N--CA 1.45 -0.472 1 N-CA-C 122.293 4.183 . . . . 0.0 122.293 175.543 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.309 45.6 mt -78.71 -4.31 48.51 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 118.072 -2.893 . . . . 0.0 116.343 174.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -71.39 -41.98 68.97 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 117.081 -1.438 . . . . 0.0 111.892 -170.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . 0.409 ' HB2' ' HD3' ' C' ' 37' ' ' PRO . 12.9 mt -64.2 -51.23 63.5 Favored Pre-proline 0 N--CA 1.446 -0.669 0 CA-C-O 116.017 -1.944 . . . . 0.0 110.923 174.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . 0.409 ' HD3' ' HB2' ' C' ' 36' ' ' LEU . 7.7 Cg_exo -45.22 -36.5 12.4 Favored 'Trans proline' 0 N--CA 1.452 -0.963 1 C-N-CA 130.296 7.331 . . . . 0.0 116.495 167.069 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.79 -44.84 22.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 116.552 -1.689 . . . . 0.0 110.019 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 36.2 mt -69.63 -28.88 66.29 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 126.21 2.194 . . . . 0.0 110.67 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -79.29 -14.8 58.78 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.918 2.487 . . . . 0.0 110.493 -177.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 58.4 tp -101.71 -42.74 6.08 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.034 3.334 . . . . 0.0 111.808 172.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 12.0 mmt -62.99 -22.65 66.99 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 175.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mp -125.3 155.51 40.09 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.936 2.094 . . . . 0.0 115.092 -175.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -90.54 167.4 16.61 Favored Pre-proline 0 N--CA 1.45 -0.45 0 C-N-CA 129.136 2.975 . . . . 0.0 115.555 163.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -56.65 -38.36 95.75 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 N-CA-C 115.689 1.38 . . . . 0.0 115.689 177.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -68.76 -37.11 79.12 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 128.553 2.741 . . . . 0.0 108.442 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -71.66 -26.11 62.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 116.193 -1.86 . . . . 0.0 112.104 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . 0.256 34.0 mtm-85 -64.99 -47.48 77.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.688 2.395 . . . . 0.0 115.96 168.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.27 -49.3 77.62 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.587 1.955 . . . . 0.0 108.406 176.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -45.94 -52.91 10.82 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 126.225 2.203 . . . . 0.0 112.491 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 92.0 mt -66.89 -45.58 77.6 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 126.346 1.858 . . . . 0.0 113.03 -177.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.17 -29.03 67.62 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 121.433 1.924 . . . . 0.0 109.269 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 94.0 m -82.47 -41.42 19.81 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 121.175 -1.191 . . . . 0.0 110.249 -174.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.35 55.2 mtt180 -44.95 -38.27 4.58 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 116.045 1.869 . . . . 0.0 116.045 165.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 54.7 t -67.72 -38.3 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-O 114.093 -2.86 . . . . 0.0 109.547 174.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -70.79 -36.22 72.92 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 124.658 3.39 . . . . 0.0 113.799 170.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 70.5 mt -69.48 -27.7 35.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 122.336 2.335 . . . . 0.0 113.476 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 79.6 t -71.79 -29.49 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 117.056 2.243 . . . . 0.0 117.056 167.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -70.75 -43.36 68.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.766 2.826 . . . . 0.0 113.023 171.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -71.65 -42.42 67.57 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 119.548 1.067 . . . . 0.0 112.127 -176.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.8 -33.29 73.61 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 117.351 -1.309 . . . . 0.0 113.507 174.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . 0.392 72.0 mt -56.59 -51.7 67.64 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 121.775 2.08 . . . . 0.0 110.115 164.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -59.13 -45.2 91.56 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.36 56.65 10.41 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 106.75 -2.54 . . . . 0.0 106.75 174.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -125.45 57.96 1.31 Allowed 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 129.631 3.172 . . . . 0.0 103.719 168.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 34.0 mtt -136.69 142.61 43.15 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 127.618 2.367 . . . . 0.0 110.983 176.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 94.5 p -77.2 159.71 29.48 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 128.749 2.82 . . . . 0.0 115.711 163.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -58.73 -24.13 61.04 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.136 3.375 . . . . 0.0 111.325 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 31.3 ttp-105 -77.07 -35.0 56.96 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 167.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -75.23 -36.83 61.3 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 121.673 -0.642 . . . . 0.0 111.036 174.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.54 -14.46 42.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.081 -2.262 . . . . 0.0 113.947 171.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.7 tttt -94.4 -44.42 7.92 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 118.036 -2.915 . . . . 0.0 114.817 165.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -97.44 -23.28 16.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 126.893 2.077 . . . . 0.0 115.54 -163.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -94.35 -36.43 11.94 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 119.346 -2.096 . . . . 0.0 114.224 170.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 9.4 mp -88.25 -29.61 20.3 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.228 -1.844 . . . . 0.0 108.579 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 75.87 -154.25 44.85 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 122.038 2.199 . . . . 0.0 110.968 -176.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.71 -15.96 60.22 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 126.564 3.078 . . . . 0.0 111.959 174.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.79 -12.39 82.95 Favored Glycine 0 N--CA 1.446 -0.68 0 O-C-N 117.121 -3.487 . . . . 0.0 113.742 -166.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 13.9 tt -54.95 -40.07 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-O 115.471 -2.204 . . . . 0.0 110.989 170.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.24 -42.72 63.84 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 123.601 2.909 . . . . 0.0 112.652 174.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 3.4 m -50.47 -33.71 22.21 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 127.329 2.251 . . . . 0.0 115.726 176.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 32.1 mm -105.17 -10.68 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 126.539 1.936 . . . . 0.0 112.154 -171.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . 0.367 20.8 p -125.4 -15.97 6.01 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 119.344 3.091 . . . . 0.0 119.344 -167.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 38.9 mtp85 -110.83 164.94 12.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 O-C-N 119.799 -1.813 . . . . 0.0 112.468 162.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.88 160.48 17.85 Favored Glycine 0 C--N 1.339 0.72 0 C-N-CA 129.792 3.568 . . . . 0.0 111.44 -171.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 2.1 m -65.73 -7.31 14.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 116.858 2.17 . . . . 0.0 116.858 -173.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -105.47 7.24 32.99 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 -179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 45.6 p -75.63 168.75 19.44 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 111.707 -3.996 . . . . 0.0 112.39 -170.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . 0.3 54.9 tp -65.93 -28.21 68.76 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 122.366 2.348 . . . . 0.0 113.454 -145.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 81.4 mttt -104.22 -14.54 15.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.998 1.272 . . . . 0.0 114.047 178.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.73 -38.12 88.29 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 117.21 -3.431 . . . . 0.0 115.066 155.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.33 153.46 0.95 Allowed Pre-proline 0 N--CA 1.449 -0.516 0 C-N-CA 128.868 2.867 . . . . 0.0 113.052 174.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -65.7 149.98 86.63 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-O 124.838 1.933 . . . . 0.0 114.521 -172.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 7.4 t -79.21 -24.07 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 114.559 -2.639 . . . . 0.0 106.913 -167.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 21.8 pm0 -75.24 -16.41 60.46 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 122.043 2.201 . . . . 0.0 113.488 171.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -86.41 -37.97 17.83 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 167.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -68.12 -31.28 70.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 120.443 -1.411 . . . . 0.0 112.896 -170.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -84.72 -50.59 7.49 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.181 2.192 . . . . 0.0 110.118 -178.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 49.5 t90 -53.97 -40.4 66.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 172.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.42 -40.18 93.48 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 118.764 -2.46 . . . . 0.0 112.701 178.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -70.73 -33.85 71.27 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 120.519 1.509 . . . . 0.0 111.79 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -61.71 -27.25 68.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 116.516 2.043 . . . . 0.0 116.516 168.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 60.3 t -91.77 -53.28 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.756 -178.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 52.0 mt -91.99 -39.57 11.59 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 117.976 -1.489 . . . . 0.0 113.057 -166.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 11.0 mt -108.45 50.26 0.78 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 -173.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 21.1 pttp . . . . . 0 N--CA 1.446 -0.661 0 O-C-N 119.333 -2.104 . . . . 0.0 113.808 -173.018 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 96.2 p . . . . . 0 N--CA 1.449 -0.498 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -67.98 -32.86 27.56 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 N-CA-C 121.102 3.462 . . . . 0.0 121.102 -173.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -160.74 132.69 5.92 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 109.383 -3.553 . . . . 0.0 103.923 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.5 t -54.17 132.6 43.48 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 118.269 -2.769 . . . . 0.0 115.812 178.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.09 -34.62 73.73 Favored 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 117.58 -3.2 . . . . 0.0 114.737 176.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.98 -23.57 55.31 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 124.044 1.878 . . . . 0.0 111.173 -177.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -77.92 -35.7 50.25 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 117.128 -3.482 . . . . 0.0 111.095 173.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -41.6 98.29 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 121.986 0.898 . . . . 0.0 112.52 169.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -60.91 -52.18 66.14 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 113.71 -1.586 . . . . 0.0 108.644 169.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -55.1 -35.78 64.98 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 176.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.56 0.3 34.46 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 117.391 2.367 . . . . 0.0 117.391 172.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -101.69 -19.35 15.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 116.879 -1.928 . . . . 0.0 110.513 158.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 78.7 mm-40 -82.18 -31.4 30.43 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -66.55 -27.11 67.48 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 119.168 -2.208 . . . . 0.0 112.273 165.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -73.8 -44.5 55.67 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.045 0.841 . . . . 0.0 112.406 173.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 73.3 mt -59.85 -16.75 31.27 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 118.342 2.719 . . . . 0.0 118.342 165.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -75.17 -40.91 59.1 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 125.404 2.526 . . . . 0.0 109.17 169.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -65.51 -47.0 77.48 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.014 -3.554 . . . . 0.0 110.907 171.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 58.6 t -55.52 -53.36 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-O 116.479 -1.724 . . . . 0.0 110.236 178.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -55.43 -36.58 66.66 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 118.597 2.814 . . . . 0.0 118.597 175.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 31.3 tp -76.72 -44.78 31.93 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 113.594 -1.639 . . . . 0.0 114.132 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.01 -41.04 99.47 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 113.369 -3.205 . . . . 0.0 111.103 170.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 ttpp -53.83 -57.22 11.69 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.319 2.327 . . . . 0.0 113.42 165.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -42.81 -48.88 5.78 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 116.468 -1.729 . . . . 0.0 113.186 164.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.359 . . -58.26 -38.37 76.8 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 120.454 1.479 . . . . 0.0 114.74 175.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -59.54 -31.4 69.37 Favored 'General case' 0 N--CA 1.454 -0.268 1 O-C-N 115.045 -4.784 . . . . 0.0 111.439 174.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -86.53 -23.35 25.9 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.919 2.088 . . . . 0.0 111.672 -167.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 50.4 p30 -122.95 5.08 9.35 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.985 1.314 . . . . 0.0 108.991 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.385 11.9 m-20 74.88 25.74 1.4 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 114.529 -2.653 . . . . 0.0 117.593 176.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . 0.269 66.0 mt -96.78 5.74 50.03 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 126.456 2.348 . . . . 0.0 112.432 -172.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -80.49 -48.84 12.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.852 3.261 . . . . 0.0 111.72 -155.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 1.2 mt -50.77 -46.88 86.69 Favored Pre-proline 0 N--CA 1.451 -0.418 0 O-C-N 119.707 -1.87 . . . . 0.0 112.894 174.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.256 17.1 Cg_exo -70.23 -18.19 34.94 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 N-CA-C 117.731 2.166 . . . . 0.0 117.731 176.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 32.0 tp -77.32 -37.09 53.28 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.313 3.045 . . . . 0.0 108.886 167.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.13 -38.88 60.88 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 115.372 -2.252 . . . . 0.0 108.789 -179.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -75.43 -22.2 57.54 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 128.523 3.64 . . . . 0.0 112.312 174.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 18.6 tp -70.72 -42.98 69.87 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 115.898 -2.001 . . . . 0.0 111.338 171.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 19.8 mmt -84.74 -36.34 21.85 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 129.148 2.979 . . . . 0.0 114.846 -171.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mt -122.35 126.98 49.19 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 125.049 2.357 . . . . 0.0 109.208 -171.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 68.2 p -78.32 166.62 41.76 Favored Pre-proline 0 N--CA 1.448 -0.534 0 CA-C-N 111.2 -2.727 . . . . 0.0 113.352 -176.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_exo -59.07 -43.84 39.32 Favored 'Trans proline' 0 N--CA 1.447 -1.21 0 CA-C-N 121.575 1.598 . . . . 0.0 114.912 -162.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.274 48.7 m-20 -75.37 -17.28 60.26 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 117.558 -3.214 . . . . 0.0 109.238 -177.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -74.25 -37.52 63.74 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 124.912 2.292 . . . . 0.0 108.602 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . 0.619 ' HD2' ' CZ2' ' C' ' 19' ' ' TRP . 17.1 mtm180 -76.72 -31.07 56.91 Favored 'General case' 0 N--CA 1.45 -0.459 1 C-N-CA 132.386 4.275 . . . . 0.0 108.599 174.155 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -66.85 -38.34 86.18 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 122.566 2.439 . . . . 0.0 109.549 168.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.277 . . -79.71 -36.89 36.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 114.718 -2.563 . . . . 0.0 116.635 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 18.2 mt -61.16 -49.07 78.72 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 125.182 1.551 . . . . 0.0 114.418 164.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.37 -44.43 58.43 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 82.7 m -73.76 -23.33 59.72 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 127.212 2.205 . . . . 0.0 113.118 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -62.26 -20.69 64.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 117.428 -3.295 . . . . 0.0 115.288 166.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 43.7 t -66.59 -57.51 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 119.946 1.248 . . . . 0.0 108.216 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -69.31 -17.39 63.72 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.247 1.819 . . . . 0.0 112.837 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 31.8 mt -74.4 -44.2 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 O-C-N 118.055 -2.903 . . . . 0.0 110.803 173.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.45 -39.39 80.66 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 C-N-CA 128.274 2.63 . . . . 0.0 111.718 174.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -58.13 -49.44 76.97 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 117.931 -2.981 . . . . 0.0 109.731 176.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -70.42 -22.27 62.74 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 116.223 1.935 . . . . 0.0 116.223 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 46.1 mt -72.82 -28.51 62.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 121.44 1.927 . . . . 0.0 112.691 164.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 78.9 mt -76.53 -36.89 57.43 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 120.835 1.652 . . . . 0.0 110.239 169.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -76.94 -33.88 57.67 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.437 0.695 . . . . 0.0 111.498 -173.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 45.31 52.46 8.58 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 121.909 3.523 . . . . 0.0 121.909 176.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -127.48 -12.69 5.55 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 119.232 -2.334 . . . . 0.0 109.701 173.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 16.4 mmt -87.85 59.36 5.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.093 1.357 . . . . 0.0 109.977 164.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 1.5 p -66.23 144.72 56.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 119.94 3.311 . . . . 0.0 119.94 -171.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 49.03 -101.41 0.08 Allowed 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 128.768 2.827 . . . . 0.0 109.355 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -58.42 -37.38 75.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 115.038 -2.411 . . . . 0.0 114.785 -174.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -70.79 -38.73 73.38 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.279 1.99 . . . . 0.0 111.708 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.75 -35.6 81.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 117.992 -2.943 . . . . 0.0 112.13 169.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -76.68 -25.13 53.34 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 121.119 1.781 . . . . 0.0 115.691 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -119.85 -30.78 4.66 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 113.103 -3.332 . . . . 0.0 111.95 -171.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . 0.258 17.5 tp10 -94.99 -45.54 7.21 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 123.453 2.842 . . . . 0.0 110.899 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.87 -50.51 19.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 102.676 -3.083 . . . . 0.0 102.676 170.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 94.33 -141.28 15.47 Favored Glycine 0 N--CA 1.448 -0.506 1 CA-C-O 129.212 4.784 . . . . 0.0 118.298 153.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.61 -33.38 73.81 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.694 -2.651 . . . . 0.0 113.616 -167.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.18 -25.56 25.77 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 126.175 1.845 . . . . 0.0 116.166 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 5.2 tt -65.39 -15.29 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 119.732 1.766 . . . . 0.0 115.597 -173.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.23 -44.16 65.91 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.902 -1.047 . . . . 0.0 113.571 173.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 26.4 m -61.64 -39.63 91.99 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 170.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 45.6 mm -77.2 -34.98 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 O-C-N 120.864 -1.148 . . . . 0.0 111.131 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 70.0 p -104.01 -9.8 18.56 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 113.308 -3.234 . . . . 0.0 112.761 -174.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -96.16 -175.7 3.45 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 104.354 -2.461 . . . . 0.0 104.354 173.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 66.37 161.62 1.08 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 126.518 2.008 . . . . 0.0 112.445 -173.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 57.1 p -77.49 -22.5 51.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 116.142 1.905 . . . . 0.0 116.142 -148.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 72.0 m-80 -121.67 62.71 0.92 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 131.335 3.854 . . . . 0.0 111.093 175.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 84.0 p -85.41 175.92 8.58 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 125.821 2.724 . . . . 0.0 115.324 171.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.39 -11.56 60.28 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 118.933 -2.354 . . . . 0.0 110.977 161.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -71.22 -18.18 62.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 162.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -118.21 -23.38 7.34 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 116.947 2.202 . . . . 0.0 116.947 -165.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 42.62 85.85 0.15 Allowed Pre-proline 0 N--CA 1.449 -0.488 0 CA-C-O 124.298 1.999 . . . . 0.0 111.707 169.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' D' ' 95' ' ' GLU . 41.2 Cg_exo 20.11 45.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.123 0 O-C-N 116.84 -2.242 . . . . 0.0 114.45 51.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -58.95 -23.79 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 C-N-CA 127.363 2.265 . . . . 0.0 106.747 -175.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . 0.483 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -105.53 -27.76 11.2 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 117.31 -1.329 . . . . 0.0 109.207 -160.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 34.5 tp -60.92 -54.24 47.51 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 128.486 2.715 . . . . 0.0 107.003 152.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 43.7 ttp180 -55.34 -52.81 62.29 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 124.739 3.427 . . . . 0.0 112.857 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -56.39 -24.78 46.84 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 124.2 3.182 . . . . 0.0 115.868 172.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -85.11 -40.93 16.2 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 123.238 1.494 . . . . 0.0 112.475 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.06 -35.25 79.61 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 118.331 -2.73 . . . . 0.0 108.967 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -68.08 -4.84 14.85 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 112.635 -2.075 . . . . 0.0 114.051 176.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -119.21 -33.63 4.08 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 119.331 -0.948 . . . . 0.0 108.599 177.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 25.4 t -77.34 -36.21 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 116.169 1.915 . . . . 0.0 116.169 171.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 24.6 mt -80.24 -39.38 29.13 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 127.923 2.489 . . . . 0.0 112.659 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 15.1 mt -110.84 37.41 2.8 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 126.62 3.105 . . . . 0.0 111.622 -174.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -58.08 165.71 1.81 Allowed 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.526 -2.609 . . . . 0.0 112.113 176.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 59.6 m -44.79 -36.48 3.25 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 129.258 3.023 . . . . 0.0 114.692 173.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 . . . . . 0 C--O 1.253 1.242 0 C-N-CA 129.175 2.99 . . . . 0.0 115.48 -178.612 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.39 -41.72 88.92 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 125.735 2.683 . . . . 0.0 114.014 171.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -71.5 -32.62 68.43 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 127.22 2.208 . . . . 0.0 112.105 171.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -60.33 -46.89 88.29 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.498 -2.001 . . . . 0.0 113.145 165.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.7 mmt-85 -70.32 -31.6 68.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 115.762 -2.066 . . . . 0.0 112.581 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.8 t60 -58.06 -50.88 71.91 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.038 -1.934 . . . . 0.0 111.796 165.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -53.53 -41.08 66.01 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.164 1.785 . . . . 0.0 113.421 174.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.254 34.7 tt0 -60.19 -49.86 75.95 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.187 1.795 . . . . 0.0 110.013 170.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -57.77 -61.07 2.78 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.394 -2.691 . . . . 0.0 117.014 172.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.8 mt -55.88 -29.17 59.56 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -175.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -47.89 -43.48 28.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 128.547 2.739 . . . . 0.0 111.023 168.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -67.15 -43.23 82.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 119.72 -1.862 . . . . 0.0 110.198 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.7 t -66.23 -36.81 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-O 113.722 -3.037 . . . . 0.0 111.171 175.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -61.99 -58.33 8.29 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.168 1.804 . . . . 0.0 109.67 168.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 36.8 tp -47.12 -54.62 10.08 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.171 -1.581 . . . . 0.0 113.17 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 36.3 tp -62.35 -39.95 94.8 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 124.137 3.153 . . . . 0.0 113.271 176.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -54.87 -35.77 64.4 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 127.003 3.287 . . . . 0.0 111.406 170.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -90.48 -6.28 55.01 Favored 'General case' 0 N--CA 1.452 -0.341 1 O-C-N 116.208 -4.057 . . . . 0.0 112.244 -177.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.0 -31.67 17.99 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 119.376 0.989 . . . . 0.0 111.961 163.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -50.95 -37.1 42.34 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.238 -2.163 . . . . 0.0 111.63 165.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -81.64 -10.46 59.41 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 121.91 2.141 . . . . 0.0 116.309 -174.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -109.76 -1.44 17.95 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.678 1.191 . . . . 0.0 113.771 172.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.442 12.4 m-20 63.94 34.52 11.51 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.822 2.049 . . . . 0.0 114.574 -175.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.6 mt -107.14 13.72 27.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.748 2.819 . . . . 0.0 113.978 174.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.3 p-80 -63.24 -60.04 3.93 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 116.091 1.886 . . . . 0.0 116.091 172.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.27 14.3 mt -59.92 -43.18 94.01 Favored Pre-proline 0 N--CA 1.449 -0.494 0 O-C-N 125.056 1.472 . . . . 0.0 112.734 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -45.46 -57.63 2.04 Favored 'Trans proline' 0 N--CA 1.448 -1.164 0 C-N-CA 123.216 2.611 . . . . 0.0 117.48 160.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.52 -40.38 92.9 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 117.605 -3.184 . . . . 0.0 117.375 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.3 mt -53.79 -35.18 61.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 115.793 -2.051 . . . . 0.0 110.434 169.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 -81.2 -10.45 59.62 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 120.789 1.631 . . . . 0.0 112.475 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.5 tt -92.68 -32.75 14.62 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 116.976 -3.578 . . . . 0.0 114.839 169.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 94.8 mmm -92.01 -17.59 24.86 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 120.065 3.358 . . . . 0.0 120.065 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.5 mt -120.6 129.83 53.92 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 169.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.9 p -70.34 154.11 94.71 Favored Pre-proline 0 N--CA 1.449 -0.481 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -49.01 -51.37 10.69 Favored 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 124.739 3.626 . . . . 0.0 119.089 -172.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.42 -9.59 58.74 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 116.863 -3.648 . . . . 0.0 115.269 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -81.92 -43.03 18.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 117.616 -3.177 . . . . 0.0 110.889 168.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 78.6 mtm-85 -54.28 -41.83 69.33 Favored 'General case' 0 N--CA 1.445 -0.693 1 O-C-N 114.666 -5.021 . . . . 0.0 112.226 171.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -65.83 -50.02 66.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 110.672 -2.967 . . . . 0.0 110.829 174.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.95 -33.6 62.49 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.953 2.101 . . . . 0.0 113.187 174.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.5 mt -88.75 -21.74 23.67 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 114.674 -2.584 . . . . 0.0 108.785 -175.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.93 -46.85 92.72 Favored Glycine 0 C--N 1.337 0.626 0 CA-C-N 121.391 1.905 . . . . 0.0 111.098 162.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.6 m -61.76 -28.67 69.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.132 -2.393 . . . . 0.0 110.462 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -60.68 -33.4 72.78 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 115.551 -2.166 . . . . 0.0 113.485 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.2 t -65.63 -40.33 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 121.592 1.996 . . . . 0.0 112.809 169.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -66.2 -23.17 66.39 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 122.641 2.473 . . . . 0.0 116.961 170.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.279 72.7 mt -64.67 -52.84 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 125.188 2.423 . . . . 0.0 109.101 168.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.4 t -68.55 -29.33 43.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-N 113.208 -1.815 . . . . 0.0 111.879 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -63.59 -44.98 92.45 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 118.604 -2.56 . . . . 0.0 112.816 174.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -83.9 -10.97 57.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -178.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 21.5 mt -78.74 -41.23 31.3 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 120.542 -1.349 . . . . 0.0 109.878 166.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.2 -43.44 17.66 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 115.475 -2.203 . . . . 0.0 107.476 -166.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -62.59 -36.97 84.41 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.317 2.261 . . . . 0.0 112.258 166.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.84 14.29 81.67 Favored Glycine 0 C--N 1.336 0.568 0 CA-C-N 122.392 2.36 . . . . 0.0 116.082 162.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -81.58 -28.58 33.75 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 129.255 3.022 . . . . 0.0 112.955 173.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.8 mtt -100.69 141.39 33.64 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 123.9 1.809 . . . . 0.0 108.399 -174.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 93.2 p -93.95 165.17 12.79 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.778 165.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -56.35 -35.48 67.71 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 125.72 2.676 . . . . 0.0 116.094 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.1 tpt85 -73.59 -21.23 60.39 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.808 -2.433 . . . . 0.0 110.532 -177.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -79.22 -42.53 25.79 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 113.911 -2.947 . . . . 0.0 110.55 166.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 57.4 mt -70.77 -18.36 62.76 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 115.612 -2.435 . . . . 0.0 114.752 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -57.25 -34.75 68.93 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.736 2.014 . . . . 0.0 111.804 169.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -90.83 -59.57 2.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.186 1.794 . . . . 0.0 107.914 167.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -62.32 -26.71 68.57 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 128.552 2.741 . . . . 0.0 117.829 -166.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.5 mt -122.82 11.35 9.68 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.393 1.877 . . . . 0.0 114.383 165.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 57.52 20.53 38.46 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 120.309 1.413 . . . . 0.0 114.26 -171.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -79.99 139.03 37.17 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.128 1.771 . . . . 0.0 114.051 -161.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.42 103.57 1.53 Allowed Glycine 0 CA--C 1.523 0.56 0 C-N-CA 127.908 2.671 . . . . 0.0 109.571 172.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 67.6 mt -37.61 -48.83 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 128.877 2.871 . . . . 0.0 112.347 -179.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.32 -34.45 74.66 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 129.731 3.212 . . . . 0.0 110.972 -172.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.3 p -65.31 -45.81 82.85 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 119.24 -2.162 . . . . 0.0 111.788 167.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.0 mm -63.64 -32.06 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 O-C-N 117.604 -3.185 . . . . 0.0 110.952 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -49.97 -52.52 33.03 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 118.645 -2.534 . . . . 0.0 115.137 165.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -59.55 -42.29 92.05 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 125.32 1.638 . . . . 0.0 110.729 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.86 -40.67 99.15 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 113.06 -1.882 . . . . 0.0 113.65 -177.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.9 m -61.74 -34.9 76.65 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 113.529 -3.129 . . . . 0.0 110.877 171.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -75.8 -30.17 58.97 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 120.771 1.623 . . . . 0.0 114.561 177.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 17.8 m -68.39 -34.97 76.99 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 115.902 -1.999 . . . . 0.0 109.967 171.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.9 tp -77.58 -45.61 24.72 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 117.255 -1.355 . . . . 0.0 111.41 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -53.76 -45.64 70.69 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 130.264 3.425 . . . . 0.0 108.262 169.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.25 -34.94 75.97 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.073 1.749 . . . . 0.0 115.302 176.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.05 171.87 4.19 Favored Pre-proline 0 N--CA 1.447 -0.614 0 O-C-N 119.496 -2.003 . . . . 0.0 113.321 -168.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . 0.317 28.5 Cg_exo -67.79 131.74 24.95 Favored 'Trans proline' 0 N--CA 1.447 -1.258 1 C-N-CA 126.847 5.032 . . . . 0.0 116.615 178.514 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 m -45.08 -39.93 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 N-CA-C 117.838 2.533 . . . . 0.0 117.838 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.1 pm0 -75.93 -31.84 59.31 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 118.26 -2.775 . . . . 0.0 110.796 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 15.7 tp -64.87 -41.95 95.24 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 112.696 -3.526 . . . . 0.0 111.394 164.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 89.1 mtm-85 -64.53 -43.47 93.91 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 126.167 2.167 . . . . 0.0 111.572 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -56.32 -20.86 20.87 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.376 2.27 . . . . 0.0 113.752 170.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -94.78 -46.26 6.98 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 127.562 3.553 . . . . 0.0 110.378 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 29.2 mt -56.32 -26.69 53.2 Favored 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 115.373 -4.579 . . . . 0.0 111.263 171.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -70.65 -24.85 62.78 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 118.11 -2.869 . . . . 0.0 117.433 170.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -101.41 -4.17 27.4 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.29 1.836 . . . . 0.0 111.968 176.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . 0.301 59.6 t -122.67 -36.66 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -170.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.2 mt -82.36 -54.83 4.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 117.866 -3.021 . . . . 0.0 115.135 165.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.7 mt -70.08 -3.89 18.63 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.747 2.019 . . . . 0.0 112.832 -167.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.264 28.9 tttt . . . . . 0 N--CA 1.448 -0.568 0 C-N-CA 129.597 3.159 . . . . 0.0 113.694 -166.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.496 0 CA-C-O 122.387 1.089 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 36.9 mtt -69.73 -34.77 74.31 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 114.152 -2.832 . . . . 0.0 110.402 176.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.68 -40.68 93.05 Favored 'General case' 0 N--CA 1.449 -0.509 1 O-C-N 130.196 4.685 . . . . 0.0 111.766 177.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 32.1 tp10 -65.46 -29.56 70.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 126.474 3.035 . . . . 0.0 116.86 171.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -68.36 -37.99 81.0 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 125.326 2.489 . . . . 0.0 116.761 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 51.9 mmt-85 -81.34 -20.0 41.61 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 115.036 -2.411 . . . . 0.0 111.078 176.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -61.53 -57.24 12.91 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 122.502 2.41 . . . . 0.0 108.064 162.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.35 -31.68 72.98 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 123.107 2.685 . . . . 0.0 116.767 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.69 -39.25 83.93 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 117.648 2.462 . . . . 0.0 117.648 165.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 11.8 t-105 -74.69 -46.91 34.64 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.708 2.003 . . . . 0.0 107.385 175.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 83.7 mt -58.93 -17.94 29.04 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 118.105 -2.872 . . . . 0.0 114.996 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . 0.381 49.4 ttt180 -67.55 -45.04 76.79 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.172 1.789 . . . . 0.0 113.527 168.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -60.03 -39.66 86.67 Favored 'General case' 0 N--CA 1.451 -0.4 1 O-C-N 115.997 -4.189 . . . . 0.0 119.492 165.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.01 -34.14 67.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-O 122.656 1.217 . . . . 0.0 110.738 176.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -61.88 -47.91 82.86 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 116.719 -3.738 . . . . 0.0 110.771 173.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 51.6 tp -62.79 -41.58 99.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.974 1.845 . . . . 0.0 109.061 -173.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.327 14.1 tp -76.46 -28.49 56.54 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 124.003 1.859 . . . . 0.0 115.917 -178.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -62.98 -37.52 87.46 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 119.04 -2.287 . . . . 0.0 111.987 164.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -79.41 -23.29 43.33 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 119.622 -1.924 . . . . 0.0 110.727 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.49 -32.34 32.5 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -69.61 -35.79 75.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 124.107 3.14 . . . . 0.0 113.921 167.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.33 -8.97 4.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 120.469 3.507 . . . . 0.0 120.469 159.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . 0.266 65.2 m-80 -128.74 9.79 5.95 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 116.389 -3.945 . . . . 0.0 110.002 -175.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.489 5.2 m-20 55.65 9.7 0.44 Allowed 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 121.137 3.754 . . . . 0.0 121.137 -168.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.3 mt -82.04 10.0 7.41 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 113.654 -1.612 . . . . 0.0 115.078 176.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . 0.266 18.5 p-80 -61.3 -49.92 75.07 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 119.801 -1.812 . . . . 0.0 112.783 -170.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.337 54.8 mt -63.07 -55.29 38.57 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-O 115.724 -2.084 . . . . 0.0 113.679 176.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -42.23 -36.24 4.01 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 N-CA-C 118.918 2.622 . . . . 0.0 118.918 168.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 58.6 tp -87.23 -28.35 22.42 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.141 0.428 . . . . 0.0 111.291 -176.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 19.8 mt -79.9 -34.07 39.37 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 120.833 -1.167 . . . . 0.0 113.362 172.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -60.8 -42.97 98.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 113.309 -3.234 . . . . 0.0 108.032 167.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -61.89 -55.59 28.07 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 126.245 2.216 . . . . 0.0 112.14 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.0 mmt -82.85 -31.5 27.98 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 126.398 2.311 . . . . 0.0 114.759 -165.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 33.4 mt -108.3 127.13 53.59 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 104.715 -2.328 . . . . 0.0 104.715 -179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 24.3 p -69.59 157.4 89.64 Favored Pre-proline 0 N--CA 1.448 -0.538 0 C-N-CA 125.393 1.477 . . . . 0.0 113.741 172.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.67 -29.79 63.08 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 123.68 2.92 . . . . 0.0 115.721 -176.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.05 -21.04 43.91 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 125.244 1.59 . . . . 0.0 114.429 178.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -84.15 -28.11 27.65 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 169.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -70.86 -46.77 62.09 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 117.703 -3.123 . . . . 0.0 107.076 171.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -58.72 -37.61 76.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.102 1.501 . . . . 0.0 114.007 170.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.88 -45.32 95.03 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 119.666 -1.896 . . . . 0.0 114.31 169.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 12.0 mt -68.51 -43.42 76.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 117.33 -1.748 . . . . 0.0 112.426 -174.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.11 -30.27 60.54 Favored Glycine 0 CA--C 1.525 0.715 0 O-C-N 125.427 1.704 . . . . 0.0 115.485 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.6 m -73.85 -44.41 55.66 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 174.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 38.2 mtt180 -60.56 -27.9 68.04 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.064 -3.523 . . . . 0.0 110.74 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 90.9 t -41.76 -62.75 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 123.245 2.748 . . . . 0.0 114.5 162.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 -71.13 -29.09 64.81 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -166.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 19.1 mt -71.45 -44.51 71.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 C-N-CA 126.795 2.038 . . . . 0.0 112.572 177.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 93.7 t -66.76 -41.8 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 124.332 2.015 . . . . 0.0 111.232 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -52.67 -49.19 65.75 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 115.343 1.608 . . . . 0.0 115.343 168.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . 0.254 22.8 tp10 -68.35 -30.45 69.42 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 113.169 -3.3 . . . . 0.0 109.798 174.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 8.5 mt -66.58 -25.11 66.47 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 123.353 2.797 . . . . 0.0 111.568 172.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 48.4 mt -86.61 -28.68 23.11 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 124.52 1.138 . . . . 0.0 109.614 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 28.5 ttm105 -83.02 -44.86 14.74 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 118.855 2.909 . . . . 0.0 118.855 -171.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.79 64.19 3.72 Favored Glycine 0 CA--C 1.522 0.47 0 O-C-N 119.256 -2.152 . . . . 0.0 114.638 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -128.39 -36.13 1.92 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 127.298 2.239 . . . . 0.0 109.077 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 60.0 mtp -81.16 134.31 35.61 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 118.526 -2.609 . . . . 0.0 116.117 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 88.5 p -84.29 174.41 10.17 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 125.322 1.639 . . . . 0.0 113.255 168.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -64.47 -36.47 84.3 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.293 -2.129 . . . . 0.0 113.657 -169.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -72.25 -35.88 68.91 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 120.029 -1.669 . . . . 0.0 112.923 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.72 -40.75 79.79 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 113.457 -1.701 . . . . 0.0 109.051 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 87.5 mt -58.93 -61.45 2.63 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.181 2.192 . . . . 0.0 112.21 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -53.58 -50.55 65.35 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 128.342 2.657 . . . . 0.0 112.974 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -104.14 -7.44 20.18 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 128.129 3.393 . . . . 0.0 109.764 -165.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -118.47 -7.04 10.7 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 125.201 3.637 . . . . 0.0 111.466 173.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 36.4 mt -122.09 -17.24 7.28 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 113.985 -2.912 . . . . 0.0 115.316 168.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.56 16.85 78.68 Favored Glycine 0 C--N 1.336 0.533 0 CA-C-N 125.08 3.582 . . . . 0.0 119.376 -168.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -105.23 71.03 0.92 Allowed 'General case' 0 N--CA 1.447 -0.58 1 C-N-CA 132.278 4.231 . . . . 0.0 106.571 -160.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.92 179.58 44.54 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 119.805 -1.188 . . . . 0.0 115.749 172.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 51.2 mm -44.85 -51.27 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-O 115.788 -2.054 . . . . 0.0 114.089 -171.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.8 -32.02 73.39 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.272 2.323 . . . . 0.0 117.272 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 2.9 m -66.59 -43.07 85.88 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 31.4 mm -70.08 -42.25 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 130.228 3.411 . . . . 0.0 113.432 168.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 26.3 m -59.17 -51.04 71.71 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 118.284 -2.76 . . . . 0.0 109.52 172.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -63.11 -42.58 99.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 114.916 -2.469 . . . . 0.0 113.077 175.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.84 -45.16 90.05 Favored Glycine 0 CA--C 1.522 0.499 0 O-C-N 125.703 1.877 . . . . 0.0 115.779 -176.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 88.2 p -62.88 -39.85 95.72 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 164.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -68.07 -37.46 81.28 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 117.074 -3.516 . . . . 0.0 112.469 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 48.1 m -74.41 -0.75 18.34 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 171.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mt -95.77 -43.52 7.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 128.271 2.628 . . . . 0.0 116.548 167.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 54.8 tttm -68.84 -31.76 70.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 123.003 0.521 . . . . 0.0 110.698 169.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.74 -14.72 60.33 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 129.554 3.141 . . . . 0.0 117.227 166.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.38 148.36 98.71 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-N 121.599 2.0 . . . . 0.0 108.9 165.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -72.71 151.53 52.04 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 122.598 2.198 . . . . 0.0 115.308 169.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.323 31.4 m -62.71 -34.84 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 O-C-N 118.892 -2.38 . . . . 0.0 117.362 -166.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -50.62 -34.51 26.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 128.204 2.602 . . . . 0.0 111.63 172.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 7.0 tp -97.23 -38.61 9.62 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 115.952 -1.975 . . . . 0.0 108.333 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 26.0 mtp85 -47.87 -51.91 21.25 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 121.748 2.067 . . . . 0.0 111.552 171.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -62.86 -28.64 70.17 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 117.365 2.357 . . . . 0.0 117.365 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -71.26 -60.4 2.25 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.35 1.86 . . . . 0.0 110.702 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 96.4 mt -54.49 -43.79 72.09 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -66.48 -13.94 61.55 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -104.19 -8.51 19.34 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 126.478 1.911 . . . . 0.0 114.134 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 39.4 t -111.55 -43.55 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 123.38 1.562 . . . . 0.0 107.875 -177.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.96 -47.17 39.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 116.948 -3.595 . . . . 0.0 109.567 -178.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 84.0 mt -72.25 -24.25 61.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 117.75 -1.58 . . . . 0.0 112.701 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -90.25 -8.97 49.66 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 119.373 -2.08 . . . . 0.0 111.329 -178.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.3 m -71.89 -22.77 61.46 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 165.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.394 61.9 m-20 . . . . . 0 C--O 1.249 1.036 0 N-CA-C 117.117 2.266 . . . . 0.0 117.117 161.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ttt . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.61 170.36 15.93 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.454 -1.299 . . . . 0.0 113.832 172.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -130.81 149.72 52.32 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 113.485 -1.689 . . . . 0.0 108.542 177.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -121.48 153.49 37.86 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 124.155 3.161 . . . . 0.0 109.492 177.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 94.9 p -143.85 169.7 9.84 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 172.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -89.8 -27.24 0.34 Allowed 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 116.873 -1.618 . . . . 0.0 114.333 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -140.88 144.29 35.17 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 117.167 -1.397 . . . . 0.0 114.16 176.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.7 t -148.06 118.53 7.42 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 125.335 1.647 . . . . 0.0 113.243 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.71 -12.31 2.85 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 157.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.87 -40.76 95.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 123.485 2.857 . . . . 0.0 115.399 163.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 39.2 mtt -79.38 -36.98 38.4 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 124.067 1.889 . . . . 0.0 110.513 -172.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.06 -36.04 60.18 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 128.549 2.74 . . . . 0.0 112.158 175.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -79.58 -37.69 35.74 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 119.4 -2.063 . . . . 0.0 109.724 175.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -70.56 -43.79 68.77 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 120.36 1.437 . . . . 0.0 112.334 -178.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -30.69 71.59 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 119.269 -2.144 . . . . 0.0 114.09 174.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -72.78 -48.38 38.73 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 126.6 2.437 . . . . 0.0 110.964 171.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -61.47 -24.01 66.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 112.748 -3.501 . . . . 0.0 113.871 171.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -59.65 -39.01 82.98 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 123.794 2.997 . . . . 0.0 115.999 164.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -78.22 -41.3 34.8 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.067 -1.424 . . . . 0.0 110.58 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 4.8 mp -67.12 -17.69 64.98 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 119.927 -1.733 . . . . 0.0 110.715 174.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -82.98 -38.56 22.52 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 118.159 -2.838 . . . . 0.0 116.668 175.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -55.46 -38.79 69.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 113.383 -1.735 . . . . 0.0 110.405 165.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 5.6 t -70.6 -41.94 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 O-C-N 118.91 -2.369 . . . . 0.0 108.466 -177.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -72.71 -25.62 61.3 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 119.077 2.991 . . . . 0.0 119.077 176.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 49.1 tp -71.63 -40.49 69.71 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 52.7 tp -69.35 -40.28 77.61 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -44.0 -51.5 7.71 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 123.342 1.544 . . . . 0.0 114.187 178.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -79.67 -13.4 59.51 Favored 'General case' 0 N--CA 1.45 -0.425 0 O-C-N 119.311 -2.118 . . . . 0.0 113.269 -175.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.31 -28.49 61.19 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 120.977 1.717 . . . . 0.0 114.968 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -65.19 -22.97 66.97 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 117.867 -3.021 . . . . 0.0 109.598 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.79 -20.74 61.1 Favored 'General case' 0 N--CA 1.448 -0.564 1 O-C-N 113.869 -5.519 . . . . 0.0 110.947 -166.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -126.66 30.4 5.53 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 118.545 -2.597 . . . . 0.0 113.677 168.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 42.16 44.84 3.33 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 129.151 2.98 . . . . 0.0 115.262 -173.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.264 95.9 mt -93.55 -10.0 36.3 Favored 'General case' 0 N--CA 1.448 -0.549 1 C-N-CA 132.125 4.17 . . . . 0.0 109.71 172.801 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 29.4 p-80 -47.9 -41.81 25.39 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 130.947 3.699 . . . . 0.0 109.653 168.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mt -76.34 -52.35 2.37 Favored Pre-proline 0 N--CA 1.45 -0.452 1 O-C-N 115.612 -4.43 . . . . 0.0 117.074 174.181 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -49.43 -33.58 30.2 Favored 'Trans proline' 0 N--CA 1.448 -1.174 0 C-N-CA 123.751 2.967 . . . . 0.0 118.54 164.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 18.8 tp -65.74 -39.18 90.85 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.005 -2.309 . . . . 0.0 115.337 168.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 66.9 mt -84.8 -16.22 42.2 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.986 2.175 . . . . 0.0 115.422 172.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -85.38 -5.12 59.33 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 129.336 3.054 . . . . 0.0 113.816 163.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 54.7 tp -91.77 -64.59 1.1 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 116.025 -1.941 . . . . 0.0 110.971 156.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -83.46 -5.83 59.28 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 119.642 3.201 . . . . 0.0 119.642 -162.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mp -114.85 155.06 27.49 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 112.731 -2.032 . . . . 0.0 111.915 162.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 44' ' ' THR . . . . . 0.406 ' HB ' ' CD ' ' C' ' 45' ' ' PRO . 58.6 p -94.23 173.56 4.51 Favored Pre-proline 0 N--CA 1.449 -0.495 0 C-N-CA 129.965 3.306 . . . . 0.0 110.624 166.055 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . 0.406 ' CD ' ' HB ' ' C' ' 44' ' ' THR . 16.8 Cg_exo -70.91 -30.91 16.23 Favored 'Trans proline' 0 N--CA 1.451 -0.989 1 C-N-CA 125.815 4.344 . . . . 0.0 111.385 -168.109 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -43.59 97.01 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.073 2.149 . . . . 0.0 108.44 178.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -71.53 -24.12 61.89 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.132 1.373 . . . . 0.0 114.465 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 82.8 mtm-85 -80.28 -33.02 38.04 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 117.156 -3.465 . . . . 0.0 108.968 170.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -64.76 -42.77 94.89 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 123.226 1.488 . . . . 0.0 113.827 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.79 -56.58 18.79 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 128.705 2.802 . . . . 0.0 109.671 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 79.9 mt -56.6 -39.81 74.23 Favored 'General case' 0 N--CA 1.446 -0.641 1 O-C-N 116.146 -4.096 . . . . 0.0 116.823 170.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.63 -18.89 46.74 Favored Glycine 0 N--CA 1.448 -0.506 0 O-C-N 119.643 -1.91 . . . . 0.0 114.598 170.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 19.7 m -92.5 -43.54 9.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 112.945 -1.628 . . . . 0.0 110.714 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -63.68 -37.65 88.15 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.61 -2.138 . . . . 0.0 107.747 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 6.8 t -52.9 -47.49 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-N 124.332 3.242 . . . . 0.0 114.346 170.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -65.36 -38.39 89.92 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 115.68 -2.105 . . . . 0.0 114.254 173.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 20.8 mt -65.14 -45.43 94.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 123.294 2.77 . . . . 0.0 107.316 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 24.3 t -57.95 -37.87 63.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 115.503 -2.189 . . . . 0.0 112.171 167.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -70.92 -41.27 71.43 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 124.159 3.163 . . . . 0.0 113.324 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -66.48 -36.33 82.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 114.402 -2.713 . . . . 0.0 111.427 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 63.7 mt -70.94 -37.62 72.85 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 122.688 2.495 . . . . 0.0 114.276 172.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 35.8 mt -77.53 -22.23 51.44 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 114.645 -2.822 . . . . 0.0 109.9 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -67.34 -51.64 49.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.069 -2.269 . . . . 0.0 112.502 165.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.27 21.02 74.19 Favored Glycine 0 CA--C 1.521 0.429 0 O-C-N 117.824 -3.048 . . . . 0.0 118.483 177.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . 0.501 30.6 tt0 -83.48 40.35 0.72 Allowed 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 128.425 2.69 . . . . 0.0 113.995 171.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 23.2 mmt -110.42 119.19 38.39 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -173.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 85.1 p -80.75 160.06 25.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.291 -3.381 . . . . 0.0 113.46 161.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.98 -30.2 61.41 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 119.275 -2.141 . . . . 0.0 112.718 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . 0.253 35.9 ttp-105 -58.7 -45.21 90.03 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 119.966 3.321 . . . . 0.0 119.966 161.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -76.16 -29.58 57.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 126.569 2.418 . . . . 0.0 112.03 -177.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.92 -16.66 52.6 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 117.326 -3.359 . . . . 0.0 115.799 171.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -98.74 -69.58 0.76 Allowed 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 172.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -74.87 -10.92 59.96 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.618 -3.176 . . . . 0.0 113.679 -164.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -106.32 -35.57 7.11 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 120.301 1.41 . . . . 0.0 110.896 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.5 mp -88.81 -28.23 20.57 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 116.776 -1.583 . . . . 0.0 113.165 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 54.66 -122.85 26.56 Favored Glycine 0 C--N 1.336 0.577 1 C-N-CA 130.95 4.119 . . . . 0.0 114.79 -173.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.2 -23.99 37.76 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 126.121 1.768 . . . . 0.0 113.301 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.68 -14.7 77.86 Favored Glycine 0 CA--C 1.526 0.74 0 O-C-N 128.617 3.698 . . . . 0.0 117.198 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 17.4 tt -51.4 -55.94 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 155.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.31 -25.85 64.43 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 119.327 -2.108 . . . . 0.0 111.724 -177.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 1.4 m -68.92 -27.91 66.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.916 1.686 . . . . 0.0 113.171 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 19.5 mm -98.33 -36.55 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 O-C-N 125.538 1.774 . . . . 0.0 114.075 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 78.1 p -91.95 -24.33 19.3 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -170.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 71.9 mtp85 -93.6 161.09 14.49 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 130.654 3.582 . . . . 0.0 112.053 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.06 169.28 41.38 Favored Glycine 0 CA--C 1.524 0.642 0 O-C-N 118.706 -2.496 . . . . 0.0 116.879 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 25.5 m -64.26 -33.93 76.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 119.048 2.981 . . . . 0.0 119.048 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -93.78 28.66 2.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 126.649 2.468 . . . . 0.0 113.749 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 8.0 p -75.15 159.17 31.95 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.766 -2.459 . . . . 0.0 108.27 -172.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 30.3 tp -44.13 -54.7 5.35 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.833 2.453 . . . . 0.0 113.1 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -82.73 2.45 33.72 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 120.893 1.679 . . . . 0.0 112.663 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -124.03 -16.4 6.55 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.376 1.87 . . . . 0.0 113.054 -172.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.53 152.9 88.36 Favored Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 130.536 3.534 . . . . 0.0 114.822 163.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -66.01 158.98 51.44 Favored 'Trans proline' 0 N--CA 1.446 -1.295 0 O-C-N 115.515 -2.939 . . . . 0.0 117.926 -167.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 89.3 t -65.9 -43.63 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 117.948 -1.025 . . . . 0.0 108.648 -170.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.3 pm0 -60.88 -23.05 64.89 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 116.194 -1.86 . . . . 0.0 112.229 -178.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 18.3 tp -76.86 -49.71 15.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.254 1.822 . . . . 0.0 108.745 169.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 67.6 mtp180 -71.84 -42.44 66.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 118.695 -2.503 . . . . 0.0 111.208 -167.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -50.05 -50.0 49.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 128.794 2.838 . . . . 0.0 108.783 167.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 90.6 t90 -63.31 -41.25 98.91 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 127.998 3.311 . . . . 0.0 117.467 -178.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 81.3 mt -51.79 -36.67 48.54 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 117.077 -1.44 . . . . 0.0 114.349 168.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -80.94 -24.57 38.03 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.774 1.296 . . . . 0.0 113.708 172.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -71.12 -14.23 62.22 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 119.944 1.247 . . . . 0.0 111.162 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 72.9 t -112.03 -61.3 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-O 115.221 -2.324 . . . . 0.0 112.454 176.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 31.6 mt -66.05 -32.43 73.9 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 121.58 1.991 . . . . 0.0 115.398 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 84.9 mt -136.83 62.82 1.59 Allowed 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.662 1.585 . . . . 0.0 111.185 -168.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.281 15.2 pttp . . . . . 0 N--CA 1.452 -0.329 0 CA-C-N 112.262 -2.244 . . . . 0.0 112.595 -174.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 78.2 p . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -50.18 -38.71 51.47 Favored 'Trans proline' 0 N--CA 1.446 -1.322 1 C-N-CA 125.585 4.19 . . . . 0.0 109.728 170.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -153.24 147.22 25.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 128.325 2.65 . . . . 0.0 108.889 178.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 12.7 t -92.66 140.37 29.6 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 120.382 1.446 . . . . 0.0 113.935 -175.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.6 -17.47 64.13 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 120.558 -1.339 . . . . 0.0 112.939 173.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.28 -35.74 66.21 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 120.653 -1.28 . . . . 0.0 111.194 167.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 14.8 mmm -72.01 -47.86 48.85 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 127.311 2.244 . . . . 0.0 114.193 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.97 -59.97 2.05 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.279 2.632 . . . . 0.0 112.263 169.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -67.43 -37.56 83.19 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 116.648 -1.644 . . . . 0.0 113.909 173.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -57.69 -22.54 46.68 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 121.705 2.048 . . . . 0.0 114.286 164.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER -93.88 -4.67 49.56 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 125.13 3.605 . . . . 0.0 106.74 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -90.19 -21.13 22.33 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 122.683 2.492 . . . . 0.0 114.81 153.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . 0.305 75.3 mm-40 -92.41 -36.14 13.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 123.876 1.798 . . . . 0.0 110.13 -166.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -46.6 -36.27 6.75 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 127.201 2.201 . . . . 0.0 111.807 161.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . 0.456 ' CZ3' ' CD1' ' D' ' 22' ' ' PHE 0.254 4.7 t-105 -85.14 -36.32 21.16 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 118.778 -2.451 . . . . 0.0 114.658 -177.564 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 50.7 mt -70.95 -22.75 62.17 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 120.037 -1.664 . . . . 0.0 113.05 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -66.51 -32.19 73.38 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 164.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . 0.456 ' CD1' ' CZ3' ' D' ' 19' ' ' TRP 0.297 13.8 t80 -66.76 -55.26 15.79 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 121.049 1.75 . . . . 0.0 107.728 173.86 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 61.1 t -57.83 -36.33 55.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 117.057 -1.449 . . . . 0.0 110.123 -172.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . 0.281 22.1 t70 -84.92 -28.38 25.96 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 125.745 1.618 . . . . 0.0 112.637 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 23.8 tp -66.27 -53.59 35.0 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 170.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 57.7 tp -55.33 -38.55 68.87 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 114.386 -2.721 . . . . 0.0 112.123 -178.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp -66.96 -37.35 84.12 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 127.124 2.765 . . . . 0.0 112.895 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -72.17 -29.98 64.54 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 113.535 -1.666 . . . . 0.0 113.143 171.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.3 -35.91 76.66 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 126.217 1.807 . . . . 0.0 115.591 164.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -73.39 -11.03 60.34 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 123.553 1.645 . . . . 0.0 113.734 172.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -102.36 -2.47 28.85 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 112.308 -3.71 . . . . 0.0 116.266 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 52.1 p30 -137.4 10.63 2.97 Favored 'General case' 0 N--CA 1.448 -0.55 1 O-C-N 129.228 4.08 . . . . 0.0 117.857 169.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 66.28 33.93 6.84 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 117.627 2.455 . . . . 0.0 117.627 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 20.2 mt -103.24 7.69 38.45 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.553 1.541 . . . . 0.0 111.485 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.42 -49.18 77.07 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 130.762 3.625 . . . . 0.0 112.541 174.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 18.0 mt -71.37 -45.68 13.59 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-N 122.729 2.513 . . . . 0.0 110.486 -178.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.259 82.4 Cg_exo -61.26 -32.47 90.3 Favored 'Trans proline' 0 N--CA 1.45 -1.085 1 C-N-CA 125.465 4.11 . . . . 0.0 115.982 173.745 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 34.6 tp -72.46 -45.59 58.84 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 118.836 -2.415 . . . . 0.0 110.726 174.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 11.3 mt -70.02 -27.85 65.01 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 117.575 -3.203 . . . . 0.0 112.53 176.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -76.85 -30.39 56.29 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 118.046 -2.909 . . . . 0.0 115.195 172.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 56.9 tp -57.97 -46.43 85.15 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 157.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.0 mmt -82.59 -37.7 24.68 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.064 -1.023 . . . . 0.0 112.695 -165.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 64.0 mt -114.63 137.42 51.91 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 114.691 -2.576 . . . . 0.0 111.957 -165.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 42.7 p -78.27 168.16 29.72 Favored Pre-proline 0 N--CA 1.449 -0.493 0 O-C-N 125.421 1.701 . . . . 0.0 112.342 -176.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -52.34 -32.9 53.57 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-N 123.164 2.166 . . . . 0.0 117.631 -174.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -91.49 -32.12 15.7 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 127.028 2.131 . . . . 0.0 112.805 -172.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -58.36 -39.75 80.38 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.05 1.34 . . . . 0.0 113.318 168.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 31.2 mtm-85 -64.26 -52.6 57.89 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.589 2.356 . . . . 0.0 108.491 169.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -54.28 -35.99 63.18 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 127.535 3.022 . . . . 0.0 114.082 174.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.22 -36.91 66.55 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 119.615 -1.928 . . . . 0.0 114.374 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 43.5 mt -72.15 -45.73 59.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 119.211 -2.181 . . . . 0.0 113.412 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.3 -42.41 99.77 Favored Glycine 0 C--N 1.338 0.676 0 C-N-CA 125.16 1.362 . . . . 0.0 110.572 166.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 36.2 m -60.67 -33.86 73.47 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 124.175 3.988 . . . . 0.0 114.504 169.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.4 61.2 mtt180 -52.99 -27.12 17.67 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 118.038 -2.914 . . . . 0.0 116.993 166.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 76.4 t -69.2 -50.5 52.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-O 114.75 -2.548 . . . . 0.0 107.377 175.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -68.02 -35.9 79.05 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 125.601 3.819 . . . . 0.0 110.67 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 59.4 mt -52.48 -53.8 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 120.56 1.527 . . . . 0.0 109.877 173.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 69.6 t -67.66 -44.96 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 O-C-N 117.136 -3.478 . . . . 0.0 106.234 -175.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -49.67 -41.72 43.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.043 -2.286 . . . . 0.0 116.427 168.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . 0.254 45.1 mm-40 -76.28 -24.3 54.44 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 125.802 1.939 . . . . 0.0 110.73 178.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 48.0 mt -76.74 -44.78 31.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 119.29 -2.131 . . . . 0.0 110.447 176.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . 0.261 30.6 mt -62.11 -25.79 67.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.957 1.703 . . . . 0.0 114.213 168.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 37.4 ttm180 -84.99 -41.41 15.86 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 119.924 -1.735 . . . . 0.0 111.547 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 41.03 64.71 1.21 Allowed Glycine 0 CA--C 1.522 0.478 0 C-N-CA 126.524 2.011 . . . . 0.0 116.797 -174.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -130.95 -36.81 1.33 Allowed 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 131.121 3.768 . . . . 0.0 112.457 177.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 13.4 mmt -85.37 49.08 1.68 Allowed 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 130.04 3.336 . . . . 0.0 108.322 166.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 53.3 p -69.64 165.3 21.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 124.549 2.119 . . . . 0.0 115.583 -168.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 56.62 -103.42 0.18 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 117.594 2.442 . . . . 0.0 117.594 158.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -53.44 -45.06 69.33 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 114.306 -2.759 . . . . 0.0 114.48 168.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -82.03 -40.1 22.55 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 123.682 2.946 . . . . 0.0 110.314 -166.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.63 -30.74 14.16 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 118.146 2.647 . . . . 0.0 118.146 165.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -86.2 -46.85 9.99 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 116.792 2.145 . . . . 0.0 116.792 169.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -74.74 -45.81 41.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 115.278 -2.296 . . . . 0.0 110.9 -175.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -119.0 -32.55 4.43 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 120.085 1.311 . . . . 0.0 112.788 -160.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.258 1.3 mm? -72.73 -28.85 62.89 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 116.131 -1.89 . . . . 0.0 109.24 157.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 105.68 -174.35 20.88 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-O 125.63 2.795 . . . . 0.0 106.959 151.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.254 . . -58.72 -9.2 1.61 Allowed 'General case' 0 N--CA 1.45 -0.47 1 C-N-CA 133.719 4.808 . . . . 0.0 119.596 171.2 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.87 -21.79 65.81 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 115.243 0.857 . . . . 0.0 115.243 164.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 3.7 tt -38.06 -31.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 127.031 2.132 . . . . 0.0 115.672 172.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.54 -7.25 13.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 118.283 -2.761 . . . . 0.0 114.924 -171.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 47.3 m -66.89 -44.02 81.94 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.536 150.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 15.7 mm -68.09 -35.85 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 129.164 2.986 . . . . 0.0 114.328 168.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 68.4 p -119.75 8.1 11.12 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 123.868 3.031 . . . . 0.0 116.692 -175.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.2 mtp85 -115.76 170.54 8.38 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 121.744 2.066 . . . . 0.0 113.848 149.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.11 156.12 32.38 Favored Glycine 0 C--N 1.334 0.464 0 CA-C-O 123.794 1.775 . . . . 0.0 111.659 -166.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 53.1 p -78.16 -5.91 53.17 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 -156.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -138.89 41.24 2.14 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 128.839 2.856 . . . . 0.0 109.944 169.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 12.7 p -56.67 174.51 0.15 Allowed 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 129.271 3.028 . . . . 0.0 107.586 164.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp -66.38 -24.76 66.54 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 118.021 -2.925 . . . . 0.0 111.145 174.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 36.8 tttt -76.65 0.75 19.13 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 167.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -130.86 5.32 4.58 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 115.069 -2.396 . . . . 0.0 115.09 -176.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . 0.506 ' HA ' ' C ' ' D' ' 93' ' ' PRO 0.376 . . 48.33 76.5 0.54 Allowed Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 119.252 3.056 . . . . 0.0 119.252 140.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . 0.527 ' C ' ' H ' ' D' ' 95' ' ' GLU . 76.8 Cg_exo 33.01 28.4 0.0 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.985 0 CA-C-N 123.543 2.301 . . . . 0.0 113.665 36.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 t -50.76 -21.93 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 C-N-CA 125.784 1.634 . . . . 0.0 108.781 166.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . 0.527 ' H ' ' C ' ' D' ' 93' ' ' PRO 0.333 0.0 OUTLIER -103.47 -35.92 8.17 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.948 1.699 . . . . 0.0 111.919 -169.082 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 27.4 tp -50.86 -54.24 25.6 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 117.445 -1.702 . . . . 0.0 110.031 151.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 -60.48 -46.02 91.62 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 128.582 2.753 . . . . 0.0 113.816 -169.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -75.1 -12.99 60.43 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 116.957 -3.589 . . . . 0.0 116.927 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 64.5 t90 -77.47 -48.41 17.19 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 117.144 -1.408 . . . . 0.0 110.81 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 38.9 mt -58.24 -34.68 70.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 126.742 2.526 . . . . 0.0 108.33 169.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -60.97 -31.74 71.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.298 2.239 . . . . 0.0 114.018 175.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -97.97 -23.12 15.94 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 119.681 -1.887 . . . . 0.0 112.884 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.254 49.0 t -78.19 -23.57 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 CA-C-N 121.702 2.047 . . . . 0.0 111.488 167.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 78.7 mt -120.75 -20.1 7.13 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 -163.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 67.7 mt -115.44 29.72 7.82 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.252 2.221 . . . . 0.0 107.188 166.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -52.6 167.32 0.15 Allowed 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.713 2.805 . . . . 0.0 115.704 173.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 53.8 m -40.35 -50.26 2.81 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 119.524 3.157 . . . . 0.0 119.524 -175.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 . . . . . 0 C--O 1.245 0.832 0 C-N-CA 126.055 1.742 . . . . 0.0 113.944 177.54 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.2 ttt . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 121.038 0.447 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -37.62 74.78 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.215 -0.902 . . . . 0.0 112.915 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -64.97 -37.19 86.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 120.027 -1.671 . . . . 0.0 110.915 166.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -55.33 -49.34 72.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 117.231 -3.418 . . . . 0.0 111.141 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -74.53 -17.84 60.69 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.769 -177.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -65.84 -49.74 67.1 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 118.914 -1.115 . . . . 0.0 110.85 168.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -70.12 -24.78 63.24 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.332 2.345 . . . . 0.0 117.332 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -67.31 -41.93 84.54 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.756 2.423 . . . . 0.0 109.808 170.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.457 ' CZ2' HG23 ' A' ' 23' ' ' VAL 0.261 3.0 t-105 -74.51 -44.1 52.86 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.977 -2.327 . . . . 0.0 113.456 174.373 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 15.4 mt -67.07 -29.27 68.99 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 117.527 -1.669 . . . . 0.0 112.061 -176.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 25.8 ttt180 -30.14 -63.05 0.14 Allowed 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 116.437 2.014 . . . . 0.0 116.437 153.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -53.95 -37.07 63.51 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 116.326 1.972 . . . . 0.0 116.326 173.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.457 HG23 ' CZ2' ' A' ' 19' ' ' TRP 0.279 2.7 t -69.51 -40.62 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 125.406 1.482 . . . . 0.0 112.282 -176.056 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -68.54 -50.68 50.13 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 116.203 -1.856 . . . . 0.0 109.329 167.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.0 tp -53.26 -40.15 64.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 123.536 2.88 . . . . 0.0 111.506 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.3 tp -76.74 -30.16 56.47 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 120.103 1.319 . . . . 0.0 111.526 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -62.74 -47.67 82.56 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 166.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -53.97 -38.81 65.39 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.38 -2.724 . . . . 0.0 111.028 165.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.406 ' HB1' HD22 ' A' ' 38' ' ' LEU . . . -75.94 -38.81 57.21 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 122.834 2.561 . . . . 0.0 110.964 -177.255 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.434 ' CD1' ' CG ' ' A' ' 35' ' ' HIS . 28.2 m-85 -67.49 -35.42 79.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 118.732 -2.48 . . . . 0.0 109.02 176.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -66.59 -10.78 49.03 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 173.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -115.8 7.22 14.52 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.384 1.073 . . . . 0.0 112.242 177.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.28 24.7 m-20 60.88 14.91 5.56 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 121.474 3.879 . . . . 0.0 121.474 -171.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.1 mt -101.03 13.49 35.03 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 119.624 -1.922 . . . . 0.0 113.648 -175.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.434 ' CG ' ' CD1' ' A' ' 30' ' ' TYR . 19.8 p-80 -55.2 -53.38 56.8 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.822 -2.423 . . . . 0.0 113.381 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.9 mt -70.09 -47.33 21.74 Favored Pre-proline 0 N--CA 1.445 -0.716 0 CA-C-N 123.547 2.885 . . . . 0.0 111.039 -178.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -41.87 -47.81 6.28 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.299 2.666 . . . . 0.0 114.524 168.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.406 HD22 ' HB1' ' A' ' 29' ' ' ALA . 27.4 tp -66.56 -55.47 15.28 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 112.887 -1.96 . . . . 0.0 113.419 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 29.0 mt -61.71 -21.92 64.9 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 119.702 1.137 . . . . 0.0 112.37 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -73.63 -31.95 63.79 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.084 1.754 . . . . 0.0 109.549 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.87 -39.48 43.19 Favored 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 133.915 4.886 . . . . 0.0 115.993 169.229 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.3 mmm -73.58 -32.13 63.97 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 129.066 2.946 . . . . 0.0 113.241 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.4 mt -127.59 120.6 28.54 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.132 1.373 . . . . 0.0 108.724 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.4 p -53.79 163.01 1.19 Allowed Pre-proline 0 N--CA 1.45 -0.465 0 CA-C-N 114.836 -1.074 . . . . 0.0 113.418 172.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -64.86 -28.11 58.92 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 CA-C-N 121.965 1.737 . . . . 0.0 115.93 -172.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -77.23 -27.2 53.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.73 2.122 . . . . 0.0 116.73 177.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -72.17 -39.56 68.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.625 1.97 . . . . 0.0 114.07 172.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.6 mtm-85 -55.96 -46.58 78.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 168.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -49.26 -54.05 18.72 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 119.568 -1.958 . . . . 0.0 113.173 169.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.31 -50.08 55.98 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 114.934 -2.46 . . . . 0.0 107.464 -172.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.9 mt -54.4 -33.42 59.28 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 124.443 3.292 . . . . 0.0 115.707 171.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.24 -47.06 92.35 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 127.928 2.68 . . . . 0.0 114.566 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.0 m -60.11 -27.3 66.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 114.857 -2.497 . . . . 0.0 112.331 163.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -81.61 -23.49 37.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 125.429 1.706 . . . . 0.0 110.795 -173.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 51.6 t -57.36 -45.22 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-O 115.795 -2.05 . . . . 0.0 107.992 167.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.29 11.6 ttt180 -63.26 -37.75 88.45 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 126.779 2.032 . . . . 0.0 110.707 173.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 28.6 mt -57.79 -42.82 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 O-C-N 117.422 -3.299 . . . . 0.0 112.358 174.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.5 t -65.19 -48.25 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 O-C-N 119.178 -2.201 . . . . 0.0 112.458 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -57.27 -47.99 80.03 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.904 1.282 . . . . 0.0 110.526 178.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -69.0 -44.15 73.37 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 115.202 -2.333 . . . . 0.0 114.623 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.1 mt -67.63 -27.13 66.63 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 120.61 1.55 . . . . 0.0 113.997 177.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 tp -77.59 -47.66 18.84 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.359 1.464 . . . . 0.0 108.915 177.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.3 ttm105 -53.96 -35.42 61.75 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 169.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.33 -9.24 14.42 Favored Glycine 0 C--N 1.334 0.45 0 C-N-CA 129.25 3.309 . . . . 0.0 117.259 169.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -60.25 -22.51 63.15 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 127.458 2.303 . . . . 0.0 116.084 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 41.4 mtt -95.4 140.83 29.72 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 126.176 1.79 . . . . 0.0 114.915 175.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.8 p -93.44 176.87 6.22 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 127.628 2.371 . . . . 0.0 109.906 174.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -69.16 -31.88 70.83 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 119.368 -2.082 . . . . 0.0 111.482 169.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.5 tpt85 -62.27 -27.52 69.07 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 167.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -90.67 -40.04 12.11 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 117.265 -1.35 . . . . 0.0 111.763 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.4 mt -63.56 -30.21 71.36 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 120.153 1.342 . . . . 0.0 109.997 176.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -56.86 -25.48 56.63 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -95.79 -54.32 3.38 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 126.2 1.8 . . . . 0.0 111.861 172.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -65.73 -47.81 74.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 118.219 -2.801 . . . . 0.0 114.439 -170.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.3 mt -108.73 -0.34 20.07 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.535 -171.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.86 21.36 73.2 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 119.841 1.2 . . . . 0.0 114.106 -171.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.08 133.1 33.64 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 116.434 2.013 . . . . 0.0 116.434 -165.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.57 129.46 9.13 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-O 114.562 -3.354 . . . . 0.0 111.601 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 83.8 mt -61.48 -17.77 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 1 O-C-N 131.356 4.798 . . . . 0.0 111.477 -164.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -77.19 -28.38 53.93 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.852 2.569 . . . . 0.0 113.361 169.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 26.4 p -84.69 -25.38 28.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 118.067 -1.453 . . . . 0.0 109.855 -173.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 51.1 mm -69.92 -43.29 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-O 113.886 -2.959 . . . . 0.0 109.619 166.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.6 m -49.75 -52.05 34.5 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 122.981 2.628 . . . . 0.0 113.347 168.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.277 42.7 ttt180 -62.45 -29.62 70.65 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 113.779 -3.01 . . . . 0.0 115.396 175.063 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.64 -36.86 41.84 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 122.216 2.28 . . . . 0.0 117.696 166.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 16.3 m -61.35 -44.35 97.33 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 114.988 -2.434 . . . . 0.0 114.223 173.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -58.27 -37.85 75.8 Favored 'General case' 0 N--CA 1.448 -0.527 1 O-C-N 129.186 4.054 . . . . 0.0 112.02 165.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 64.5 m -70.55 -35.32 73.04 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 124.083 3.129 . . . . 0.0 117.709 172.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.4 tp -69.35 -40.12 77.7 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 128.176 3.422 . . . . 0.0 113.499 170.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 18.7 tttp -59.99 -36.99 78.38 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 120.575 -1.328 . . . . 0.0 113.252 176.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.13 -13.13 58.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 172.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.55 126.36 91.42 Favored Pre-proline 0 N--CA 1.449 -0.504 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -67.63 155.73 68.91 Favored 'Trans proline' 0 N--CA 1.446 -1.281 1 C-N-CA 126.786 4.991 . . . . 0.0 108.759 -172.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . 0.396 3.1 m -68.06 -34.03 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 113.288 -1.778 . . . . 0.0 113.906 -165.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.28 13.0 pm0 -61.29 -35.46 77.38 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 170.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 43.0 tp -70.34 -44.7 67.64 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 124.525 2.107 . . . . 0.0 108.618 173.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.5 mtm180 -70.09 -29.41 66.38 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 116.733 -3.729 . . . . 0.0 114.661 -168.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -80.1 -30.45 39.16 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 117.028 2.232 . . . . 0.0 117.028 168.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 85.7 t90 -73.12 -37.16 66.77 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 169.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.99 -24.31 67.67 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.489 1.516 . . . . 0.0 114.078 174.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -80.33 -8.61 59.56 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.922 2.489 . . . . 0.0 114.883 165.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -99.34 -38.61 8.78 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 112.019 -3.848 . . . . 0.0 105.904 173.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.8 t -83.88 -57.72 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 O-C-N 127.992 3.308 . . . . 0.0 106.879 -165.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.4 mt -85.25 -30.33 23.9 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 120.413 1.46 . . . . 0.0 114.04 -158.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mt -105.86 -27.64 11.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 124.686 2.184 . . . . 0.0 108.276 -148.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.8 tttt . . . . . 0 N--CA 1.452 -0.372 0 C-N-CA 128.568 2.747 . . . . 0.0 115.994 -159.943 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.657 0 CA-C-O 124.564 2.126 . . . . 0.0 108.332 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 21.7 mmt -74.32 -24.81 59.26 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 117.674 -3.141 . . . . 0.0 108.936 -178.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.94 -42.86 56.85 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 120.305 -1.497 . . . . 0.0 109.837 171.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -62.02 -40.56 96.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.075 1.75 . . . . 0.0 111.022 177.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -65.8 -39.25 90.75 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.577 2.351 . . . . 0.0 108.79 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -86.38 -14.54 43.15 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 118.027 -2.921 . . . . 0.0 112.824 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -51.7 -47.7 63.83 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 121.025 1.739 . . . . 0.0 114.757 149.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -64.68 -44.83 89.07 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 118.354 -2.716 . . . . 0.0 110.605 -177.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -53.94 -45.88 71.4 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.702 1.601 . . . . 0.0 112.425 174.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 28.0 t-105 -64.26 -58.91 5.19 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 170.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 73.8 mt -51.78 -25.84 8.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 116.721 -1.609 . . . . 0.0 110.651 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -65.08 -31.93 73.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 174.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -67.43 -53.84 25.56 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 121.048 1.749 . . . . 0.0 109.941 165.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 29.7 t -46.11 -38.57 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 117.495 2.405 . . . . 0.0 117.495 171.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -75.07 -52.49 10.91 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.106 2.162 . . . . 0.0 106.61 171.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 46.2 tp -59.27 -34.08 71.83 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 124.891 3.496 . . . . 0.0 112.083 -175.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 27.8 tp -72.76 -37.58 67.62 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 114.503 -2.665 . . . . 0.0 115.39 173.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -65.14 -39.03 92.47 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 121.098 1.772 . . . . 0.0 113.363 176.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -71.59 -34.7 70.11 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 127.011 2.125 . . . . 0.0 108.484 173.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.51 -26.22 65.34 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 121.938 2.154 . . . . 0.0 113.098 175.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -70.77 -28.08 64.41 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.138 -2.226 . . . . 0.0 110.267 173.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -71.59 -13.08 61.66 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -123.55 -1.22 8.56 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 118.214 -2.804 . . . . 0.0 112.194 -172.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.332 0.3 OUTLIER 70.66 8.69 6.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.063 2.545 . . . . 0.0 116.556 -172.522 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.44 3.89 26.36 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 119.566 -1.959 . . . . 0.0 111.905 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -54.49 -47.86 72.53 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 177.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 27.8 tp -65.16 -61.9 5.47 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-O 116.167 -1.873 . . . . 0.0 111.23 -178.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -55.95 -31.47 81.96 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 CA-C-N 124.338 2.585 . . . . 0.0 118.687 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 46.5 tp -70.39 -42.11 72.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 113.623 -3.084 . . . . 0.0 114.22 170.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 21.8 mt -69.47 -33.59 73.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 123.403 2.819 . . . . 0.0 111.576 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -70.56 -26.88 63.75 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 125.144 1.528 . . . . 0.0 112.332 171.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . 0.282 11.7 tp -75.38 -33.48 61.03 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 116.543 -3.848 . . . . 0.0 115.277 164.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 24.4 mmt -84.2 -26.76 28.51 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -170.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 38.7 mt -122.82 136.92 55.03 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 124.242 0.964 . . . . 0.0 109.452 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 59.7 p -68.03 155.78 91.16 Favored Pre-proline 0 N--CA 1.447 -0.601 0 O-C-N 120.05 -1.656 . . . . 0.0 108.926 174.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -47.11 -38.84 25.43 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 122.886 2.391 . . . . 0.0 113.894 174.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -66.91 -45.41 78.05 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 115.592 -2.147 . . . . 0.0 114.902 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -64.1 -38.73 92.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 125.91 2.006 . . . . 0.0 115.118 171.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 42.2 mtm-85 -64.96 -37.95 89.35 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.052 -2.28 . . . . 0.0 111.595 170.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -69.46 -31.26 69.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 173.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.04 -62.42 1.71 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 114.622 -2.608 . . . . 0.0 109.218 170.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 7.2 mt -53.5 -35.7 60.9 Favored 'General case' 0 N--CA 1.447 -0.59 0 O-C-N 127.965 3.291 . . . . 0.0 117.548 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.17 -28.87 70.95 Favored Glycine 0 CA--C 1.522 0.494 0 O-C-N 125.446 1.716 . . . . 0.0 113.485 168.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.7 m -72.87 -34.72 66.91 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.716 -2.638 . . . . 0.0 110.099 166.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . 0.416 ' HA ' ' HB ' ' B' ' 57' ' ' ILE . 95.4 mtt180 -69.79 -18.67 63.49 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 112.634 -3.555 . . . . 0.0 114.804 174.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.38 -59.15 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 122.145 2.248 . . . . 0.0 109.882 157.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -55.42 -34.71 64.67 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 122.437 2.381 . . . . 0.0 116.81 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.416 ' HB ' ' HA ' ' B' ' 54' ' ' ARG 0.347 45.1 mt -57.11 -70.09 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 124.763 2.22 . . . . 0.0 108.678 173.556 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 57.6 t -54.52 -38.15 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 125.382 1.473 . . . . 0.0 112.29 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -65.46 -39.48 92.03 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 119.32 3.082 . . . . 0.0 119.32 169.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -74.38 -31.55 62.41 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 119.533 -1.979 . . . . 0.0 111.096 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 3.6 mt -55.47 -33.77 63.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.442 1.897 . . . . 0.0 113.227 168.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . 0.284 73.3 mt -85.52 -45.84 11.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 116.384 -1.77 . . . . 0.0 108.625 174.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.319 5.0 ttm105 -62.17 -64.3 0.97 Allowed 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 130.035 3.334 . . . . 0.0 110.79 -169.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.91 44.87 13.19 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 119.375 2.51 . . . . 0.0 119.375 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -106.63 -36.48 6.72 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 112.538 -1.831 . . . . 0.0 115.075 168.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 52.2 mtt -70.77 145.6 50.32 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 116.836 2.162 . . . . 0.0 116.836 -173.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 83.3 p -78.46 161.59 26.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 119.77 -1.831 . . . . 0.0 112.738 164.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -68.25 -20.15 64.78 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 119.345 -2.097 . . . . 0.0 108.665 -175.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -64.26 -45.09 89.62 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 115.093 -2.384 . . . . 0.0 113.083 164.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -62.3 -36.94 83.69 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 125.173 1.545 . . . . 0.0 113.059 177.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 91.3 mt -73.01 -51.81 16.8 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.43 1.492 . . . . 0.0 113.554 173.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 18.0 tptp -65.92 -46.14 79.33 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 119.443 -2.036 . . . . 0.0 110.892 -174.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -100.93 -17.53 16.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 124.177 0.923 . . . . 0.0 111.004 -164.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . 0.296 34.9 mt-10 -121.92 -16.25 7.64 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 115.613 -2.137 . . . . 0.0 111.432 -172.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 81.7 mt -112.04 -5.03 14.32 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 117.589 2.44 . . . . 0.0 117.589 162.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.63 21.65 69.18 Favored Glycine 0 C--N 1.334 0.467 0 O-C-N 124.433 1.083 . . . . 0.0 111.758 -177.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -111.9 108.32 17.65 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.617 -0.931 . . . . 0.0 112.131 -172.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.5 -176.19 51.26 Favored Glycine 0 CA--C 1.523 0.558 0 O-C-N 126.374 2.296 . . . . 0.0 109.606 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 26.8 mm -53.68 -46.02 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-O 125.925 2.774 . . . . 0.0 112.833 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.38 -23.94 54.1 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 117.643 -3.16 . . . . 0.0 110.12 -171.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 5.6 m -79.1 -35.47 42.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 125.696 1.873 . . . . 0.0 109.919 177.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 38.5 mm -74.77 -52.03 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 C-N-CA 130.884 3.674 . . . . 0.0 110.549 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 30.9 m -57.61 -37.98 74.17 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 130.095 3.358 . . . . 0.0 113.34 173.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -66.75 -47.09 73.32 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.997 -1.001 . . . . 0.0 111.531 169.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -54.64 -36.97 59.98 Favored Glycine 0 CA--C 1.521 0.466 0 O-C-N 119.121 -2.237 . . . . 0.0 114.83 166.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 24.2 p -72.47 -29.19 63.43 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.223 1.011 . . . . 0.0 110.24 -178.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -70.77 -44.59 66.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.475 1.51 . . . . 0.0 114.821 166.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 70.5 m -57.85 -34.63 69.93 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 115.072 1.508 . . . . 0.0 115.072 177.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 16.8 mt -60.89 -24.64 66.13 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 127.599 3.062 . . . . 0.0 111.598 168.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -93.8 -43.35 8.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.697 1.999 . . . . 0.0 111.353 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.35 -1.21 1.56 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.398 1.879 . . . . 0.0 115.328 162.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.16 149.76 50.7 Favored Pre-proline 0 N--CA 1.447 -0.585 0 O-C-N 119.708 -1.87 . . . . 0.0 110.287 174.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -60.47 144.61 99.53 Favored 'Trans proline' 0 N--CA 1.448 -1.204 0 C-N-CA 122.857 2.371 . . . . 0.0 112.658 164.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 25.2 m -67.92 -23.72 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -178.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -68.84 -4.68 17.17 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 117.852 -3.03 . . . . 0.0 114.308 166.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 15.0 tp -99.5 -35.61 9.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 120.726 1.603 . . . . 0.0 110.338 170.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 57.9 mtp85 -54.55 -41.29 69.59 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 130.9 3.68 . . . . 0.0 113.959 173.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -74.44 -42.41 59.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.158 2.183 . . . . 0.0 110.409 167.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -52.81 -36.82 59.01 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 116.362 -1.78 . . . . 0.0 114.244 178.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 21.0 mt -83.76 -35.27 24.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.081 1.753 . . . . 0.0 113.606 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -61.91 -31.54 71.86 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 171.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -103.1 -15.49 16.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 125.493 1.746 . . . . 0.0 115.378 -175.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 53.9 t -85.1 -54.21 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 128.668 2.787 . . . . 0.0 110.879 167.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 14.0 mt -78.11 -44.36 26.34 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 116.886 2.18 . . . . 0.0 116.886 -168.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 88.3 mt -76.67 -22.72 53.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 127.308 2.88 . . . . 0.0 111.07 -169.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -86.58 -4.7 59.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 128.704 2.802 . . . . 0.0 112.255 170.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 17.6 m -104.49 3.57 32.17 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.304 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 19.1 t70 . . . . . 0 C--O 1.251 1.139 0 C-N-CA 128.704 2.802 . . . . 0.0 114.203 178.444 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ttt . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.86 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.275 . . -72.33 154.43 40.95 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 127.45 2.969 . . . . 0.0 113.35 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -126.94 145.74 50.57 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 126.193 1.797 . . . . 0.0 110.414 -177.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -121.14 126.17 49.06 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.935 1.294 . . . . 0.0 112.228 171.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 5' ' ' SER . . . . . 0.436 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 58.5 p -136.82 142.3 38.25 Favored Pre-proline 0 N--CA 1.445 -0.725 0 C-N-CA 128.117 2.567 . . . . 0.0 109.225 -179.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' C' ' 5' ' ' SER . 53.3 Cg_exo -64.88 -14.99 48.12 Favored 'Trans proline' 0 N--CA 1.451 -1.013 0 N-CA-C 120.157 3.099 . . . . 0.0 120.157 -164.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -140.97 147.76 39.26 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.125 1.37 . . . . 0.0 114.29 176.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 9.1 t -140.84 133.65 28.98 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.222 1.963 . . . . 0.0 108.527 164.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.52 -25.05 53.75 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 111.981 -2.372 . . . . 0.0 113.576 173.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.19 -29.36 34.61 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 119.381 -2.074 . . . . 0.0 110.096 178.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 39.8 mtt -66.07 -38.32 88.0 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.174 2.19 . . . . 0.0 112.284 169.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.17 84.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 117.441 2.386 . . . . 0.0 117.441 164.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -73.01 -35.48 66.81 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 125.533 1.771 . . . . 0.0 106.467 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -63.51 -44.92 92.91 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.514 2.042 . . . . 0.0 116.514 166.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -32.33 73.83 Favored 'General case' 0 N--CA 1.448 -0.547 1 O-C-N 116.141 -4.099 . . . . 0.0 107.973 177.066 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -68.0 -54.09 21.08 Favored 'General case' 0 N--CA 1.453 -0.292 1 O-C-N 115.628 -4.42 . . . . 0.0 111.416 173.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.275 67.0 mm-40 -54.44 -35.78 63.35 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 114.867 1.432 . . . . 0.0 114.867 172.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -64.58 -35.04 79.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 172.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 -71.16 -37.51 72.23 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 124.257 1.98 . . . . 0.0 108.383 177.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . 0.285 9.7 mp -67.09 -16.87 64.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.628 177.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -93.31 -31.41 14.69 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 114.099 -2.857 . . . . 0.0 113.377 178.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -64.06 -33.9 76.81 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 126.518 2.386 . . . . 0.0 109.008 168.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.284 11.1 t -60.99 -44.31 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 O-C-N 118.562 -2.586 . . . . 0.0 114.917 168.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -71.7 -32.3 67.68 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 126.623 2.452 . . . . 0.0 117.229 -174.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 50.0 tp -68.37 -50.61 51.92 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 118.482 -1.287 . . . . 0.0 108.599 173.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 61.7 tp -57.23 -37.2 71.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 120.544 -1.347 . . . . 0.0 110.461 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -47.67 -55.66 8.94 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.789 2.436 . . . . 0.0 111.849 173.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -74.87 -25.13 58.74 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.192 -2.813 . . . . 0.0 107.57 -177.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.5 -26.12 68.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 118.818 2.896 . . . . 0.0 118.818 -175.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -64.01 -41.33 97.49 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 122.745 1.259 . . . . 0.0 114.343 171.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -61.34 -36.5 80.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.072 -1.422 . . . . 0.0 111.551 -174.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . 0.312 29.6 p-10 -108.29 9.31 27.95 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.13 2.172 . . . . 0.0 116.756 173.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.535 5.0 m-20 61.21 28.45 18.05 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 117.065 -3.522 . . . . 0.0 120.507 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.02 4.13 35.33 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 116.654 2.094 . . . . 0.0 116.654 165.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -67.59 -43.31 80.84 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 122.08 2.218 . . . . 0.0 115.212 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 80.6 mt -65.92 -50.21 54.12 Favored Pre-proline 0 N--CA 1.45 -0.432 0 O-C-N 117.747 -3.096 . . . . 0.0 112.449 166.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -42.82 -49.4 6.78 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 CA-C-N 124.176 2.527 . . . . 0.0 118.205 162.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 19.8 tp -63.36 -40.62 97.77 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.318 66.8 mt -70.77 -8.4 52.05 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 118.329 -2.732 . . . . 0.0 115.514 174.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -107.96 -1.49 20.58 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 130.997 3.719 . . . . 0.0 111.32 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 12.3 tp -104.98 -48.05 3.84 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 120.814 -1.179 . . . . 0.0 113.194 166.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 87.5 mmm -78.29 -2.53 38.41 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -170.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mp -138.75 154.84 48.56 Favored 'General case' 0 N--CA 1.452 -0.342 1 O-C-N 115.877 -4.264 . . . . 0.0 107.663 -172.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 54.6 p -79.67 160.25 69.94 Favored Pre-proline 0 N--CA 1.449 -0.521 0 C-N-CA 129.791 3.236 . . . . 0.0 112.655 163.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -48.52 -43.35 33.43 Favored 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 122.811 2.341 . . . . 0.0 114.907 169.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -40.35 94.9 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 118.091 -2.881 . . . . 0.0 108.717 175.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -66.94 -35.32 79.72 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 123.686 2.948 . . . . 0.0 113.346 -176.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 82.3 mtm-85 -64.8 -31.36 72.56 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 127.608 3.575 . . . . 0.0 115.132 165.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.78 -30.0 45.33 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 111.882 -2.417 . . . . 0.0 105.521 -172.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.46 -37.05 77.15 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 123.485 1.612 . . . . 0.0 114.613 175.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 68.6 mt -74.91 -25.63 59.05 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 117.724 2.49 . . . . 0.0 117.724 167.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.11 -45.88 94.49 Favored Glycine 0 CA--C 1.526 0.751 0 O-C-N 118.837 -2.414 . . . . 0.0 111.87 164.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 58.3 m -60.98 -57.16 13.8 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 130.249 3.42 . . . . 0.0 109.412 174.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.38 26.9 mtt180 -60.59 -31.37 70.52 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.025 -1.047 . . . . 0.0 113.452 -170.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 46.8 t -67.97 -45.47 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.251 0.62 . . . . 0.0 110.088 174.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.76 -1.96 6.27 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.549 -2.594 . . . . 0.0 115.329 171.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 53.1 mt -99.49 -34.13 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 120.557 1.526 . . . . 0.0 110.328 173.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 77.5 t -69.85 -41.49 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 117.592 -3.192 . . . . 0.0 113.852 172.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -64.02 -42.66 97.06 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 122.494 1.14 . . . . 0.0 111.944 176.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -64.34 -24.6 67.7 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 170.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 97.0 mt -90.73 -17.34 26.88 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 63.5 mt -84.81 -41.08 16.44 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.881 2.472 . . . . 0.0 111.482 163.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 29.7 ttm105 -61.88 -41.85 98.35 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 126.228 2.918 . . . . 0.0 112.373 175.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.35 12.99 61.96 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 119.682 2.633 . . . . 0.0 119.682 172.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -73.28 -31.49 64.09 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 118.442 -2.799 . . . . 0.0 111.604 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 17.3 mmt -72.04 141.53 49.29 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 126.503 3.049 . . . . 0.0 110.585 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 53.8 p -114.1 169.01 9.33 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 111.466 -2.606 . . . . 0.0 113.833 -171.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -43.43 -33.91 1.18 Allowed 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 126.668 2.48 . . . . 0.0 116.606 -170.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 26.2 ttp-105 -72.37 -51.68 19.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 126.252 1.821 . . . . 0.0 109.468 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -69.37 -40.78 77.24 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 128.523 2.729 . . . . 0.0 112.414 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 91.1 mt -52.28 -21.46 3.5 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 117.233 2.309 . . . . 0.0 117.233 167.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -106.16 -42.79 4.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 120.322 -1.486 . . . . 0.0 110.949 166.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -88.16 -8.21 55.72 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 120.927 -1.108 . . . . 0.0 112.788 -165.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -129.71 -47.31 1.15 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 116.185 -1.864 . . . . 0.0 114.342 -177.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 mp -64.71 -28.3 69.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 120.164 1.347 . . . . 0.0 111.336 163.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 57.09 -151.6 26.35 Favored Glycine 0 N--CA 1.447 -0.595 0 N-CA-C 117.214 1.645 . . . . 0.0 117.214 -168.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.03 -20.84 55.42 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 116.491 -3.947 . . . . 0.0 114.981 -168.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.32 -5.1 26.63 Favored Glycine 0 C--N 1.337 0.599 0 O-C-N 126.958 2.661 . . . . 0.0 115.618 -178.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 16.5 tt -64.4 -31.87 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 O-C-N 117.601 -3.293 . . . . 0.0 110.468 170.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.15 -18.44 36.72 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 122.326 2.33 . . . . 0.0 114.142 -177.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 55.1 m -73.99 -26.8 60.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.269 2.228 . . . . 0.0 112.841 170.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 24.4 mm -98.13 -6.39 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 O-C-N 117.134 -3.479 . . . . 0.0 110.954 178.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 80.8 p -125.01 4.95 7.96 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 118.584 -2.573 . . . . 0.0 116.586 -166.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -127.66 149.09 50.36 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.399 0.68 . . . . 0.0 111.952 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.61 178.15 42.55 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-O 117.194 -1.892 . . . . 0.0 114.77 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 18.4 m -71.16 -15.56 62.49 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 118.045 2.609 . . . . 0.0 118.045 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -96.15 -7.3 36.22 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 120.524 3.528 . . . . 0.0 120.524 170.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 8.4 p -42.96 158.71 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 123.209 1.48 . . . . 0.0 114.277 175.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 57.5 tp -54.59 -38.24 66.5 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 130.536 3.534 . . . . 0.0 109.119 -167.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -99.3 -1.15 39.7 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 122.126 2.239 . . . . 0.0 113.077 -175.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -116.4 -13.21 11.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.322 -0.853 . . . . 0.0 112.656 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.29 155.76 6.54 Favored Pre-proline 0 N--CA 1.454 -0.257 0 C-N-CA 126.628 1.971 . . . . 0.0 113.896 171.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.28 149.86 83.27 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.12 1.88 . . . . 0.0 112.73 178.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 29.3 t -65.88 -46.61 88.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 126.105 1.762 . . . . 0.0 109.614 -172.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -62.29 -25.85 68.08 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 113.172 -3.299 . . . . 0.0 117.684 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 15.8 tp -66.55 -48.37 69.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 125.793 1.933 . . . . 0.0 109.377 163.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -63.95 -51.01 66.35 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.355 -165.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -60.15 -29.76 68.86 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.819 2.048 . . . . 0.0 116.236 168.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.7 t90 -78.25 -30.11 48.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 122.384 2.357 . . . . 0.0 108.673 -177.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 16.2 mt -63.77 -40.54 96.93 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 116.815 -1.564 . . . . 0.0 115.121 177.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -70.18 -18.32 63.19 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 127.522 2.329 . . . . 0.0 111.552 177.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -85.7 -28.16 24.84 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 115.359 -2.258 . . . . 0.0 116.158 167.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 17.4 t -96.42 -51.03 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.99 2.632 . . . . 0.0 112.803 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 85.1 mt -76.58 -23.63 53.49 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.101 -175.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 71.6 mt -128.91 29.48 5.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.102 1.761 . . . . 0.0 110.494 -168.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 17.4 pttp . . . . . 0 N--CA 1.451 -0.422 0 CA-C-O 128.08 3.8 . . . . 0.0 117.518 -174.67 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 59.7 p . . . . . 0 N--CA 1.451 -0.388 0 CA-C-O 118.041 -0.981 . . . . 0.0 111.292 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . 0.329 89.5 Cg_endo -78.74 -18.42 11.83 Favored 'Trans proline' 0 N--CA 1.45 -1.049 1 C-N-CA 126.943 5.095 . . . . 0.0 118.774 -166.822 . . . . . . . . 3 2 . 1 . 011 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -154.87 129.69 9.35 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.638 3.175 . . . . 0.0 106.513 156.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.9 t -64.81 124.74 22.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 118.432 2.752 . . . . 0.0 118.432 -174.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.82 -42.54 58.41 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 128.033 2.533 . . . . 0.0 110.37 166.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.38 -27.08 65.92 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.294 -2.129 . . . . 0.0 111.979 177.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.298 9.2 mmt -66.57 -49.09 67.55 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 112.956 -3.402 . . . . 0.0 113.882 161.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.14 -36.52 51.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 125.842 2.734 . . . . 0.0 115.126 175.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 35.7 tp10 -76.04 -47.9 22.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 116.406 -1.759 . . . . 0.0 108.899 174.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -55.55 -44.23 76.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 128.682 2.793 . . . . 0.0 110.668 176.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . 0.419 HH21 ' CD ' ' D' ' 18' ' ' GLU . 0.0 OUTLIER -64.66 -37.06 86.28 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.324 -2.735 . . . . 0.0 115.372 173.651 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -57.56 -45.39 85.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 119.809 1.186 . . . . 0.0 114.199 165.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -74.99 -35.04 62.04 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.639 -1.913 . . . . 0.0 114.305 -175.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . 0.419 ' CD ' HH21 ' D' ' 15' ' ' ARG . 79.0 mt-10 -62.0 -21.28 64.73 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 116.189 -1.862 . . . . 0.0 113.924 163.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -89.33 -26.72 20.95 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 127.22 2.825 . . . . 0.0 113.104 172.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 20.4 mt -69.61 -30.23 67.93 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 123.788 1.756 . . . . 0.0 113.607 172.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 37.7 ttt180 -71.51 -24.79 62.03 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.317 -2.115 . . . . 0.0 112.261 168.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -74.06 -56.45 4.92 Favored 'General case' 0 N--CA 1.453 -0.318 1 O-C-N 115.746 -4.346 . . . . 0.0 108.972 167.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 23.4 t -58.76 -37.82 68.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 121.527 1.967 . . . . 0.0 114.476 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -61.19 -39.4 90.03 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 124.76 1.288 . . . . 0.0 114.442 166.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 16.6 tp -67.44 -41.67 84.38 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 119.937 -1.727 . . . . 0.0 112.466 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 55.0 tp -63.07 -49.36 74.8 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 113.53 -3.128 . . . . 0.0 112.07 171.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -48.91 -55.7 11.0 Favored 'General case' 0 N--CA 1.451 -0.389 1 CA-C-N 126.978 4.445 . . . . 0.0 111.561 167.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -52.81 -30.84 35.65 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 121.294 1.861 . . . . 0.0 112.655 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.88 -34.06 62.16 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 123.126 1.441 . . . . 0.0 112.746 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -68.78 -4.93 17.9 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.109 -3.494 . . . . 0.0 115.233 163.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -104.94 -6.97 19.63 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 117.347 -3.345 . . . . 0.0 113.054 176.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 50.2 p30 -132.97 9.75 4.18 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 128.251 2.62 . . . . 0.0 114.016 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.38 7.1 m-20 67.35 6.76 5.07 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 116.555 2.058 . . . . 0.0 116.555 173.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 32.1 mt -77.68 16.24 0.7 Allowed 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 116.484 -3.885 . . . . 0.0 115.2 166.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -81.19 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.872 2.469 . . . . 0.0 114.059 171.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 14.3 mt -48.58 -30.12 1.95 Allowed Pre-proline 0 N--CA 1.447 -0.615 0 O-C-N 116.613 -3.804 . . . . 0.0 114.085 -176.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -68.13 -48.17 1.42 Allowed 'Trans proline' 0 N--CA 1.447 -1.241 0 O-C-N 114.412 -3.52 . . . . 0.0 116.095 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . 0.261 63.6 tp -48.97 -50.74 34.15 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 116.558 -1.687 . . . . 0.0 108.713 170.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 2.8 mt -66.54 -39.32 88.5 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 113.69 -3.052 . . . . 0.0 106.299 -172.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 -84.22 -17.26 40.44 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 115.587 -2.149 . . . . 0.0 114.119 -176.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 39.9 tp -65.72 -54.5 26.49 Favored 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 125.01 1.444 . . . . 0.0 108.379 161.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 1.7 mmt -68.1 -39.52 82.81 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.101 -1.428 . . . . 0.0 108.43 -168.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 37.3 mt -119.59 137.32 53.93 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 -165.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 8.0 p -73.85 153.75 89.07 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-N 114.057 -1.429 . . . . 0.0 112.757 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -48.99 -37.15 36.66 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 124.97 3.78 . . . . 0.0 120.496 -174.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.365 24.5 m-20 -72.39 -23.16 61.07 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 115.069 -2.396 . . . . 0.0 111.189 176.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -85.1 -32.03 23.03 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 15.7 mtm180 -75.8 -37.1 59.46 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.597 1.559 . . . . 0.0 110.6 173.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -54.83 -47.21 74.4 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 129.401 3.081 . . . . 0.0 107.76 170.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.46 -46.18 80.86 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -178.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.71 -42.76 95.05 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 116.141 -1.885 . . . . 0.0 113.4 174.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.76 -27.07 65.97 Favored Glycine 0 C--N 1.338 0.643 0 CA-C-N 120.307 1.412 . . . . 0.0 116.063 167.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 95.7 m -82.99 -35.48 25.84 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 117.052 -3.617 . . . . 0.0 110.94 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -60.71 -33.39 72.81 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 116.841 -3.662 . . . . 0.0 108.519 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 43.9 t -64.27 -36.11 76.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 123.738 2.972 . . . . 0.0 114.124 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -80.56 -32.28 36.66 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 115.973 -1.965 . . . . 0.0 114.52 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 82.7 mt -49.0 -48.75 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 116.612 -1.661 . . . . 0.0 113.568 160.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 75.3 t -68.99 -43.77 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 O-C-N 124.578 1.174 . . . . 0.0 109.835 -178.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -59.13 -40.02 84.16 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -67.04 -25.86 66.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 116.213 -1.851 . . . . 0.0 112.35 175.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 mt -72.96 -13.35 61.22 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 122.152 2.251 . . . . 0.0 112.169 173.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 85.5 mt -111.85 -18.96 12.57 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 117.393 -1.289 . . . . 0.0 113.759 176.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 ttm105 -69.85 -47.49 62.46 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 162.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 44.55 66.02 1.54 Allowed Glycine 0 CA--C 1.52 0.381 0 C-N-CA 126.285 1.898 . . . . 0.0 110.156 -173.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -130.67 -29.78 1.91 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.023 0.929 . . . . 0.0 112.282 164.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 22.2 mmt -81.02 69.35 7.6 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 125.213 2.435 . . . . 0.0 108.342 165.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 89.6 p -79.16 145.68 33.55 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.593 1.957 . . . . 0.0 111.243 -162.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 56.55 -88.17 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.125 -2.307 . . . . 0.0 115.927 156.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -72.54 -33.46 66.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 169.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -64.66 -42.72 95.2 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.94 -41.09 77.62 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.58 1.8 . . . . 0.0 112.517 174.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 58.1 mtmt -77.71 -37.31 49.77 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 125.09 1.493 . . . . 0.0 112.088 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -83.34 -56.3 3.84 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 121.692 2.042 . . . . 0.0 111.441 -177.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -93.95 -38.69 11.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 125.126 1.516 . . . . 0.0 113.128 -162.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -90.21 -24.06 21.1 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.258 -1.353 . . . . 0.0 108.152 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 74.58 -153.76 46.38 Favored Glycine 0 C--N 1.335 0.52 0 O-C-N 118.356 -2.715 . . . . 0.0 118.187 141.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -34.83 -65.02 0.23 Allowed 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 129.228 3.011 . . . . 0.0 113.71 -165.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.73 -1.7 2.9 Favored Glycine 0 C--N 1.339 0.701 0 O-C-N 126.412 2.32 . . . . 0.0 116.851 -174.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 2.2 tt -47.53 -34.69 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 122.549 3.175 . . . . 0.0 111.181 164.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -91.63 -20.78 21.26 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 119.388 -2.07 . . . . 0.0 110.266 -169.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 81.9 m -65.55 -46.2 80.46 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.349 1.86 . . . . 0.0 110.695 163.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 mm -73.9 -33.89 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 125.347 1.459 . . . . 0.0 111.361 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 16.3 p -119.72 9.61 11.45 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 118.775 2.88 . . . . 0.0 118.775 -174.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 17.8 mtp85 -123.85 173.47 8.16 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 153.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.63 152.98 29.72 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-O 116.633 -2.204 . . . . 0.0 113.498 -154.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 9.6 p -61.44 -29.6 70.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -165.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -128.6 45.05 2.85 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 123.878 1.799 . . . . 0.0 112.18 -177.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 1.7 p -69.24 177.73 2.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 119.808 -1.808 . . . . 0.0 109.382 -178.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 tp -66.22 -24.05 66.54 Favored 'General case' 0 N--CA 1.451 -0.379 1 O-C-N 116.108 -4.12 . . . . 0.0 114.731 176.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -67.72 -7.81 30.24 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 118.394 2.739 . . . . 0.0 118.394 159.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -133.93 11.95 3.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 115.382 -2.247 . . . . 0.0 113.245 -168.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 30.35 99.32 0.03 OUTLIER Pre-proline 0 N--CA 1.452 -0.343 0 N-CA-C 116.558 2.058 . . . . 0.0 116.558 134.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . 0.402 ' C ' ' H ' ' D' ' 95' ' ' GLU 0.346 0.3 OUTLIER 39.33 43.98 0.0 OUTLIER 'Cis proline' 0 N--CA 1.445 -1.341 0 O-C-N 117.147 -2.08 . . . . 0.0 109.902 26.339 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.94 -21.11 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 O-C-N 119.508 -1.995 . . . . 0.0 111.26 170.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' D' ' 93' ' ' PRO 0.304 0.0 OUTLIER -91.15 -26.16 19.23 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 125.462 1.726 . . . . 0.0 112.201 -171.414 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.21 -51.7 55.14 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 131.064 3.745 . . . . 0.0 108.495 162.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -58.94 -48.8 80.2 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 126.128 1.771 . . . . 0.0 113.802 -174.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -63.56 -29.14 70.44 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 125.423 1.702 . . . . 0.0 115.399 170.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 70.6 t90 -83.37 -27.31 29.76 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 121.335 1.88 . . . . 0.0 111.652 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 25.7 mt -69.59 -34.8 74.65 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.179 -3.451 . . . . 0.0 110.498 171.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -67.64 -20.52 65.34 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 116.812 -1.566 . . . . 0.0 112.769 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -104.74 -9.88 17.82 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 126.556 2.41 . . . . 0.0 116.765 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.439 3.2 t -106.74 -26.61 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-O 125.698 2.666 . . . . 0.0 116.141 171.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 36.0 mt -104.83 -19.24 13.96 Favored 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 116.611 -3.806 . . . . 0.0 114.545 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 5.1 mp -110.73 44.7 1.23 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.771 1.628 . . . . 0.0 110.495 153.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -62.83 167.71 4.44 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 117.835 2.532 . . . . 0.0 117.835 169.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.9 m -52.4 -42.23 63.85 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 119.314 -2.116 . . . . 0.0 115.08 -170.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.247 0.945 0 C-N-CA 128.612 2.765 . . . . 0.0 118.104 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.451 -0.408 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.32 -22.78 61.13 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 120.428 3.492 . . . . 0.0 120.428 167.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -69.78 -37.51 76.37 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 120.985 -1.072 . . . . 0.0 112.292 157.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -66.78 -37.25 84.22 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 116.645 -3.784 . . . . 0.0 109.414 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -76.97 -3.81 40.83 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 130.747 3.619 . . . . 0.0 116.683 169.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -83.0 -50.31 8.67 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 116.412 -2.115 . . . . 0.0 110.334 163.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -41.76 -41.19 2.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 119.37 3.1 . . . . 0.0 119.37 161.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -65.17 -36.9 85.66 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.032 1.333 . . . . 0.0 113.694 174.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 9.2 t-105 -72.44 -45.57 59.01 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 117.61 -1.186 . . . . 0.0 112.807 170.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.32 -27.52 67.4 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 117.696 -1.145 . . . . 0.0 113.002 178.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . 0.313 12.1 ttt-85 -60.24 -23.22 63.9 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 130.756 3.622 . . . . 0.0 115.329 169.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.252 61.6 t80 -79.79 -43.95 21.54 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 115.427 -2.509 . . . . 0.0 109.684 165.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 68.8 t -69.51 -35.99 69.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -168.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -60.96 -37.01 80.89 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 165.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.9 tp -72.61 -30.41 64.32 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.257 1.023 . . . . 0.0 112.298 -177.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 48.5 tp -82.28 -31.76 29.91 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 128.047 2.539 . . . . 0.0 106.056 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -62.73 -44.35 96.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 121.996 2.18 . . . . 0.0 108.261 175.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -68.39 -36.29 78.94 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 127.475 3.512 . . . . 0.0 109.65 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.83 -40.93 95.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 116.535 -3.853 . . . . 0.0 117.477 175.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -68.84 -33.48 73.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 120.544 1.52 . . . . 0.0 113.044 173.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -71.96 -21.24 61.62 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 117.161 -3.462 . . . . 0.0 116.39 170.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -101.26 11.72 38.81 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 114.04 -2.886 . . . . 0.0 114.512 168.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 48.67 42.94 20.27 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 125.225 1.578 . . . . 0.0 113.142 -175.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -114.28 -1.66 13.53 Favored 'General case' 0 N--CA 1.45 -0.458 1 C-N-CA 133.538 4.735 . . . . 0.0 113.314 176.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -56.81 -43.08 80.62 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 122.683 2.492 . . . . 0.0 112.951 -178.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.5 mt -64.17 -63.45 3.82 Favored Pre-proline 0 N--CA 1.447 -0.584 0 O-C-N 120.549 -1.344 . . . . 0.0 109.841 -175.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -70.17 -11.58 30.56 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 CA-C-O 115.462 -1.974 . . . . 0.0 112.716 -174.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.6 tp -70.52 -63.25 1.13 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 129.254 3.021 . . . . 0.0 105.105 167.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 37.0 mt -58.86 -34.5 71.67 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 119.571 -1.956 . . . . 0.0 114.537 -175.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -51.71 -50.76 59.88 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.479 1.112 . . . . 0.0 112.299 164.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.8 tt -64.32 -47.18 80.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 126.584 1.954 . . . . 0.0 109.869 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 65.9 mmm -83.86 -17.95 39.17 Favored 'General case' 0 N--CA 1.453 -0.295 1 CA-C-O 111.306 -4.188 . . . . 0.0 116.49 -167.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 mt -133.5 138.77 46.28 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 124.201 3.182 . . . . 0.0 108.444 170.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.9 p -73.5 155.5 89.41 Favored Pre-proline 0 N--CA 1.448 -0.544 0 CA-C-N 114.359 -1.291 . . . . 0.0 111.011 177.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -59.45 -29.24 89.55 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 CA-C-O 114.905 -2.206 . . . . 0.0 117.212 -170.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.49 -23.61 53.76 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 122.748 2.522 . . . . 0.0 107.372 178.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -81.26 -27.63 35.08 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 116.74 -3.725 . . . . 0.0 113.221 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.8 mtm-85 -69.73 -57.13 5.5 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 117.904 -2.998 . . . . 0.0 108.373 178.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . 0.275 24.4 tt0 -61.84 -27.18 68.59 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.365 1.866 . . . . 0.0 111.889 177.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.75 -38.05 70.44 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.62 2.368 . . . . 0.0 110.269 174.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.9 mt -70.62 -27.71 64.29 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 120.823 1.647 . . . . 0.0 115.199 166.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.5 -38.02 95.69 Favored Glycine 0 C--N 1.335 0.501 0 CA-C-N 122.094 2.225 . . . . 0.0 111.299 167.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.0 m -68.91 -39.87 79.42 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 119.614 3.19 . . . . 0.0 119.614 171.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -54.93 -24.13 22.21 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 114.829 -2.51 . . . . 0.0 115.724 163.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.3 t -60.93 -38.66 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 122.397 2.362 . . . . 0.0 113.17 164.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -77.74 -29.67 51.23 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 114.983 -2.436 . . . . 0.0 114.378 171.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 66.8 mt -74.74 -24.57 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 122.48 2.4 . . . . 0.0 112.556 172.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 4.3 t -71.12 -51.77 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 C-N-CA 124.789 1.236 . . . . 0.0 110.986 159.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -50.51 -67.99 0.21 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.067 1.747 . . . . 0.0 111.922 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -71.79 -34.93 69.82 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.611 2.365 . . . . 0.0 110.541 -165.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.66 -39.45 91.42 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 118.022 2.601 . . . . 0.0 118.022 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.89 -37.14 72.98 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.751 2.02 . . . . 0.0 113.877 177.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 34.8 ttm105 -66.76 -44.6 80.97 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 165.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.7 18.02 55.49 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 110.014 -3.266 . . . . 0.0 113.372 155.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.257 47.9 mm-40 -88.18 -27.22 21.98 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 120.595 2.198 . . . . 0.0 107.025 -179.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 57.3 mtt -91.91 124.95 36.4 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 125.098 1.499 . . . . 0.0 112.603 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.8 p -73.07 164.63 26.41 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.024 1.73 . . . . 0.0 112.589 166.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -59.4 -40.06 85.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 123.967 0.792 . . . . 0.0 112.999 166.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 42.2 tpt85 -57.63 -27.37 62.73 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 173.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -87.1 -34.99 18.93 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 117.063 2.245 . . . . 0.0 117.063 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 92.0 mt -58.6 -26.16 63.38 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 118.806 -2.434 . . . . 0.0 115.592 167.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -42.28 -44.67 3.92 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 115.663 1.727 . . . . 0.0 115.663 157.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -83.37 -46.12 12.93 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 174.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -62.53 -46.77 86.87 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 125.458 1.503 . . . . 0.0 111.148 -169.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.9 mt -119.09 9.21 11.73 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 111.787 -2.46 . . . . 0.0 109.042 -169.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.79 12.1 74.17 Favored Glycine 0 C--N 1.337 0.596 0 N-CA-C 117.985 1.954 . . . . 0.0 117.985 174.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -97.2 141.59 30.14 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 118.875 2.917 . . . . 0.0 118.875 -157.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.03 123.17 21.04 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-O 116.656 -2.191 . . . . 0.0 110.422 168.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 72.0 mt -53.88 -35.08 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 118.719 1.259 . . . . 0.0 112.387 -162.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.2 -14.36 61.78 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 119.308 -2.12 . . . . 0.0 114.491 -171.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 78.0 p -74.56 -44.6 50.2 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.9 mm -68.93 -29.23 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-O 115.091 -2.385 . . . . 0.0 107.453 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 99.0 m -60.89 -32.15 71.62 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 120.908 1.686 . . . . 0.0 114.009 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -69.69 -46.26 66.43 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.919 -1.113 . . . . 0.0 113.114 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.15 -26.97 65.05 Favored Glycine 0 CA--C 1.525 0.712 0 O-C-N 119.739 -1.851 . . . . 0.0 110.29 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.2 m -64.64 -38.93 92.68 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.854 0.862 . . . . 0.0 110.161 169.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -77.34 -30.03 53.72 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 118.697 -2.502 . . . . 0.0 110.757 175.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.7 m -67.43 -40.14 85.46 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 122.362 2.346 . . . . 0.0 112.938 170.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.4 tp -64.4 -41.7 96.5 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 117.626 2.454 . . . . 0.0 117.626 168.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -57.8 -39.53 77.79 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 119.756 -1.84 . . . . 0.0 111.04 165.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.71 3.59 44.2 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 121.422 3.86 . . . . 0.0 121.422 175.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.44 153.36 85.8 Favored Pre-proline 0 N--CA 1.449 -0.482 0 O-C-N 126.336 2.272 . . . . 0.0 108.782 178.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -67.12 148.57 81.28 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 N-CA-C 109.303 -1.076 . . . . 0.0 109.303 -175.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.14 -30.79 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 117.852 -1.071 . . . . 0.0 111.692 -163.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 16.1 pm0 -76.86 -7.96 56.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.267 2.227 . . . . 0.0 111.392 -177.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 49.3 tp -87.34 -46.85 9.29 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 124.794 1.309 . . . . 0.0 112.944 168.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 54.5 mtm-85 -56.86 -35.28 68.7 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 119.251 -2.156 . . . . 0.0 110.493 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -66.94 -20.61 65.93 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 116.844 -3.66 . . . . 0.0 117.69 171.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -90.27 -42.94 10.7 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 118.061 -2.9 . . . . 0.0 106.715 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.66 -20.45 64.83 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 126.12 1.768 . . . . 0.0 114.683 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -70.21 -48.53 56.69 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.861 -3.024 . . . . 0.0 108.677 170.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -71.44 -32.23 68.12 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.239 -175.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 80.8 t -81.37 -59.75 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-O 113.464 -3.16 . . . . 0.0 110.959 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.6 mt -96.28 -29.69 13.86 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 127.367 2.917 . . . . 0.0 113.268 -172.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 11.7 mt -107.46 -22.9 12.38 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 114.735 -2.786 . . . . 0.0 110.84 -159.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 71.7 tttt . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 125.319 2.485 . . . . 0.0 115.19 -175.314 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.423 0 N-CA-C 118.244 2.683 . . . . 0.0 118.244 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.86 -30.27 28.74 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.289 1.836 . . . . 0.0 108.097 172.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.77 -17.9 65.1 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 163.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -85.02 -46.14 11.47 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.508 1.123 . . . . 0.0 112.615 171.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 36.5 tp60 -63.77 -28.78 70.11 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 118.392 -0.813 . . . . 0.0 111.863 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -85.41 -16.21 40.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.774 -1.829 . . . . 0.0 113.793 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -80.69 -33.46 35.4 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 119.182 -2.199 . . . . 0.0 108.433 172.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -78.03 -13.52 59.84 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 118.185 -2.822 . . . . 0.0 110.852 175.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -72.91 -39.0 66.68 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 126.183 1.793 . . . . 0.0 113.321 160.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -62.05 -35.94 80.12 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.37 -2.081 . . . . 0.0 111.005 173.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 93.9 mt -70.01 -26.78 64.23 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 128.425 2.69 . . . . 0.0 113.963 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -54.0 -59.97 3.94 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 115.685 -2.102 . . . . 0.0 110.336 165.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -44.33 -45.74 8.94 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.011 2.187 . . . . 0.0 112.949 166.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 39.8 t -65.29 -48.42 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 -176.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.14 -33.74 73.93 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 117.427 -3.296 . . . . 0.0 113.5 172.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 48.6 tp -61.53 -47.03 87.44 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 177.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.261 65.3 tp -66.96 -39.56 87.27 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.308 -3.37 . . . . 0.0 116.066 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -56.3 -44.8 80.24 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 120.423 -1.423 . . . . 0.0 110.079 173.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -71.87 -30.08 65.04 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . 0.299 . . -68.14 -42.33 80.29 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 113.475 -3.155 . . . . 0.0 114.938 168.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -70.27 -10.59 59.38 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 116.617 2.081 . . . . 0.0 116.617 170.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -84.35 -13.3 52.72 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.845 1.258 . . . . 0.0 112.865 168.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -121.63 6.79 9.99 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 122.513 1.149 . . . . 0.0 112.747 176.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.294 1.7 m-20 57.04 30.12 17.66 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 119.429 -2.045 . . . . 0.0 115.496 -176.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 50.4 mt -102.3 14.21 32.57 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 128.886 2.874 . . . . 0.0 110.127 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -64.93 -38.57 91.39 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 114.583 -2.627 . . . . 0.0 117.764 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.26 34.0 tp -67.59 -55.1 15.33 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 126.007 2.067 . . . . 0.0 109.569 -175.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.31 -14.45 22.91 Favored 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 123.794 2.996 . . . . 0.0 114.025 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 40.4 tp -73.93 -41.74 61.61 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 119.405 -2.059 . . . . 0.0 112.511 163.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 46.3 mt -75.9 -25.57 56.18 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.917 -1.992 . . . . 0.0 115.144 175.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -67.76 -41.26 83.61 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.855 1.262 . . . . 0.0 110.345 163.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 26.7 tp -62.3 -46.38 89.02 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 117.671 -3.143 . . . . 0.0 107.283 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 23.7 mmt -77.57 -17.22 58.08 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.602 -2.561 . . . . 0.0 116.975 -169.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 mt -134.01 138.12 45.19 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 118.634 -2.541 . . . . 0.0 108.059 -175.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 64.8 p -89.01 164.98 29.05 Favored Pre-proline 0 N--CA 1.45 -0.467 0 C-N-CA 127.58 2.352 . . . . 0.0 109.607 -171.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -60.66 -27.99 85.78 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 124.215 3.277 . . . . 0.0 117.311 -172.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -76.49 -25.8 54.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 119.67 -1.894 . . . . 0.0 112.052 173.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -92.5 -33.7 14.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 116.628 -3.795 . . . . 0.0 110.168 -169.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 mtm-85 -70.88 -40.96 71.94 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 115.354 -2.26 . . . . 0.0 111.808 176.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -67.27 -30.78 70.76 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 119.891 1.223 . . . . 0.0 111.335 170.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.85 -34.08 60.05 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 120.003 -1.686 . . . . 0.0 115.044 177.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 28.3 mt -62.7 -44.59 95.83 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 118.694 -2.504 . . . . 0.0 110.635 166.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -42.65 -52.43 5.44 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-N 122.295 2.316 . . . . 0.0 114.411 163.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 6.2 m -74.74 -37.86 62.4 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.503 -0.848 . . . . 0.0 111.262 -170.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -57.48 -35.94 70.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 113.11 -3.329 . . . . 0.0 113.597 168.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 62.5 t -65.7 -35.25 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 114.241 -2.984 . . . . 0.0 106.749 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 48.6 mtp180 -74.98 -22.37 58.59 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 116.973 -1.489 . . . . 0.0 114.788 177.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 31.6 mt -70.17 -47.59 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 119.789 1.177 . . . . 0.0 108.767 173.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.283 47.1 t -73.84 -25.26 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 118.099 -2.876 . . . . 0.0 109.362 -175.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -64.34 -49.45 71.65 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 115.496 1.665 . . . . 0.0 115.496 166.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -64.68 -33.9 77.03 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 127.435 2.959 . . . . 0.0 110.858 175.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 52.1 mt -63.01 -21.22 66.0 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 122.567 2.44 . . . . 0.0 116.74 169.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 39.0 mt -89.05 -38.74 14.15 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 116.9 -1.524 . . . . 0.0 112.173 167.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.281 26.2 ttm105 -55.02 -53.13 59.67 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 123.964 1.84 . . . . 0.0 112.879 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.61 45.91 33.91 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-O 114.666 -3.297 . . . . 0.0 116.034 -172.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -118.26 -44.95 2.66 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 121.107 2.453 . . . . 0.0 115.018 -173.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 50.7 mtt -70.34 148.36 48.55 Favored 'General case' 0 N--CA 1.447 -0.586 2 O-C-N 113.286 -5.884 . . . . 0.0 114.43 179.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 73.0 p -74.96 161.36 29.57 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 128.063 2.545 . . . . 0.0 115.452 158.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -55.02 -24.42 24.46 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.557 0.694 . . . . 0.0 112.119 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 67.0 ttt-85 -77.1 -39.59 48.97 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 127.553 2.341 . . . . 0.0 110.61 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -70.68 -45.44 65.05 Favored 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 127.229 2.831 . . . . 0.0 108.229 174.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 44.7 mt -49.72 -41.02 42.49 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 117.451 2.389 . . . . 0.0 117.451 173.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 17.7 tptp -62.32 -43.91 97.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.479 2.311 . . . . 0.0 116.491 171.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -114.95 -24.09 8.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 126.02 1.728 . . . . 0.0 113.104 -158.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -105.7 -13.89 15.42 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 125.121 1.368 . . . . 0.0 113.862 175.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 57.4 mt -137.62 -3.6 1.87 Allowed 'General case' 0 N--CA 1.446 -0.628 1 O-C-N 116.044 -4.16 . . . . 0.0 108.398 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 84.46 2.75 88.89 Favored Glycine 0 C--N 1.336 0.561 0 O-C-N 120.033 -1.667 . . . . 0.0 113.902 164.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.54 133.76 52.24 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.602 -3.293 . . . . 0.0 118.306 -172.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.59 177.6 39.09 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 127.978 2.704 . . . . 0.0 114.471 174.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 40.6 mm -70.19 -35.86 65.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 O-C-N 118.071 -3.017 . . . . 0.0 111.513 -161.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.35 -36.62 81.77 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 113.894 -2.955 . . . . 0.0 113.127 170.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 74.9 m -54.89 -54.3 44.27 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 127.898 3.249 . . . . 0.0 114.1 172.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 20.4 mm -79.62 -37.05 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 112.527 -2.124 . . . . 0.0 112.391 -170.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 18.6 m -55.4 -47.39 75.96 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 116.154 -1.879 . . . . 0.0 109.724 168.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -55.68 -53.67 53.64 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 123.13 2.695 . . . . 0.0 116.198 173.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -49.24 -31.68 12.65 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 116.042 1.177 . . . . 0.0 116.042 166.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 60.4 p -81.83 -36.31 28.44 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.377 -2.249 . . . . 0.0 114.026 173.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -62.49 -30.48 71.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 115.847 -2.025 . . . . 0.0 114.778 167.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 50.7 m -66.84 -32.04 73.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 122.2 2.273 . . . . 0.0 112.079 171.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 5.7 mt -73.82 -35.27 64.84 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 115.68 -2.105 . . . . 0.0 112.409 168.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -66.82 -36.19 81.79 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 121.011 1.732 . . . . 0.0 114.635 164.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.24 -28.26 67.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 118.086 -2.884 . . . . 0.0 108.4 175.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.76 145.82 97.32 Favored Pre-proline 0 N--CA 1.446 -0.647 0 CA-C-N 123.811 3.005 . . . . 0.0 111.306 -170.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -72.9 153.89 53.16 Favored 'Trans proline' 0 N--CA 1.449 -1.122 0 C-N-CA 124.397 3.398 . . . . 0.0 111.526 173.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 16.7 m -64.47 -19.07 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 O-C-N 118.434 -2.666 . . . . 0.0 116.192 -177.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -77.18 -16.07 59.25 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.356 1.462 . . . . 0.0 113.738 173.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 18.0 tp -90.85 -47.57 7.53 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 118.209 -2.807 . . . . 0.0 114.248 161.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.1 mtp85 -57.75 -48.06 80.71 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 116.2 -1.857 . . . . 0.0 114.404 -176.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -78.82 -12.07 60.01 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 127.088 2.743 . . . . 0.0 115.063 177.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -76.69 -45.0 31.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.563 1.145 . . . . 0.0 109.744 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 11.4 mt -62.08 -42.95 99.74 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 118.726 -2.484 . . . . 0.0 113.528 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -58.95 -31.53 68.8 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 115.689 -2.404 . . . . 0.0 115.257 -178.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -92.74 -27.38 17.26 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 128.521 2.728 . . . . 0.0 118.156 -171.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.39 -42.05 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 O-C-N 119.086 -2.259 . . . . 0.0 110.351 168.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 75.9 mt -77.49 -77.04 0.16 Allowed 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 123.574 0.546 . . . . 0.0 112.125 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 13.3 mt -77.35 -24.83 50.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.204 1.401 . . . . 0.0 110.77 -153.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -61.03 -22.46 64.58 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 123.641 2.928 . . . . 0.0 110.896 171.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 49.5 m -110.85 8.93 22.45 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 129.588 3.155 . . . . 0.0 115.305 -177.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 26.5 t70 . . . . . 0 C--O 1.25 1.095 0 N-CA-C 116.102 1.89 . . . . 0.0 116.102 178.413 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 19.8 ttt . . . . . 0 N--CA 1.471 0.604 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.53 159.13 25.21 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 122.451 1.12 . . . . 0.0 110.419 -173.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -152.82 155.3 36.85 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.453 2.301 . . . . 0.0 107.745 -167.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -154.32 111.42 3.38 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -164.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 81.5 p -101.02 159.03 30.64 Favored Pre-proline 0 N--CA 1.444 -0.736 0 O-C-N 118.992 -2.318 . . . . 0.0 109.042 -175.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -63.5 -28.93 70.75 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 CA-C-O 115.851 -1.812 . . . . 0.0 112.977 -167.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -153.67 142.63 21.19 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 127.827 3.205 . . . . 0.0 111.957 176.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 44.5 t -133.81 118.77 18.41 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 125.665 2.65 . . . . 0.0 107.092 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.79 -20.2 60.54 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.482 -2.011 . . . . 0.0 109.333 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.19 -26.91 32.94 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 121.752 2.069 . . . . 0.0 112.84 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 17.9 mtt -70.1 -31.94 69.74 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 121.104 3.742 . . . . 0.0 121.104 151.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.84 -40.25 83.68 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 126.147 1.779 . . . . 0.0 112.352 163.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -71.72 -37.7 70.59 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 116.369 -2.132 . . . . 0.0 112.898 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -63.15 -29.76 71.05 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.911 1.284 . . . . 0.0 112.033 173.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . 0.28 0.0 OUTLIER -66.15 -39.3 89.71 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 118.36 -2.713 . . . . 0.0 112.826 163.037 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -68.16 -38.49 82.16 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 115.417 -2.23 . . . . 0.0 113.375 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.255 31.5 mm-40 -67.53 -37.47 82.79 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 172.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -61.19 -40.51 94.21 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 115.734 -2.079 . . . . 0.0 113.697 169.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 24.8 t-105 -63.89 -46.09 86.41 Favored 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 129.713 4.383 . . . . 0.0 113.519 177.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.44 -30.98 70.92 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 113.022 -1.899 . . . . 0.0 109.795 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -67.93 -27.67 66.83 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 118.557 -2.589 . . . . 0.0 115.484 172.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -61.21 -41.91 97.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 119.887 -1.758 . . . . 0.0 114.889 156.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 83.6 t -70.59 -41.76 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 C-N-CA 128.474 2.71 . . . . 0.0 112.0 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.61 -44.83 89.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 117.84 -1.076 . . . . 0.0 113.884 169.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 34.1 tp -56.79 -48.85 76.99 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 120.376 1.444 . . . . 0.0 111.651 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 25.9 tp -63.98 -34.8 78.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.394 1.878 . . . . 0.0 111.668 176.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -60.76 -39.0 87.12 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 118.224 -2.798 . . . . 0.0 114.348 -178.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -76.85 -19.13 57.86 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 125.529 1.768 . . . . 0.0 115.272 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 -22.1 35.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.148 -2.22 . . . . 0.0 113.877 -172.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -56.83 -46.64 81.57 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 116.363 -3.96 . . . . 0.0 104.534 170.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -58.67 -35.62 72.86 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 117.041 -3.537 . . . . 0.0 112.065 -170.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -106.26 9.04 32.16 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 117.425 2.38 . . . . 0.0 117.425 174.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.41 7.7 m-20 49.47 39.41 16.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 119.094 -2.254 . . . . 0.0 113.095 177.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 33.9 mt -86.43 -0.35 55.81 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.669 2.388 . . . . 0.0 110.937 160.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -53.65 -51.04 64.39 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 121.19 1.814 . . . . 0.0 109.374 -169.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 mt -62.05 -52.88 64.33 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-O 115.856 -2.021 . . . . 0.0 114.676 174.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . 0.282 70.5 Cg_exo -43.36 -47.11 9.28 Favored 'Trans proline' 0 N--CA 1.45 -1.054 1 C-N-CA 127.458 5.438 . . . . 0.0 116.259 166.567 . . . . . . . . 3 2 . 1 . 012 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 tp -64.99 -37.4 87.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 116.987 2.217 . . . . 0.0 116.987 171.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.292 33.0 mt -77.43 -25.14 50.43 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 127.545 3.028 . . . . 0.0 110.921 177.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -59.31 -44.54 92.55 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 117.733 -1.127 . . . . 0.0 108.779 166.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 64.1 tp -75.71 -46.35 31.59 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.989 2.515 . . . . 0.0 111.506 -169.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 84.7 mmm -88.77 -14.77 36.32 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.912 -1.117 . . . . 0.0 113.187 -163.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mp -125.48 164.9 19.46 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 122.536 1.16 . . . . 0.0 109.092 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 69.7 p -97.22 169.37 8.74 Favored Pre-proline 0 N--CA 1.448 -0.564 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 175.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -54.51 -45.8 38.27 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.685 2.257 . . . . 0.0 113.668 174.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -42.92 97.19 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.542 1.937 . . . . 0.0 111.63 177.091 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -59.52 -32.18 70.07 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.417 1.487 . . . . 0.0 114.047 179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 95.9 mtm-85 -88.02 -34.93 17.84 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 127.665 2.386 . . . . 0.0 112.733 177.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -60.33 -41.18 93.01 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 117.092 2.256 . . . . 0.0 117.092 162.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.12 -53.92 15.01 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 119.425 -2.047 . . . . 0.0 115.303 169.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 26.3 mt -75.71 -32.66 60.16 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 126.371 2.295 . . . . 0.0 115.863 -174.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.9 -33.08 86.07 Favored Glycine 0 N--CA 1.448 -0.521 0 O-C-N 120.363 -1.46 . . . . 0.0 110.153 166.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 27.4 m -80.7 -47.26 14.26 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.85 0.825 . . . . 0.0 111.743 -178.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.304 89.0 mtt180 -53.39 -24.43 12.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 167.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 39.8 t -68.24 -38.87 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 O-C-N 117.078 -3.514 . . . . 0.0 113.157 169.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 33.9 mtp180 -81.53 -1.7 47.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 123.772 0.829 . . . . 0.0 109.001 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 79.9 mt -95.17 -52.05 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 O-C-N 119.678 -1.889 . . . . 0.0 108.495 170.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 37.4 t -46.64 -52.58 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 C-N-CA 128.282 2.633 . . . . 0.0 116.949 166.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -56.04 -47.46 77.81 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 122.25 1.024 . . . . 0.0 112.223 173.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -72.53 -18.62 61.63 Favored 'General case' 0 N--CA 1.452 -0.364 1 O-C-N 115.175 -4.703 . . . . 0.0 113.083 -171.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 60.3 mt -87.5 -31.76 19.79 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 118.384 -2.698 . . . . 0.0 108.313 173.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 24.3 mt -68.55 -10.81 58.14 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 118.507 -2.621 . . . . 0.0 114.358 160.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttm105 -104.32 -43.02 5.32 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 125.302 1.626 . . . . 0.0 113.084 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.11 2.16 60.89 Favored Glycine 0 C--N 1.336 0.583 0 O-C-N 119.238 -2.164 . . . . 0.0 112.497 158.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -89.26 -17.41 29.07 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 120.977 -1.308 . . . . 0.0 114.351 -166.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 10.7 mmt -56.08 125.89 23.57 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.409 1.483 . . . . 0.0 114.589 177.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . 0.285 55.4 p -78.14 166.64 22.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.932 2.02 . . . . 0.0 110.233 169.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -51.03 -29.88 13.89 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 116.555 2.057 . . . . 0.0 116.555 169.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 -65.74 -44.17 86.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 125.557 2.598 . . . . 0.0 107.788 172.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -75.56 -39.21 58.5 Favored 'General case' 0 N--CA 1.452 -0.336 1 O-C-N 116.027 -4.171 . . . . 0.0 111.572 -174.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 96.8 mt -56.76 -6.59 0.34 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 118.637 2.828 . . . . 0.0 118.637 166.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -112.1 -65.07 1.21 Allowed 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 125.551 1.782 . . . . 0.0 109.912 171.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -85.53 -9.73 56.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 112.96 -3.4 . . . . 0.0 115.892 -169.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -105.74 -45.81 4.3 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 128.71 2.804 . . . . 0.0 114.752 173.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 5.2 mp -86.51 -12.06 49.92 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 116.865 -1.54 . . . . 0.0 111.659 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 58.51 -133.56 52.68 Favored Glycine 0 C--N 1.338 0.641 0 CA-C-N 120.6 1.545 . . . . 0.0 110.848 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.72 -23.78 9.99 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 126.687 2.051 . . . . 0.0 110.756 -162.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.07 -13.19 6.41 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 127.404 2.43 . . . . 0.0 117.382 167.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 19.2 tt -58.3 -39.63 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 1 O-C-N 116.181 -4.129 . . . . 0.0 115.501 175.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.91 -56.13 11.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 116.919 -1.515 . . . . 0.0 111.975 168.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . 0.337 28.3 m -55.57 -37.98 68.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 125.977 2.048 . . . . 0.0 113.889 -179.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 6.5 mm -70.58 -23.54 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-O 115.105 -2.378 . . . . 0.0 115.509 170.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 52.9 p -122.51 -17.86 6.85 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 129.71 3.204 . . . . 0.0 114.925 -164.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 74.3 mtp85 -104.05 149.44 25.18 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.883 3.673 . . . . 0.0 112.283 171.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 98.28 153.45 28.66 Favored Glycine 0 C--N 1.337 0.6 0 CA-C-N 121.216 1.826 . . . . 0.0 109.498 -176.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 4.3 m -75.66 9.92 2.02 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 128.522 2.729 . . . . 0.0 117.045 176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -118.89 -2.64 10.83 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.684 1.593 . . . . 0.0 115.072 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 80.1 p -45.75 166.84 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.01 1.324 . . . . 0.0 114.43 172.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 42.7 tp -56.37 -35.76 68.05 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.618 2.451 . . . . 0.0 117.618 -164.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -90.15 -25.2 20.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 126.785 2.034 . . . . 0.0 113.033 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.94 -12.66 59.36 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 125.581 1.801 . . . . 0.0 111.801 174.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.24 161.23 5.56 Favored Pre-proline 0 N--CA 1.45 -0.457 0 C-N-CA 128.625 2.77 . . . . 0.0 113.701 174.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -68.76 143.78 57.14 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 125.08 3.853 . . . . 0.0 112.411 177.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 81.0 t -54.47 -39.73 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 124.921 1.288 . . . . 0.0 114.439 -173.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 15.6 pm0 -63.85 -33.94 76.8 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 112.511 -3.614 . . . . 0.0 113.523 173.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 32.7 tp -71.16 -43.95 66.48 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 127.558 3.036 . . . . 0.0 116.261 172.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -63.69 -39.5 94.48 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 115.488 -2.196 . . . . 0.0 110.231 -174.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -81.69 -32.75 31.59 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 116.532 -1.699 . . . . 0.0 110.635 172.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.3 t90 -67.17 -42.93 83.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 122.598 2.454 . . . . 0.0 112.645 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 22.6 mt -66.5 -16.69 64.33 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 123.604 2.911 . . . . 0.0 114.116 172.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -78.8 -18.89 53.36 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.133 1.773 . . . . 0.0 111.507 172.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -100.18 -41.98 6.88 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 120.173 -1.579 . . . . 0.0 108.963 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 48.9 t -72.12 -62.05 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.492 1 C-N-CA 131.822 4.049 . . . . 0.0 114.54 176.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . 0.26 38.9 mt -77.65 -18.03 57.13 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 124.414 3.279 . . . . 0.0 109.796 -171.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 90.4 mt -117.66 50.84 1.09 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 121.039 1.745 . . . . 0.0 114.817 -169.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.257 17.3 pttp . . . . . 0 N--CA 1.451 -0.424 0 O-C-N 127.605 3.066 . . . . 0.0 112.591 -157.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 78.0 p . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 122.572 1.177 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -57.86 -30.8 90.72 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 122.935 2.423 . . . . 0.0 113.12 -175.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -148.57 142.91 26.23 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 129.189 2.995 . . . . 0.0 106.914 164.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 26.6 t -76.46 128.26 34.44 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 125.743 2.687 . . . . 0.0 112.263 -173.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.74 -20.86 37.75 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 118.075 -2.891 . . . . 0.0 114.288 165.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -83.76 -33.09 25.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 120.737 -1.227 . . . . 0.0 112.797 172.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 16.6 mmt -66.68 -42.81 85.94 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 118.404 -2.685 . . . . 0.0 112.531 173.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.9 -39.48 62.77 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 169.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -65.15 -55.31 19.41 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.471 -2.018 . . . . 0.0 107.466 176.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -50.92 -44.56 60.19 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.918 2.087 . . . . 0.0 109.331 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . 0.401 HH21 ' CD ' ' D' ' 18' ' ' GLU . 0.0 OUTLIER -66.12 -11.25 47.8 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 124.425 3.284 . . . . 0.0 110.816 173.383 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -95.91 -19.28 19.67 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.974 -2.329 . . . . 0.0 108.754 168.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -86.36 -33.24 20.6 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.318 -3.364 . . . . 0.0 114.273 176.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . 0.401 ' CD ' HH21 ' D' ' 15' ' ' ARG . 95.9 mt-10 -67.29 -33.0 74.37 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 126.637 3.113 . . . . 0.0 111.908 173.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -62.99 -51.14 67.99 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 112.782 -2.008 . . . . 0.0 112.682 168.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.64 -16.97 62.87 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.116 -2.24 . . . . 0.0 111.717 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 49.2 ttt-85 -84.1 -6.46 59.41 Favored 'General case' 0 N--CA 1.449 -0.523 1 O-C-N 116.083 -4.135 . . . . 0.0 118.628 161.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -76.06 -41.28 51.13 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 119.28 -2.137 . . . . 0.0 113.207 149.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 99.3 t -66.42 -39.66 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 O-C-N 121.189 -0.945 . . . . 0.0 113.413 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -64.78 -39.63 93.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 124.652 2.168 . . . . 0.0 114.674 174.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 63.5 tp -67.38 -40.59 85.73 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 118.878 -2.389 . . . . 0.0 115.117 173.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 39.6 tp -74.14 -41.6 61.29 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.31 1.844 . . . . 0.0 110.293 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -51.79 -57.81 8.24 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 163.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -63.0 -31.74 72.94 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 117.465 -1.255 . . . . 0.0 110.728 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.82 -38.0 80.77 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 120.839 1.654 . . . . 0.0 114.726 167.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -72.62 -14.82 61.69 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 130.43 3.492 . . . . 0.0 109.958 170.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . 0.315 47.8 mt-30 -87.48 -14.9 39.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 118.697 -2.502 . . . . 0.0 109.554 176.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . 0.39 47.2 p30 -128.76 5.46 5.52 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 129.166 2.986 . . . . 0.0 115.911 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 62.66 25.49 15.15 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 124.439 2.066 . . . . 0.0 112.826 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 44.2 mt -88.37 -8.0 55.76 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.279 -2.763 . . . . 0.0 114.927 170.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -49.03 -57.56 6.35 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 127.967 2.507 . . . . 0.0 115.382 -173.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.321 3.1 mt -53.18 -52.87 61.83 Favored Pre-proline 0 N--CA 1.447 -0.582 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 177.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -62.63 -15.27 45.13 Favored 'Trans proline' 0 N--CA 1.446 -1.317 0 C-N-CA 122.322 2.015 . . . . 0.0 113.406 176.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 47.0 tp -77.46 -43.54 32.0 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 125.592 3.814 . . . . 0.0 111.386 164.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 25.2 mt -57.94 -45.09 87.17 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 125.413 3.733 . . . . 0.0 111.844 171.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -73.03 -23.32 60.58 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 119.572 -0.851 . . . . 0.0 111.831 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 19.2 tp -78.69 -27.6 45.07 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.347 -2.095 . . . . 0.0 111.059 170.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 13.2 mmt -89.24 -41.09 12.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 119.602 -1.936 . . . . 0.0 114.444 -174.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt -117.03 147.26 42.49 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 125.847 2.736 . . . . 0.0 112.798 -171.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 30.4 p -74.09 156.27 87.83 Favored Pre-proline 0 N--CA 1.45 -0.443 0 C-N-CA 128.721 2.808 . . . . 0.0 108.675 172.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -44.57 -44.01 13.94 Favored 'Trans proline' 0 N--CA 1.451 -1.024 1 C-N-CA 126.967 5.111 . . . . 0.0 122.168 173.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.265 18.9 m-20 -71.21 -22.44 62.01 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 120.376 3.473 . . . . 0.0 120.376 170.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -75.71 -36.54 59.97 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 126.143 2.152 . . . . 0.0 112.864 164.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 25.5 mtm180 -67.46 -43.7 80.44 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 126.205 2.191 . . . . 0.0 109.306 171.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -70.01 -35.84 74.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -170.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.28 -32.87 73.33 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 174.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 23.9 mt -77.79 -49.12 14.98 Favored 'General case' 0 N--CA 1.45 -0.451 1 O-C-N 115.388 -4.57 . . . . 0.0 114.113 -176.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -51.44 -37.25 39.84 Favored Glycine 0 C--N 1.335 0.507 0 CA-C-O 122.637 1.132 . . . . 0.0 113.906 164.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 86.9 m -72.33 -42.27 65.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 118.017 -3.049 . . . . 0.0 108.582 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -55.3 -23.15 21.87 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 121.579 3.918 . . . . 0.0 121.579 170.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 24.4 t -64.48 -33.5 63.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 172.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -89.02 -20.77 23.97 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 172.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 17.9 mt -54.19 -49.65 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 118.748 -2.47 . . . . 0.0 111.506 158.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . 0.495 ' CG2' HD11 ' D' ' 82' ' ' ILE . 65.0 t -68.24 -47.57 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 CA-C-O 117.028 -1.463 . . . . 0.0 109.63 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -51.12 -48.32 61.77 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 119.446 3.128 . . . . 0.0 119.446 170.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -65.42 -24.79 67.29 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.074 2.25 . . . . 0.0 117.074 172.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 59.3 mt -68.27 -13.44 62.26 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 121.859 2.118 . . . . 0.0 113.178 168.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 80.0 mt -104.6 -36.49 7.47 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 114.914 -2.47 . . . . 0.0 105.005 -177.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -81.4 -39.08 25.52 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.643 2.377 . . . . 0.0 113.083 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 53.01 41.67 59.92 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 120.168 2.827 . . . . 0.0 120.168 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -119.62 -1.91 10.55 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 117.806 -3.173 . . . . 0.0 116.231 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 8.5 mmt -129.86 39.51 3.69 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 128.702 2.801 . . . . 0.0 118.105 169.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 26.1 p -81.01 -179.95 7.58 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 110.235 -3.166 . . . . 0.0 117.532 -168.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . 0.515 ' O ' ' HE2' ' D' ' 72' ' ' LYS . 6.0 tp-100 63.05 -105.43 0.16 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 169.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -63.84 -43.01 97.45 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.331 1.452 . . . . 0.0 110.92 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -86.81 -16.09 37.26 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 116.876 2.176 . . . . 0.0 116.876 -171.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.42 -31.85 58.14 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.652 1.215 . . . . 0.0 109.664 176.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . 0.515 ' HE2' ' O ' ' D' ' 68' ' ' GLN 0.303 38.6 mtmt -72.09 -45.97 58.58 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 114.58 -1.191 . . . . 0.0 113.052 166.255 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -86.49 -25.81 24.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 124.299 2.0 . . . . 0.0 115.582 -163.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -122.39 -45.44 2.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 120.775 -1.203 . . . . 0.0 111.695 -171.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -69.46 -42.51 74.79 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.15 -2.844 . . . . 0.0 110.08 166.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.47 -167.22 18.86 Favored Glycine 0 C--N 1.339 0.742 0 CA-C-N 125.694 3.861 . . . . 0.0 122.273 155.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.71 -19.83 64.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.569 -1.548 . . . . 0.0 114.578 -164.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.45 -17.23 5.85 Favored Glycine 0 N--CA 1.446 -0.644 0 O-C-N 119.278 -2.139 . . . . 0.0 118.261 166.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 10.0 tt -52.5 -33.06 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 125.752 1.621 . . . . 0.0 108.032 -177.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -86.28 -12.48 49.39 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.736 2.414 . . . . 0.0 111.522 -173.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.3 m -79.75 -25.06 41.17 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 124.999 2.333 . . . . 0.0 114.004 165.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . 0.495 HD11 ' CG2' ' D' ' 58' ' ' VAL . 26.1 mm -100.11 -31.45 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 130.219 3.408 . . . . 0.0 115.215 -163.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 81.6 p -117.21 -2.73 11.58 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 126.348 2.28 . . . . 0.0 114.776 174.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.354 28.5 mtp85 -121.29 175.1 6.31 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 122.447 1.118 . . . . 0.0 112.872 167.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.99 160.96 27.67 Favored Glycine 0 N--CA 1.445 -0.706 0 O-C-N 118.054 -2.904 . . . . 0.0 114.165 -155.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 77.5 p -71.62 -42.01 68.17 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 118.759 -2.613 . . . . 0.0 112.968 -147.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -118.75 63.92 0.77 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.476 2.71 . . . . 0.0 106.652 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . 0.266 3.1 p -73.46 -175.46 1.97 Allowed 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 117.424 2.379 . . . . 0.0 117.424 173.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.27 5.5 tp -54.76 -32.95 60.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 113.187 -3.292 . . . . 0.0 111.446 162.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -72.44 -2.14 18.36 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.005 2.691 . . . . 0.0 114.03 174.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -124.28 -23.72 4.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 116.359 -1.781 . . . . 0.0 113.76 -171.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . 0.292 . . 63.3 94.37 0.05 OUTLIER Pre-proline 0 N--CA 1.447 -0.576 0 CA-C-N 121.671 2.032 . . . . 0.0 112.226 148.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . 0.446 ' C ' ' H ' ' D' ' 95' ' ' GLU 0.324 32.1 Cg_exo 33.81 32.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 129.216 0.923 . . . . 0.0 114.351 36.825 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 88.0 t -56.51 -17.74 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 C-N-CA 127.988 2.515 . . . . 0.0 110.022 176.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . 0.446 ' H ' ' C ' ' D' ' 93' ' ' PRO 0.285 0.1 OUTLIER -92.31 -49.36 6.2 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 117.984 -2.948 . . . . 0.0 112.899 -173.739 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 54.2 tp -38.38 -53.16 1.53 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 128.138 3.399 . . . . 0.0 109.531 150.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 31.7 ttp180 -65.87 -50.99 62.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 122.977 1.37 . . . . 0.0 111.856 -167.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.99 -28.05 15.55 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.137 -1.392 . . . . 0.0 113.726 170.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 45.6 t90 -85.61 -43.51 13.41 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -177.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.52 -38.86 69.79 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 125.614 1.821 . . . . 0.0 108.974 166.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -72.67 -14.82 61.67 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.873 1.321 . . . . 0.0 112.826 -177.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -94.2 -46.05 7.25 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.983 -2.323 . . . . 0.0 111.724 169.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 97.7 t -68.0 -27.92 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 O-C-N 119.345 -2.097 . . . . 0.0 113.869 177.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 82.6 mt -108.78 -18.87 13.6 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 122.055 2.207 . . . . 0.0 114.369 -171.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 4.6 mp -105.96 23.81 13.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.094 -2.879 . . . . 0.0 108.506 168.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 16.8 pttp -61.19 169.13 2.23 Favored 'General case' 0 N--CA 1.448 -0.534 1 C-N-CA 132.419 4.288 . . . . 0.0 113.342 -172.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 45.5 m -49.73 -45.56 49.4 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 110.654 -2.975 . . . . 0.0 114.557 -170.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 113.362 -3.208 . . . . 0.0 116.089 177.354 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . 0.253 16.5 tpt . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -27.93 65.11 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 111.933 -3.889 . . . . 0.0 112.391 166.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -73.64 -38.75 64.91 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 126.517 2.386 . . . . 0.0 111.116 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -59.98 -42.14 93.52 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 127.163 2.79 . . . . 0.0 111.147 171.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -68.65 -34.39 75.64 Favored 'General case' 0 N--CA 1.448 -0.555 1 O-C-N 115.75 -4.344 . . . . 0.0 114.096 170.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.6 t60 -64.86 -32.58 74.35 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 121.993 2.179 . . . . 0.0 114.6 171.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -67.36 -35.72 79.93 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 174.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -75.28 -30.08 60.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.262 -2.149 . . . . 0.0 109.104 -175.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -76.45 -40.52 50.27 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 119.707 1.139 . . . . 0.0 111.096 172.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 51.3 mt -71.96 -15.81 62.08 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.476 -1.39 . . . . 0.0 109.68 -171.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.2 ttt180 -54.03 -57.39 11.23 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 120.162 -1.586 . . . . 0.0 113.582 167.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.456 ' CE1' HD22 ' A' ' 26' ' ' LEU . 77.5 t80 -49.89 -35.15 22.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 120.41 1.459 . . . . 0.0 114.427 168.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.0 t -67.42 -51.83 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 121.225 -0.922 . . . . 0.0 112.533 -175.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -71.46 -23.72 61.88 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 125.435 2.541 . . . . 0.0 110.787 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.0 tp -75.13 -43.58 51.83 Favored 'General case' 0 N--CA 1.451 -0.41 1 O-C-N 114.244 -5.285 . . . . 0.0 108.307 173.28 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.456 HD22 ' CE1' ' A' ' 22' ' ' PHE . 20.9 tp -64.66 -31.03 72.07 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 116.639 -1.648 . . . . 0.0 110.103 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -57.01 -58.07 9.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 127.599 3.062 . . . . 0.0 109.13 173.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -60.57 -37.79 82.45 Favored 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 117.496 -3.253 . . . . 0.0 108.432 175.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.87 -41.31 83.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.716 -3.115 . . . . 0.0 113.569 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.486 ' CE1' ' HB2' ' B' ' 27' ' ' LYS . 16.9 m-85 -61.44 -35.99 79.13 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 124.708 3.413 . . . . 0.0 112.186 172.034 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.316 84.6 mt-30 -62.78 -16.65 58.93 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 119.448 -2.033 . . . . 0.0 115.139 173.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -124.38 18.84 8.95 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 127.627 2.371 . . . . 0.0 116.52 -176.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 41.32 33.24 0.25 Allowed 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 -165.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.1 mt -91.11 -5.8 54.6 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.577 2.751 . . . . 0.0 114.005 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -68.54 -41.42 79.86 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 113.405 -3.188 . . . . 0.0 113.923 -167.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.28 39.9 mt -61.9 -50.77 79.65 Favored Pre-proline 0 N--CA 1.448 -0.542 0 O-C-N 126.3 2.25 . . . . 0.0 112.593 165.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . 0.261 84.8 Cg_exo -51.25 -39.73 61.91 Favored 'Trans proline' 0 N--CA 1.451 -1.004 1 C-N-CA 127.94 5.76 . . . . 0.0 113.256 174.811 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.4 tp -81.39 -36.23 29.79 Favored 'General case' 0 N--CA 1.449 -0.522 1 O-C-N 115.153 -4.717 . . . . 0.0 111.643 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.9 mt -74.5 -30.54 61.85 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 126.14 1.776 . . . . 0.0 115.517 -177.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -66.75 -30.05 70.17 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 125.972 2.045 . . . . 0.0 113.625 163.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tt -69.72 -48.15 60.59 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 127.614 2.366 . . . . 0.0 111.019 173.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 80.4 mmm -91.44 -11.42 37.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.124 -2.86 . . . . 0.0 115.243 -162.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.8 mt -130.34 136.62 49.3 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 128.04 2.536 . . . . 0.0 110.714 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.2 p -94.49 157.97 36.36 Favored Pre-proline 0 N--CA 1.448 -0.555 0 O-C-N 119.154 -2.216 . . . . 0.0 112.393 176.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -47.89 -39.79 32.12 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.566 2.177 . . . . 0.0 116.135 -169.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . 0.288 5.3 p-10 -72.77 -18.89 61.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 129.121 2.968 . . . . 0.0 112.528 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -97.01 -32.53 11.95 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.884 1.274 . . . . 0.0 108.356 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.2 mtm-85 -69.54 -44.37 71.1 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 119.919 -1.738 . . . . 0.0 112.763 173.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -68.82 -14.56 63.1 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 112.043 -3.837 . . . . 0.0 112.158 166.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.45 -46.99 62.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 123.553 2.888 . . . . 0.0 113.035 164.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.06 -42.2 73.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 118.834 -2.416 . . . . 0.0 110.551 -173.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.26 -42.58 82.89 Favored Glycine 0 C--N 1.333 0.405 0 O-C-N 117.113 -3.492 . . . . 0.0 114.484 167.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.5 m -68.82 -33.15 73.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 124.064 1.887 . . . . 0.0 112.861 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.21 -24.12 67.04 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 116.746 2.128 . . . . 0.0 116.746 178.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.332 5.0 t -61.99 -39.6 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-O 117.171 -1.395 . . . . 0.0 108.138 172.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -70.53 -31.79 69.0 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 121.257 1.844 . . . . 0.0 113.687 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 95.3 mt -64.14 -48.92 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 117.126 -1.416 . . . . 0.0 107.895 176.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.1 t -61.89 -41.56 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-O 115.776 -2.059 . . . . 0.0 112.637 170.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -58.4 -53.2 61.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 123.372 2.806 . . . . 0.0 112.023 174.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -67.15 -26.4 66.65 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.316 76.6 mt -81.93 -35.87 28.66 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.101 2.96 . . . . 0.0 112.151 173.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 tp -72.12 -45.75 59.33 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 114.418 -2.706 . . . . 0.0 113.292 171.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -53.24 -55.66 22.69 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 120.61 1.55 . . . . 0.0 110.375 163.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.81 -0.8 89.39 Favored Glycine 0 C--N 1.333 0.391 0 CA-C-O 116.561 -2.244 . . . . 0.0 114.503 171.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -75.39 -4.92 42.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 120.437 3.495 . . . . 0.0 120.437 -176.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 94.6 mtp -106.2 155.83 19.07 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 129.252 3.021 . . . . 0.0 113.901 167.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 60.4 p -83.63 156.67 22.58 Favored 'General case' 0 N--CA 1.447 -0.615 0 O-C-N 124.476 1.11 . . . . 0.0 112.647 164.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -42.82 -39.8 2.64 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 120.573 -1.33 . . . . 0.0 111.429 166.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.8 tpt85 -79.77 -23.49 42.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 115.656 -2.116 . . . . 0.0 110.96 -175.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -76.12 -31.93 58.91 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 121.954 2.161 . . . . 0.0 112.99 168.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.8 mt -68.14 -31.39 70.94 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 124.39 2.043 . . . . 0.0 114.863 175.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -50.94 -54.39 24.66 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 117.55 -3.219 . . . . 0.0 108.83 174.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -59.2 -38.04 78.91 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.923 1.082 . . . . 0.0 113.923 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -70.56 -32.6 70.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 119.448 -2.033 . . . . 0.0 110.307 -177.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 74.3 mt -119.44 -26.45 5.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -156.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 81.77 -28.29 3.21 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 120.469 2.948 . . . . 0.0 120.469 174.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.6 163.83 25.89 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 120.226 -1.749 . . . . 0.0 110.058 -173.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.28 140.85 34.59 Favored Glycine 0 C--N 1.339 0.702 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -177.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.346 89.1 mt -53.07 -27.38 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-O 116.104 -1.903 . . . . 0.0 111.757 -178.237 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.42 -36.15 53.7 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 120.163 1.347 . . . . 0.0 111.064 175.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 56.5 p -80.9 -23.88 38.66 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 119.614 -1.929 . . . . 0.0 110.922 -173.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 50.0 mm -78.81 -42.5 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 C-N-CA 127.529 2.332 . . . . 0.0 108.999 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.4 m -67.89 -33.95 75.71 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.837 1.255 . . . . 0.0 108.477 177.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.1 ttt180 -61.55 -46.65 89.0 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 121.796 -0.565 . . . . 0.0 110.762 172.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.28 -26.82 74.27 Favored Glycine 0 C--N 1.334 0.426 0 CA-C-O 117.065 -1.964 . . . . 0.0 113.487 175.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 58.1 m -63.54 -40.29 96.62 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.261 1.825 . . . . 0.0 110.789 174.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -68.88 -43.86 74.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 116.988 -1.482 . . . . 0.0 113.96 169.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.0 m -63.26 -25.87 68.52 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 127.21 2.204 . . . . 0.0 106.666 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.0 tp -85.44 -32.35 22.35 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 117.117 -3.489 . . . . 0.0 115.901 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -78.28 -38.0 43.61 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.875 2.07 . . . . 0.0 109.069 -173.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.56 -13.03 60.34 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 129.743 3.217 . . . . 0.0 116.132 167.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.82 126.72 92.25 Favored Pre-proline 0 N--CA 1.449 -0.48 0 C-N-CA 131.088 3.755 . . . . 0.0 107.771 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -59.93 152.48 64.12 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 O-C-N 128.209 3.742 . . . . 0.0 115.298 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -34.88 67.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 CA-C-O 116.395 -1.764 . . . . 0.0 111.086 -173.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.6 pm0 -71.83 -18.07 62.1 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 122.174 2.261 . . . . 0.0 111.896 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 13.6 tp -85.52 -36.35 20.56 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 58.2 mtm-85 -82.41 -35.06 28.0 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 117.545 -3.222 . . . . 0.0 115.934 -171.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -69.58 -6.06 28.59 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.095 1.758 . . . . 0.0 114.148 165.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 40.3 t90 -98.97 -48.34 4.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 117.996 2.591 . . . . 0.0 117.996 166.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.0 mt -61.59 -32.7 72.82 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 120.015 -1.678 . . . . 0.0 111.589 177.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.93 -22.63 65.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 122.608 2.458 . . . . 0.0 115.992 172.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -93.9 -7.7 42.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 118.799 -2.438 . . . . 0.0 113.381 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 54.1 t -118.95 -25.36 2.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 127.456 2.972 . . . . 0.0 113.905 -175.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 68.5 mt -103.57 -39.34 6.76 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 118.587 -2.571 . . . . 0.0 116.308 167.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.2 mt -88.57 -33.61 17.64 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 119.84 -1.787 . . . . 0.0 115.318 -175.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.3 tttt . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 117.448 -1.263 . . . . 0.0 113.73 -166.303 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.307 . . . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 16.5 mmt -74.85 -28.22 60.58 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -174.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.19 75.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 168.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.8 -39.52 66.62 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.787 2.835 . . . . 0.0 114.537 165.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 8.9 tp60 -57.47 -44.03 84.52 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 119.938 -1.726 . . . . 0.0 112.313 171.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 51.7 mmt-85 -74.42 -29.0 61.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 120.926 1.694 . . . . 0.0 112.336 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -75.27 -39.64 59.57 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 117.991 -2.943 . . . . 0.0 113.943 170.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -64.72 -38.81 92.27 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 129.216 3.006 . . . . 0.0 109.384 169.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -70.19 -36.67 74.78 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 119.108 -2.245 . . . . 0.0 111.591 178.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -63.65 -50.15 70.42 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 116.567 -1.683 . . . . 0.0 109.105 170.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 82.6 mt -64.66 -14.2 57.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 122.131 2.241 . . . . 0.0 113.525 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -56.41 -54.17 48.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 128.56 2.744 . . . . 0.0 108.33 171.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -65.39 -52.24 54.91 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.528 0.731 . . . . 0.0 111.692 -178.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . 0.256 4.2 t -44.19 -48.98 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 126.221 1.808 . . . . 0.0 111.642 178.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -73.44 -41.8 62.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 128.448 3.592 . . . . 0.0 109.282 -171.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 33.8 tp -64.53 -43.7 93.17 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.37 176.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 41.1 tp -65.02 -32.88 74.82 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 120.694 -1.254 . . . . 0.0 114.008 171.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . 0.486 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 57.7 tttt -64.14 -41.48 97.18 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.486 -2.009 . . . . 0.0 112.43 171.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -58.35 -39.15 78.75 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 123.015 2.643 . . . . 0.0 112.811 166.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.8 -33.4 62.22 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.539 -1.35 . . . . 0.0 113.281 -176.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -54.75 -47.7 73.54 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.94 2.096 . . . . 0.0 112.732 169.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -70.77 -6.31 36.65 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.286 1.834 . . . . 0.0 114.426 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -119.86 23.64 10.97 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.556 1.942 . . . . 0.0 113.004 170.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 34.79 48.18 0.3 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 128.372 2.669 . . . . 0.0 110.277 -173.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 33.9 mt -121.63 16.61 11.16 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.445 -1.252 . . . . 0.0 113.098 174.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -71.8 -37.95 70.31 Favored 'General case' 0 N--CA 1.452 -0.357 1 O-C-N 115.444 -4.535 . . . . 0.0 111.144 -176.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 43.0 tp -62.13 -55.75 37.71 Favored Pre-proline 0 N--CA 1.449 -0.518 0 CA-C-O 114.587 -2.625 . . . . 0.0 111.454 177.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -65.23 -20.52 62.51 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 CA-C-N 122.707 2.002 . . . . 0.0 111.696 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 27.7 tp -79.1 -32.85 44.76 Favored 'General case' 0 N--CA 1.451 -0.417 1 CA-C-O 111.56 -4.067 . . . . 0.0 113.047 172.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 59.1 mt -71.08 -32.87 69.64 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 125.603 1.814 . . . . 0.0 107.756 173.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -80.31 -10.2 59.75 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 117.38 2.363 . . . . 0.0 117.38 176.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.3 tp -91.58 -33.42 15.14 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 118.097 -2.877 . . . . 0.0 111.31 160.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 16.2 mmt -85.0 -18.18 35.24 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 128.548 3.655 . . . . 0.0 116.226 -175.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 6.2 mp -126.97 147.77 50.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.21 1.804 . . . . 0.0 112.312 176.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 18.5 p -75.82 165.52 52.63 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-O 112.305 -3.712 . . . . 0.0 116.44 176.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -58.65 -14.57 22.07 Favored 'Trans proline' 0 N--CA 1.45 -1.042 0 O-C-N 126.371 2.774 . . . . 0.0 116.385 174.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -90.19 -46.37 8.48 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 126.195 1.798 . . . . 0.0 113.218 175.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -67.43 -26.59 66.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 117.115 -1.421 . . . . 0.0 114.448 -178.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -60.12 -42.55 94.99 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 125.656 1.848 . . . . 0.0 110.81 172.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -65.35 -27.75 68.8 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 112.141 -2.3 . . . . 0.0 116.148 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.5 -45.97 12.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 118.256 -2.778 . . . . 0.0 110.748 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.99 -34.22 77.28 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.511 -1.993 . . . . 0.0 110.176 -179.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.79 -23.78 72.59 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 118.361 2.104 . . . . 0.0 118.361 170.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 74.7 m -87.9 -25.6 23.16 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.799 2.04 . . . . 0.0 112.803 174.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 42.4 mtt180 -64.5 -24.99 67.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 117.711 2.485 . . . . 0.0 117.711 161.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.02 -41.97 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 120.179 1.354 . . . . 0.0 107.671 175.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 -59.61 -43.84 93.64 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 112.897 -3.43 . . . . 0.0 110.502 176.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 56.5 mt -61.57 -47.76 91.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 123.116 2.689 . . . . 0.0 107.129 -177.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.298 69.2 t -62.18 -33.31 58.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 120.156 1.344 . . . . 0.0 111.766 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -69.45 -43.23 73.7 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 118.654 -2.529 . . . . 0.0 113.176 173.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -72.4 -36.82 68.74 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 119.417 -2.052 . . . . 0.0 114.118 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 12.7 mt -52.18 -28.06 16.79 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.352 0.596 . . . . 0.0 112.568 165.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 23.4 mt -92.18 -21.94 20.1 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 117.831 -3.043 . . . . 0.0 118.381 174.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . 0.497 HH21 ' CG ' ' B' ' 108' ' ' ASP . 5.1 ttm105 -88.89 -43.58 11.08 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.833 2.053 . . . . 0.0 105.516 -166.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.99 49.95 31.74 Favored Glycine 0 CA--C 1.524 0.632 0 CA-C-O 117.422 -1.765 . . . . 0.0 116.294 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -116.75 -36.13 3.98 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 119.811 1.805 . . . . 0.0 108.746 -177.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 27.0 mtt -73.33 139.56 46.13 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 126.357 2.98 . . . . 0.0 111.43 -175.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -81.79 170.65 15.46 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 118.973 -2.329 . . . . 0.0 109.438 163.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -59.97 -17.43 38.1 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 117.135 -3.478 . . . . 0.0 110.446 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 48.1 ttt-85 -82.04 -48.39 11.47 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.676 2.39 . . . . 0.0 106.94 -173.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -71.24 -49.28 44.94 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 114.157 -2.83 . . . . 0.0 112.162 178.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 83.0 mt -47.66 -43.27 26.1 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 121.296 1.862 . . . . 0.0 109.279 173.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -61.14 -20.11 62.31 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 119.271 -2.143 . . . . 0.0 113.229 178.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -118.21 -54.22 2.31 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 124.907 3.503 . . . . 0.0 116.785 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.03 -24.56 64.61 Favored 'General case' 0 N--CA 1.446 -0.653 1 C-N-CA 132.142 4.177 . . . . 0.0 113.371 -177.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 60.0 mt -131.28 -3.96 3.86 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 113.274 -1.784 . . . . 0.0 113.258 172.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.9 21.28 67.45 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 126.558 2.028 . . . . 0.0 116.603 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.55 110.85 22.43 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 118.608 -2.701 . . . . 0.0 108.959 -163.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.19 176.53 48.7 Favored Glycine 0 CA--C 1.523 0.565 0 O-C-N 118.811 -2.431 . . . . 0.0 117.289 168.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 14.4 mm -53.51 -48.32 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.725 0 CA-C-O 117.751 -1.118 . . . . 0.0 111.869 -166.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.82 -33.98 69.18 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 122.059 2.209 . . . . 0.0 112.977 -177.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 54.1 m -75.93 -48.52 20.9 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.38 3.072 . . . . 0.0 111.213 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 18.9 mm -53.96 -35.94 29.65 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 O-C-N 118.366 -2.709 . . . . 0.0 108.385 167.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 5.3 m -75.64 -27.61 58.46 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 117.17 -1.395 . . . . 0.0 112.917 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -63.69 -48.89 75.31 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 122.7 2.5 . . . . 0.0 110.321 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -76.94 -32.07 50.89 Favored Glycine 0 CA--C 1.525 0.682 0 CA-C-O 118.132 -1.371 . . . . 0.0 112.701 -167.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 89.1 p -68.46 -40.58 81.01 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -61.45 -41.46 97.24 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 118.826 -2.421 . . . . 0.0 110.185 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.6 m -77.94 -24.69 48.12 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 112.391 -3.671 . . . . 0.0 110.127 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.57 -36.66 44.22 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 127.113 2.758 . . . . 0.0 116.917 170.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -60.71 -45.44 94.22 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 125.26 2.457 . . . . 0.0 111.46 169.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . 0.31 . . -71.2 -17.21 62.53 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 118.222 -2.799 . . . . 0.0 117.62 173.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.56 160.17 83.49 Favored Pre-proline 0 N--CA 1.45 -0.451 0 O-C-N 119.906 -1.746 . . . . 0.0 112.548 172.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -67.32 155.75 69.17 Favored 'Trans proline' 0 N--CA 1.447 -1.222 1 C-N-CA 127.942 5.761 . . . . 0.0 118.436 175.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.277 12.9 m -65.81 -36.3 77.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 119.262 0.937 . . . . 0.0 113.452 -177.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.332 7.8 pm0 -59.57 -27.75 66.52 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 -177.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 24.7 tp -83.16 -46.6 12.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.569 1.548 . . . . 0.0 109.41 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 64.8 mtp85 -57.47 -27.3 62.37 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 175.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -99.32 -8.75 24.47 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 174.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -75.01 -62.59 1.5 Allowed 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 127.968 2.507 . . . . 0.0 105.78 168.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 83.2 mt -57.77 -31.74 66.81 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 131.391 3.876 . . . . 0.0 109.029 -169.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -69.62 -43.13 73.34 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 124.267 3.212 . . . . 0.0 111.326 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -71.85 -48.15 48.08 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 124.871 2.272 . . . . 0.0 108.565 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 65.2 t -60.31 -50.03 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 113.481 -1.691 . . . . 0.0 111.455 -170.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 13.5 mt -76.16 -54.56 6.63 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 127.862 3.696 . . . . 0.0 115.399 176.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 60.6 mt -76.6 -36.6 57.42 Favored 'General case' 0 N--CA 1.45 -0.44 1 O-C-N 114.431 -5.168 . . . . 0.0 116.907 -165.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -80.19 -5.88 56.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 112.518 -3.611 . . . . 0.0 108.408 177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 70.6 m -105.73 -10.25 16.85 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 128.398 2.679 . . . . 0.0 109.701 -178.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . 0.497 ' CG ' HH21 ' B' ' 63' ' ' ARG . 9.8 t70 . . . . . 0 C--O 1.25 1.11 0 C-N-CA 129.834 3.253 . . . . 0.0 115.346 -173.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 15.7 mtt . . . . . 0 N--CA 1.472 0.639 0 CA-C-O 123.816 1.769 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.42 147.4 30.99 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 112.587 -2.097 . . . . 0.0 114.747 -178.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -140.67 156.91 46.11 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.854 2.461 . . . . 0.0 113.204 165.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -122.21 164.8 17.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.995 1.718 . . . . 0.0 108.885 175.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 42.9 p -127.99 153.97 78.38 Favored Pre-proline 0 N--CA 1.451 -0.398 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.94 -38.21 93.07 Favored 'Trans proline' 0 N--CA 1.447 -1.261 0 O-C-N 125.69 2.416 . . . . 0.0 116.976 172.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -149.82 148.59 29.36 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 124.72 2.2 . . . . 0.0 110.605 175.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.1 t -145.46 133.79 21.78 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.286 -2.759 . . . . 0.0 114.556 170.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.64 -26.43 59.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 112.95 -3.405 . . . . 0.0 107.806 175.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.33 -34.63 78.77 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 125.853 3.933 . . . . 0.0 110.044 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 18.4 mtt -82.32 -34.48 28.55 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 125.338 1.649 . . . . 0.0 114.84 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.62 -38.82 82.36 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 125.576 1.551 . . . . 0.0 114.337 164.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -67.29 -33.13 74.65 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.619 1.568 . . . . 0.0 112.659 167.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -59.08 -40.98 86.93 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 119.206 -2.184 . . . . 0.0 111.46 167.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -21.52 65.1 Favored 'General case' 0 N--CA 1.449 -0.506 1 O-C-N 114.635 -5.041 . . . . 0.0 117.792 169.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -76.82 -46.56 24.4 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 120.888 -1.132 . . . . 0.0 113.205 177.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -53.92 -23.15 11.91 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 119.191 3.034 . . . . 0.0 119.191 159.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -81.75 -45.13 16.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 127.329 2.251 . . . . 0.0 106.375 171.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 23.8 t-105 -66.9 -37.11 83.75 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 118.072 -2.893 . . . . 0.0 112.406 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mp -73.03 -27.6 61.86 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 127.11 2.756 . . . . 0.0 111.281 -176.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 27.1 ttt180 -75.38 -35.23 61.12 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 119.33 -2.106 . . . . 0.0 113.151 172.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -61.06 -42.38 98.38 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 169.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.368 76.0 t -54.81 -61.99 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 CA-C-O 117.097 -1.43 . . . . 0.0 108.921 167.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -53.24 -43.35 67.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 117.834 2.531 . . . . 0.0 117.834 178.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 60.9 tp -45.17 -55.07 6.11 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 127.721 2.408 . . . . 0.0 112.268 176.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 25.6 tp -67.25 -27.01 66.86 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 119.641 -1.912 . . . . 0.0 114.825 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -56.43 -50.56 71.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 119.398 -2.064 . . . . 0.0 110.302 166.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -68.65 -8.73 44.94 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 119.821 -1.799 . . . . 0.0 112.086 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.17 -20.77 17.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 -178.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -76.0 -22.89 55.34 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-O 125.796 2.712 . . . . 0.0 115.123 164.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . 0.305 45.7 tt0 -62.07 -16.37 51.66 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 129.598 3.159 . . . . 0.0 116.582 169.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -147.24 6.01 0.85 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.263 3.6 m-20 59.16 29.98 19.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 118.228 2.677 . . . . 0.0 118.228 -173.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 96.9 mt -82.31 7.52 13.72 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 118.679 -2.513 . . . . 0.0 114.536 162.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 7.0 p-80 -59.33 -44.99 92.56 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 119.121 3.008 . . . . 0.0 119.121 173.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.323 6.5 mt -60.25 -55.44 45.29 Favored Pre-proline 0 N--CA 1.452 -0.352 0 O-C-N 125.085 1.491 . . . . 0.0 110.312 175.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -54.35 -50.62 12.86 Favored 'Trans proline' 0 N--CA 1.445 -1.329 0 C-N-CA 123.488 2.792 . . . . 0.0 113.12 174.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 56.6 tp -55.4 -30.53 60.58 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 173.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.387 15.3 mt -94.92 -18.48 21.08 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 122.496 2.407 . . . . 0.0 114.187 177.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -67.24 -26.18 66.46 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.596 -1.192 . . . . 0.0 111.635 161.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 19.9 tp -77.5 -52.54 8.9 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.638 2.375 . . . . 0.0 114.708 170.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 49.2 mmm -78.72 -15.8 58.01 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 117.117 -1.421 . . . . 0.0 113.752 -164.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 7.8 mp -121.29 144.45 48.62 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 130.669 3.588 . . . . 0.0 113.523 -175.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 55.7 p -75.42 157.13 84.94 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-N 122.26 2.3 . . . . 0.0 113.356 164.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -57.88 -34.1 97.88 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 CA-C-N 121.52 1.578 . . . . 0.0 110.872 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.74 -41.18 94.84 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.868 172.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -67.83 -31.49 71.38 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.652 1.181 . . . . 0.0 112.309 176.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . 0.435 ' HD2' ' CE2' ' D' ' 19' ' ' TRP . 85.8 mtm-85 -69.75 -44.08 70.94 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.067 2.147 . . . . 0.0 110.888 175.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . 0.254 40.5 tt0 -68.89 -22.65 64.17 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 127.967 2.507 . . . . 0.0 114.34 168.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.51 -28.76 64.13 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 121.62 2.009 . . . . 0.0 110.704 173.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 57.2 mt -74.75 -46.11 39.47 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 118.424 2.75 . . . . 0.0 118.424 177.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.49 -43.8 36.26 Favored Glycine 0 CA--C 1.526 0.766 0 O-C-N 126.482 2.364 . . . . 0.0 110.532 169.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 99.6 m -59.59 -55.92 28.45 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.576 1.95 . . . . 0.0 109.958 178.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -57.69 -42.03 82.86 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 115.5 -2.19 . . . . 0.0 113.504 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 50.2 t -58.59 -36.02 57.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 CA-C-N 124.464 3.302 . . . . 0.0 114.671 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -80.82 -30.91 35.73 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 113.536 -1.666 . . . . 0.0 110.788 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . 0.325 7.9 mt -60.16 -51.67 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 1 O-C-N 115.6 -4.438 . . . . 0.0 110.755 165.039 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . 0.267 62.5 t -49.08 -55.81 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 C-N-CA 125.488 1.515 . . . . 0.0 113.484 174.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -49.05 -45.71 43.31 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.338 1.855 . . . . 0.0 114.672 174.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . 0.265 29.9 mm-40 -78.83 -11.01 59.98 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 123.179 1.466 . . . . 0.0 114.882 -174.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 46.2 mt -101.53 -4.5 26.63 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 115.21 -2.329 . . . . 0.0 108.847 168.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.53 -39.95 11.08 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 114.362 -2.732 . . . . 0.0 113.222 166.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 7.9 ttm105 -67.38 -31.62 71.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 126.139 2.15 . . . . 0.0 113.664 167.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.84 17.23 73.12 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-N 113.71 -1.587 . . . . 0.0 116.746 171.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -97.94 -2.02 41.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 121.644 2.722 . . . . 0.0 112.03 -160.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 19.1 mmt -79.38 136.7 37.05 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 124.851 1.344 . . . . 0.0 108.547 -177.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 65.7 p -90.33 174.8 7.38 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 129.274 3.029 . . . . 0.0 113.001 166.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -57.93 -40.49 80.56 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -173.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 39.0 ttp-105 -57.17 -46.25 82.97 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 126.155 1.782 . . . . 0.0 109.417 173.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -80.42 -22.29 41.34 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 119.724 -1.86 . . . . 0.0 111.279 -170.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 16.3 mt -73.25 -21.14 60.69 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.038 -2.914 . . . . 0.0 110.799 172.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -89.06 -54.64 4.02 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.894 -2.379 . . . . 0.0 112.382 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -72.55 -49.04 35.32 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 125.191 1.557 . . . . 0.0 111.835 -172.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -73.31 -38.87 65.69 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 115.909 -1.996 . . . . 0.0 115.993 177.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 8.0 mp -97.0 -30.86 12.83 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 120.77 3.618 . . . . 0.0 120.77 -171.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.18 -160.37 31.38 Favored Glycine 0 C--N 1.337 0.608 0 CA-C-O 124.021 1.901 . . . . 0.0 114.844 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.84 -21.58 59.18 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 116.998 2.221 . . . . 0.0 116.998 -175.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.53 -12.71 9.83 Favored Glycine 0 CA--C 1.522 0.531 0 C-N-CA 128.858 3.123 . . . . 0.0 117.204 173.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 16.8 tt -54.11 -38.09 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 161.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.86 -46.35 89.58 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 113.915 -2.945 . . . . 0.0 110.858 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 40.6 m -50.68 -32.54 19.57 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 129.603 3.161 . . . . 0.0 115.669 166.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.298 52.0 mm -89.18 -10.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 119.441 -2.037 . . . . 0.0 114.073 177.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 39.8 p -136.67 5.1 2.87 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 118.285 -1.366 . . . . 0.0 114.215 -161.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 52.5 mtp85 -126.43 158.98 34.58 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 123.433 1.587 . . . . 0.0 110.723 169.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.64 163.37 31.36 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-O 117.155 -1.914 . . . . 0.0 115.118 -178.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . 0.317 20.0 m -67.55 -12.88 61.39 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 127.334 2.432 . . . . 0.0 117.048 -167.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . 0.268 63.2 m-80 -99.83 -1.81 36.59 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 112.013 -2.358 . . . . 0.0 114.153 -179.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 52.7 p -70.06 167.0 18.58 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 121.101 1.773 . . . . 0.0 110.395 -174.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 27.2 tp -56.45 -29.53 61.78 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -161.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 45.3 mttt -99.54 -4.8 30.39 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 118.786 -2.446 . . . . 0.0 116.164 170.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.33 -23.9 22.14 Favored 'General case' 0 N--CA 1.452 -0.355 1 O-C-N 115.536 -4.478 . . . . 0.0 115.38 166.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.45 156.61 30.06 Favored Pre-proline 0 N--CA 1.449 -0.514 0 C-N-CA 124.849 1.26 . . . . 0.0 112.938 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -63.72 147.26 92.65 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 O-C-N 116.667 -2.333 . . . . 0.0 110.584 -177.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 68.3 t -62.58 -31.08 50.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 127.751 2.421 . . . . 0.0 111.671 -172.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . 0.275 22.6 pm0 -65.24 -28.27 69.24 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.566 1.547 . . . . 0.0 114.213 175.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 13.7 tp -82.97 -42.5 17.52 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.395 -0.812 . . . . 0.0 108.891 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 -61.1 -54.39 45.2 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 127.927 2.491 . . . . 0.0 110.566 -175.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -52.71 -53.5 46.82 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 127.787 3.18 . . . . 0.0 112.665 172.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 66.9 t90 -64.08 -39.17 93.48 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -177.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' C' ' 100' ' ' LEU . 13.3 mt -60.1 -39.28 85.59 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 116.948 -1.901 . . . . 0.0 114.642 172.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -64.23 -30.64 71.69 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.271 1.028 . . . . 0.0 112.711 175.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -67.86 -37.52 81.95 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 128.724 2.81 . . . . 0.0 116.751 173.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 61.6 t -86.42 -51.17 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 129.757 3.223 . . . . 0.0 113.315 -176.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 70.4 mt -77.76 -19.12 55.67 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 113.852 -2.975 . . . . 0.0 108.13 -174.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 35.1 mt -124.5 49.3 1.83 Allowed 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 122.564 2.438 . . . . 0.0 111.224 176.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 4.5 pttp . . . . . 0 N--CA 1.45 -0.454 0 CA-C-O 114.908 -2.472 . . . . 0.0 116.142 -172.914 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 55.0 p . . . . . 0 N--CA 1.447 -0.596 0 CA-C-O 118.124 -0.941 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -63.62 -20.7 69.7 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 115.089 -2.807 . . . . 0.0 111.405 169.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -161.29 137.43 8.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 172.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 18.1 t -78.72 132.91 37.15 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 126.896 2.623 . . . . 0.0 111.602 -167.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.02 -34.54 74.99 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 116.615 -1.659 . . . . 0.0 114.209 169.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.69 -38.99 57.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 125.277 2.465 . . . . 0.0 114.722 166.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 12.8 mmt -81.91 -22.95 36.52 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 115.635 -2.126 . . . . 0.0 114.879 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.56 -17.93 57.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 118.59 2.811 . . . . 0.0 118.59 165.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . 0.336 40.0 tp10 -76.97 -45.04 28.94 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 116.96 -1.495 . . . . 0.0 110.622 156.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -65.64 -31.66 72.81 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 117.687 2.477 . . . . 0.0 117.687 -173.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.95 -21.05 63.3 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 176.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -86.1 -24.09 26.41 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 165.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -81.66 -30.33 32.77 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.206 -1.559 . . . . 0.0 108.677 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -70.76 -22.41 62.4 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 117.901 -3.0 . . . . 0.0 111.881 169.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . 0.435 ' CE2' ' HD2' ' C' ' 48' ' ' ARG . 6.7 t-105 -87.39 -48.44 7.97 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 114.806 -2.521 . . . . 0.0 110.932 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 46.3 mt -57.13 -34.27 68.21 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 126.925 2.09 . . . . 0.0 109.504 167.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -63.11 -35.54 80.61 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 116.729 -3.732 . . . . 0.0 114.377 169.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -69.68 -36.71 76.22 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 121.255 1.843 . . . . 0.0 110.037 167.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 97.9 t -68.46 -35.86 72.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-N 122.455 2.389 . . . . 0.0 110.739 -177.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.91 -42.35 94.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 128.188 2.595 . . . . 0.0 114.158 168.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.89 -47.8 73.62 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 116.27 -1.824 . . . . 0.0 109.236 177.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 39.5 tp -64.44 -38.31 90.59 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 125.537 1.773 . . . . 0.0 114.844 177.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -49.67 -58.06 6.02 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 123.846 0.858 . . . . 0.0 111.878 166.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -74.41 -12.87 60.63 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.133 -1.413 . . . . 0.0 113.127 -176.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.396 . . -77.08 -27.41 54.24 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.691 2.478 . . . . 0.0 117.691 157.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -68.0 -29.99 69.14 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.362 -3.336 . . . . 0.0 113.101 171.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -73.21 -36.95 66.58 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 129.187 2.995 . . . . 0.0 116.254 -172.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 40.7 p30 -105.92 9.91 32.55 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 125.259 1.599 . . . . 0.0 113.571 171.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 64.95 30.7 11.81 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 131.391 3.876 . . . . 0.0 115.287 -176.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 34.9 mt -96.39 12.91 29.57 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 118.713 -2.492 . . . . 0.0 116.228 174.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -53.77 51.67 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 128.07 2.548 . . . . 0.0 110.15 178.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.27 1.1 mt -63.1 -50.88 73.88 Favored Pre-proline 0 N--CA 1.448 -0.534 0 O-C-N 121.246 -0.909 . . . . 0.0 111.679 -171.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -53.09 -27.35 36.31 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 N-CA-C 118.606 2.502 . . . . 0.0 118.606 166.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 27.2 tp -83.45 -43.2 16.09 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 120.084 1.311 . . . . 0.0 111.971 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 93.1 mt -62.35 -37.36 85.37 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 119.991 1.269 . . . . 0.0 110.425 170.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -81.9 -30.72 31.78 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 116.734 -1.603 . . . . 0.0 113.769 -174.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 13.8 tp -58.52 -58.64 7.64 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 129.389 3.076 . . . . 0.0 111.166 157.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.9 mmt -56.04 -35.97 67.5 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.167 2.187 . . . . 0.0 112.677 -178.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 70.0 mt -121.7 124.98 45.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 117.576 -3.202 . . . . 0.0 106.365 -161.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 81.4 p -60.42 153.49 59.56 Favored Pre-proline 0 N--CA 1.453 -0.313 0 C-N-CA 127.665 2.386 . . . . 0.0 109.927 162.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.61 -27.12 11.09 Favored 'Trans proline' 0 N--CA 1.449 -1.133 0 CA-C-O 116.606 -1.498 . . . . 0.0 115.513 -158.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -15.08 63.04 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 113.988 -2.91 . . . . 0.0 114.711 165.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -76.99 -29.72 55.63 Favored 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 125.544 1.777 . . . . 0.0 115.294 167.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 28.9 mtm-85 -77.06 -37.97 53.58 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.833 1.653 . . . . 0.0 112.022 175.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -56.82 -41.44 77.8 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 123.728 1.728 . . . . 0.0 114.414 166.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.319 . . -64.32 -42.22 96.42 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.76 -1.838 . . . . 0.0 113.877 175.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 20.0 mt -72.05 -38.72 69.43 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.12 -28.58 73.79 Favored Glycine 0 C--N 1.336 0.545 0 CA-C-N 120.034 1.288 . . . . 0.0 110.724 167.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 91.2 m -70.5 -23.08 62.6 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 119.164 -2.374 . . . . 0.0 110.928 170.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -81.6 -23.86 36.8 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 116.622 -3.799 . . . . 0.0 110.329 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 69.5 t -58.33 -39.14 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 120.594 1.543 . . . . 0.0 113.859 164.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -84.4 -19.44 33.53 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.839 -1.788 . . . . 0.0 115.747 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 80.4 mt -66.8 -51.57 54.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 C-N-CA 127.315 2.246 . . . . 0.0 110.353 160.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . 0.278 67.9 t -55.7 -52.35 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 O-C-N 126.352 2.282 . . . . 0.0 109.099 169.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -56.2 -42.55 77.36 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 120.065 1.302 . . . . 0.0 112.289 -168.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -76.16 -35.33 59.23 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 119.007 2.965 . . . . 0.0 119.007 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 54.4 mt -53.66 -37.32 63.03 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 115.562 -2.161 . . . . 0.0 113.22 167.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 94.1 mt -80.74 -36.2 32.36 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 127.984 2.514 . . . . 0.0 107.358 177.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -68.53 -50.49 51.58 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 122.488 2.404 . . . . 0.0 110.261 -177.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.63 48.15 8.2 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-O 114.933 -3.148 . . . . 0.0 106.651 161.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -130.74 -54.5 1.07 Allowed 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 126.385 1.874 . . . . 0.0 107.081 179.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 15.7 mmt -80.28 49.91 1.19 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.766 2.426 . . . . 0.0 108.679 -176.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 23.6 p -82.4 -166.02 1.17 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 119.977 3.325 . . . . 0.0 119.977 -175.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 50.59 -95.47 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 126.124 1.77 . . . . 0.0 113.761 169.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -70.58 -39.14 74.03 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 117.498 -3.251 . . . . 0.0 113.025 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -79.01 -38.71 35.96 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 112.885 -1.961 . . . . 0.0 110.656 -161.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . 0.3 3.8 mt -56.65 -34.76 67.62 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.415 170.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -78.45 -29.85 47.14 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 177.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -116.65 -16.81 10.68 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 128.177 2.591 . . . . 0.0 116.207 -162.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . 0.27 15.8 tp10 -122.14 -44.93 2.26 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 130.971 3.708 . . . . 0.0 107.821 -173.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -82.17 -47.15 12.85 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 113.282 -3.247 . . . . 0.0 114.879 165.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 99.53 -164.14 19.93 Favored Glycine 0 CA--C 1.523 0.592 0 CA-C-N 121.144 1.793 . . . . 0.0 113.415 155.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.69 -22.49 66.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 125.808 1.534 . . . . 0.0 113.947 -159.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.94 -15.81 22.26 Favored Glycine 0 C--N 1.337 0.6 1 CA-C-O 112.483 -4.509 . . . . 0.0 112.099 171.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 10.0 tt -49.8 -22.11 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 1 CA-C-N 124.211 4.006 . . . . 0.0 114.926 172.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -102.19 -15.21 16.73 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 131.356 3.862 . . . . 0.0 112.649 -171.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 57.1 m -64.78 -32.4 74.07 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 116.264 -1.827 . . . . 0.0 113.341 153.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 28.0 mm -98.18 -23.55 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 126.817 2.047 . . . . 0.0 113.388 -173.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 44.8 p -118.17 0.56 11.79 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 118.836 -2.415 . . . . 0.0 115.118 177.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -120.22 -177.53 3.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.308 1.843 . . . . 0.0 108.083 154.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.14 166.3 35.51 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-O 117.183 -1.898 . . . . 0.0 112.127 -144.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 53.3 p -77.83 -32.31 52.13 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 118.872 2.916 . . . . 0.0 118.872 -166.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -131.57 101.71 5.61 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.014 -1.448 . . . . 0.0 112.485 161.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 69.1 p -101.33 -177.28 3.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 124.273 1.987 . . . . 0.0 112.433 -172.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 tp -63.34 -22.5 66.91 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.165 -1.38 . . . . 0.0 113.371 168.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 46.5 tttt -75.17 -15.48 60.57 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.453 -2.03 . . . . 0.0 111.306 170.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -110.1 -15.36 14.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 115.874 -2.013 . . . . 0.0 115.263 -170.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 38.68 92.43 0.05 OUTLIER Pre-proline 0 N--CA 1.45 -0.45 0 O-C-N 126.539 2.399 . . . . 0.0 115.886 172.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.365 15.2 Cg_exo 24.43 38.49 0.0 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.342 0 CA-C-O 116.319 -1.617 . . . . 0.0 115.948 50.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 15.4 t -51.8 -33.34 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 126.137 1.775 . . . . 0.0 107.45 -176.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.332 0.0 OUTLIER -76.38 -43.27 41.36 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -174.36 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 14.7 tp -59.51 -46.85 87.66 Favored 'General case' 0 N--CA 1.447 -0.606 1 O-C-N 129.263 4.102 . . . . 0.0 105.805 174.201 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 45.2 ttp180 -65.94 -55.1 18.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.62 0.768 . . . . 0.0 110.43 -171.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -45.22 -37.64 4.76 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 126.638 2.461 . . . . 0.0 113.564 173.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . 0.272 90.4 t90 -74.03 -52.67 11.99 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 172.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 97.0 mt -51.39 -29.65 16.39 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 118.519 -2.613 . . . . 0.0 112.579 169.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -82.73 -16.22 48.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 120.049 -1.657 . . . . 0.0 110.933 -175.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -116.38 6.07 13.61 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 117.0 -3.562 . . . . 0.0 115.875 175.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 44.1 t -109.88 -38.14 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 128.122 2.569 . . . . 0.0 108.87 170.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 31.3 mt -99.34 -20.62 16.42 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 121.965 2.166 . . . . 0.0 112.198 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 4.3 mp -116.6 44.49 2.01 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 126.928 3.251 . . . . 0.0 112.677 171.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 17.1 pttp -71.64 -179.89 2.78 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 112.136 -2.302 . . . . 0.0 113.704 -174.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 69.2 m -50.97 -31.8 18.99 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.619 -1.173 . . . . 0.0 112.636 -173.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 . . . . . 0 C--O 1.251 1.157 1 O-C-N 116.297 -4.002 . . . . 0.0 114.487 -175.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 16.9 tpt . . . . . 0 N--CA 1.453 -0.277 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.07 -37.0 85.44 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 118.426 -1.31 . . . . 0.0 113.583 174.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -62.91 -39.29 94.09 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 118.981 -2.324 . . . . 0.0 112.884 171.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -72.04 -30.43 65.17 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.134 -1.394 . . . . 0.0 112.473 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 37.4 mmt-85 -75.16 -28.08 59.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 162.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -64.95 -42.33 94.71 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 117.036 -1.459 . . . . 0.0 110.543 171.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -79.68 -18.15 52.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 125.049 1.468 . . . . 0.0 112.276 -175.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -74.28 -36.55 63.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.734 2.814 . . . . 0.0 107.334 173.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 11.1 t-105 -71.17 -62.08 1.53 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 124.914 2.292 . . . . 0.0 110.697 172.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.3 mt -57.05 -13.81 3.17 Favored 'General case' 0 N--CA 1.447 -0.604 1 O-C-N 115.535 -4.478 . . . . 0.0 117.422 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -52.37 -44.95 65.55 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 118.732 -2.48 . . . . 0.0 113.798 160.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -72.4 -35.66 68.45 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 118.034 -2.916 . . . . 0.0 114.221 179.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.8 t -62.65 -34.72 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 124.141 1.924 . . . . 0.0 110.226 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -76.5 -31.49 57.75 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.47 -2.643 . . . . 0.0 114.352 171.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 27.3 tp -68.13 -66.23 0.59 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.695 1.198 . . . . 0.0 111.588 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.0 tp -46.37 -29.45 1.69 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 117.514 2.413 . . . . 0.0 117.514 167.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -62.8 -49.39 75.12 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 116.329 -3.982 . . . . 0.0 110.924 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -70.94 -17.86 62.66 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 116.501 -1.714 . . . . 0.0 112.563 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . 0.301 . . -84.28 -28.68 26.99 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 114.482 1.289 . . . . 0.0 114.482 176.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -56.33 -49.67 73.69 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.094 1.758 . . . . 0.0 110.435 163.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -62.08 -7.16 3.61 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 118.404 2.742 . . . . 0.0 118.404 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -126.66 8.66 6.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 129.625 3.17 . . . . 0.0 112.29 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 42.41 21.64 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 118.282 2.697 . . . . 0.0 118.282 -168.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 mt -84.06 2.86 37.19 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.466 1.906 . . . . 0.0 111.898 172.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -66.35 -45.38 80.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 -178.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 9.1 mt -64.57 -40.47 50.1 Favored Pre-proline 0 N--CA 1.451 -0.423 0 C-N-CA 116.44 -2.104 . . . . 0.0 112.333 174.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 83.0 Cg_exo -60.69 -39.65 61.77 Favored 'Trans proline' 0 N--CA 1.449 -1.119 1 C-N-CA 126.791 4.994 . . . . 0.0 112.584 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.9 tp -63.32 -47.66 81.31 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 125.427 2.537 . . . . 0.0 114.925 169.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 62.5 mt -70.41 -37.31 74.43 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 118.384 -2.698 . . . . 0.0 112.105 -169.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -68.34 -9.42 47.81 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 119.836 -1.79 . . . . 0.0 114.035 171.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.293 1.0 OUTLIER -86.34 -56.56 3.38 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 118.263 -2.773 . . . . 0.0 106.89 178.902 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.3 mmt -66.17 -22.77 66.37 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.367 48.5 mt -123.56 131.28 53.58 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.276 2.63 . . . . 0.0 112.946 -170.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.8 p -87.56 152.74 52.41 Favored Pre-proline 0 N--CA 1.447 -0.575 0 CA-C-O 117.229 -1.367 . . . . 0.0 111.899 177.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -49.69 -48.24 19.96 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 123.709 2.939 . . . . 0.0 118.619 -175.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -65.66 -35.77 81.74 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 116.693 -1.622 . . . . 0.0 110.365 175.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -60.69 -40.14 91.06 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 123.887 3.04 . . . . 0.0 112.71 169.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 46.0 mtm-85 -65.86 -54.36 27.66 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -50.45 -45.76 56.23 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.391 1.476 . . . . 0.0 108.377 170.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.37 -33.97 77.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 117.638 -3.164 . . . . 0.0 109.983 -178.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.8 mt -75.75 -27.5 58.11 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 125.262 1.602 . . . . 0.0 113.554 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -64.27 -47.14 87.79 Favored Glycine 0 CA--C 1.521 0.447 0 CA-C-O 115.436 -2.869 . . . . 0.0 108.229 172.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 m -57.79 -36.31 72.01 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 120.419 2.11 . . . . 0.0 114.321 174.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 82.2 mtt180 -59.54 -19.85 51.36 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 117.4 2.37 . . . . 0.0 117.4 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.9 t -64.86 -45.74 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 CA-C-O 117.25 -1.357 . . . . 0.0 113.932 167.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 46.6 ttt180 -71.35 -26.57 62.87 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 125.759 1.912 . . . . 0.0 116.142 171.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.304 34.5 mt -61.66 -53.34 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 128.047 3.342 . . . . 0.0 115.679 165.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.0 t -67.55 -30.76 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 O-C-N 126.558 2.411 . . . . 0.0 110.544 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -50.97 -55.16 18.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 116.397 -3.939 . . . . 0.0 115.369 172.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -76.05 -29.28 57.97 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.158 1.783 . . . . 0.0 106.393 -174.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -80.56 -18.61 47.86 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 113.087 -3.34 . . . . 0.0 112.077 178.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.5 tp -87.18 -35.47 18.56 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 113.131 -3.319 . . . . 0.0 109.18 167.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -66.66 -45.41 79.0 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 123.294 2.77 . . . . 0.0 109.448 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.65 20.42 44.21 Favored Glycine 0 CA--C 1.525 0.673 0 CA-C-O 125.689 2.827 . . . . 0.0 113.183 158.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -105.06 -43.46 5.04 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.919 1.688 . . . . 0.0 113.531 -170.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 24.6 mtp -79.49 145.32 33.3 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.796 -3.065 . . . . 0.0 109.448 178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.55 165.17 21.38 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 126.091 2.12 . . . . 0.0 113.494 170.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -67.68 -27.99 67.31 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 126.481 2.363 . . . . 0.0 108.662 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -78.45 -33.34 48.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.823 1.249 . . . . 0.0 113.542 173.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -67.24 -40.32 86.28 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 124.223 1.963 . . . . 0.0 109.533 172.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.4 mt -68.68 -22.38 64.38 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 118.51 -2.619 . . . . 0.0 110.822 -175.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -61.6 -46.05 91.48 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 116.816 -1.564 . . . . 0.0 114.852 167.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -60.73 -15.72 32.25 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 120.22 1.373 . . . . 0.0 113.27 172.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -91.05 -50.8 5.66 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 124.937 2.303 . . . . 0.0 113.821 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.6 mt -100.4 -20.26 15.89 Favored 'General case' 0 N--CA 1.451 -0.381 1 N-CA-C 121.895 4.035 . . . . 0.0 121.895 -172.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 61.07 -4.85 0.25 Allowed Glycine 0 CA--C 1.521 0.418 0 N-CA-C 118.608 2.203 . . . . 0.0 118.608 -164.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.71 154.08 39.95 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 125.189 2.423 . . . . 0.0 112.827 -178.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.75 136.97 50.75 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 126.45 1.976 . . . . 0.0 117.021 171.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 26.8 mt -74.91 -25.92 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 O-C-N 118.014 -3.051 . . . . 0.0 113.464 -175.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . 0.298 . . -58.3 -33.97 70.05 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 120.159 3.392 . . . . 0.0 120.159 167.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . 0.277 33.4 p -83.12 -26.38 31.05 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 114.582 -2.627 . . . . 0.0 113.971 174.048 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 13.7 mm -68.66 -38.01 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 162.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.2 m -64.91 -44.75 88.53 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 118.633 -2.542 . . . . 0.0 112.856 176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -60.68 -49.13 78.73 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 113.732 -1.576 . . . . 0.0 111.85 172.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -50.17 -38.55 32.9 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 117.071 1.588 . . . . 0.0 117.071 171.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.4 m -63.58 -41.79 98.34 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 128.877 2.871 . . . . 0.0 114.347 174.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 49.4 m-20 -77.67 -38.98 46.41 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.065 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 70.3 m -54.51 -33.24 59.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 126.426 1.89 . . . . 0.0 114.247 166.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 37.3 tp -69.89 -49.27 53.87 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.862 1.665 . . . . 0.0 111.857 172.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -56.28 -37.82 70.37 Favored 'General case' 0 N--CA 1.446 -0.658 0 O-C-N 117.157 -3.464 . . . . 0.0 107.728 172.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.89 5.05 26.77 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 121.434 1.925 . . . . 0.0 114.579 -173.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.86 147.65 94.27 Favored Pre-proline 0 N--CA 1.452 -0.367 0 C-N-CA 127.959 2.504 . . . . 0.0 113.131 166.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -59.43 150.14 77.15 Favored 'Trans proline' 0 N--CA 1.446 -1.285 0 C-N-CA 125.094 3.863 . . . . 0.0 112.925 165.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.2 m -59.1 -36.91 65.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 O-C-N 126.116 2.135 . . . . 0.0 105.725 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -73.88 -37.89 64.57 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 123.498 2.863 . . . . 0.0 109.584 -168.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 21.8 tp -61.12 -43.82 98.3 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 117.365 -3.334 . . . . 0.0 111.479 168.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 50.7 mtm-85 -67.31 -40.01 85.98 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 121.477 1.944 . . . . 0.0 113.322 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.37 -43.12 83.3 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 126.842 2.057 . . . . 0.0 115.266 166.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -63.39 -53.56 50.59 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 116.299 -1.81 . . . . 0.0 115.831 164.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 51.4 mt -59.72 -25.05 64.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 127.44 2.296 . . . . 0.0 112.488 -177.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -67.73 -35.23 78.38 Favored 'General case' 0 N--CA 1.452 -0.332 1 O-C-N 116.257 -4.027 . . . . 0.0 111.895 170.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -80.11 -24.72 40.32 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 120.529 -1.357 . . . . 0.0 111.83 178.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.4 t -66.72 -61.04 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 O-C-N 117.314 -3.366 . . . . 0.0 114.291 164.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.2 mt -87.5 -31.66 19.84 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 117.375 2.361 . . . . 0.0 117.375 -166.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 24.4 mt -109.14 -4.64 16.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 -163.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.8 tttt . . . . . 0 N--CA 1.447 -0.622 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -164.077 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -34.72 67.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 117.182 2.29 . . . . 0.0 117.182 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.02 -45.23 91.24 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 123.41 1.576 . . . . 0.0 109.711 173.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . 0.302 48.3 tp10 -61.73 -38.09 86.65 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.501 2.72 . . . . 0.0 110.628 174.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -70.3 -42.36 72.1 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 122.232 2.287 . . . . 0.0 109.39 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -80.8 -2.81 48.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 115.004 -2.427 . . . . 0.0 112.266 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -82.58 -44.97 15.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 119.933 3.308 . . . . 0.0 119.933 152.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -65.14 -21.38 66.78 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 170.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -64.95 -37.04 86.33 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 117.88 2.548 . . . . 0.0 117.88 161.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 15.9 t-105 -68.44 -41.42 80.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 117.143 -1.408 . . . . 0.0 108.815 -177.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 59.7 mt -65.92 -27.79 68.45 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 127.346 2.904 . . . . 0.0 110.739 -176.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -63.31 -31.66 72.88 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 125.251 1.595 . . . . 0.0 114.677 -178.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -74.48 -49.36 22.5 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 124.814 1.321 . . . . 0.0 109.847 171.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.18 -37.41 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.774 1.63 . . . . 0.0 108.48 -173.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.45 -35.01 63.32 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 127.846 2.458 . . . . 0.0 113.601 175.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 16.8 tp -57.79 -50.09 74.42 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 116.879 -3.638 . . . . 0.0 110.597 166.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 22.4 tp -63.52 -45.45 90.54 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.844 178.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -56.73 -44.94 82.13 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.812 2.045 . . . . 0.0 113.419 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -66.55 -43.94 83.73 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 172.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.44 -49.35 55.18 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 119.214 -2.179 . . . . 0.0 114.238 173.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . 0.49 ' C ' ' H ' ' B' ' 32' ' ' ASN . 1.6 m-85 -64.65 -37.69 88.45 Favored 'General case' 0 N--CA 1.45 -0.457 1 CA-C-O 111.37 -4.157 . . . . 0.0 105.206 -176.166 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -57.26 -4.94 0.24 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 123.639 2.927 . . . . 0.0 116.47 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . 0.49 ' H ' ' C ' ' B' ' 30' ' ' TYR . 49.0 m-80 -141.48 3.18 1.69 Allowed 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 129.002 2.921 . . . . 0.0 114.61 -167.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 65.79 19.43 11.35 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 129.503 3.121 . . . . 0.0 118.298 170.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 26.2 mt -87.81 0.69 55.45 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 113.367 -1.742 . . . . 0.0 114.843 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -59.19 -40.92 87.24 Favored 'General case' 0 N--CA 1.45 -0.425 1 O-C-N 115.573 -4.454 . . . . 0.0 113.286 -170.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 29.4 tp -66.89 -47.61 53.46 Favored Pre-proline 0 N--CA 1.451 -0.41 0 CA-C-O 113.51 -3.138 . . . . 0.0 110.109 -178.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.22 -49.07 18.27 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 124.934 3.756 . . . . 0.0 116.567 167.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 21.8 tp -56.08 -40.78 74.13 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 119.201 3.037 . . . . 0.0 119.201 168.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 82.4 mt -73.61 -16.55 61.23 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 113.986 -2.912 . . . . 0.0 109.338 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . 0.344 33.6 m-20 -78.8 -40.46 32.95 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 123.025 2.648 . . . . 0.0 110.945 169.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 56.4 tp -65.88 -30.13 70.69 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 117.336 2.347 . . . . 0.0 117.336 169.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.2 mmt -105.82 -8.27 17.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 121.535 1.97 . . . . 0.0 109.039 -169.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 19.5 mt -134.94 135.23 41.34 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 120.501 1.5 . . . . 0.0 109.298 176.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 59.0 p -75.42 159.32 82.21 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-O 114.037 -2.887 . . . . 0.0 112.879 170.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -67.97 -20.56 44.64 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 CA-C-O 113.025 -2.99 . . . . 0.0 112.885 -172.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.78 -35.65 73.13 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 128.153 3.408 . . . . 0.0 112.372 166.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -86.8 -36.57 18.46 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 126.078 2.111 . . . . 0.0 112.28 -176.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 16.3 mtm-85 -68.19 -30.21 69.25 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.069 -1.423 . . . . 0.0 114.157 170.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -71.38 -25.91 62.56 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 114.651 -2.595 . . . . 0.0 114.135 167.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.81 -53.02 62.41 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 124.592 2.139 . . . . 0.0 114.915 158.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.292 30.7 mt -62.12 -42.78 99.57 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 116.63 -1.653 . . . . 0.0 114.849 -175.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.32 -31.67 79.69 Favored Glycine 0 CA--C 1.522 0.519 0 C-N-CA 118.096 -2.002 . . . . 0.0 113.798 174.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . 0.258 25.8 m -64.01 -45.05 90.67 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.638 2.375 . . . . 0.0 111.303 170.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -73.08 -27.51 61.76 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 118.891 -2.38 . . . . 0.0 112.385 -171.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 23.8 t -56.85 -38.28 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 1 O-C-N 115.01 -4.807 . . . . 0.0 112.889 163.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -76.97 -33.06 57.66 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 120.656 1.571 . . . . 0.0 110.38 -176.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 45.0 mt -64.3 -56.08 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 128.383 2.673 . . . . 0.0 113.536 173.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.267 94.0 t -44.69 -48.16 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 119.136 3.013 . . . . 0.0 119.136 167.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -58.75 -54.72 43.89 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 126.99 2.681 . . . . 0.0 110.924 173.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -59.93 -33.29 71.69 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.831 -1.793 . . . . 0.0 109.437 -175.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 42.6 mt -60.89 -42.59 98.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 116.308 -1.805 . . . . 0.0 108.901 178.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 47.8 mt -72.64 -24.55 61.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.753 1.908 . . . . 0.0 114.995 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 31.9 ttm105 -87.08 -50.12 6.85 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.421 -1.276 . . . . 0.0 112.208 -176.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.02 37.91 36.85 Favored Glycine 0 CA--C 1.525 0.687 0 CA-C-N 121.249 1.841 . . . . 0.0 116.865 177.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -113.23 -28.94 7.44 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 118.237 -2.92 . . . . 0.0 114.14 -175.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 24.5 mtt -82.72 131.17 35.21 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 -168.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 29.6 p -62.61 166.25 5.53 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 128.338 2.655 . . . . 0.0 113.066 170.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -72.15 -25.04 61.55 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 123.921 3.055 . . . . 0.0 112.428 -177.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -63.33 -48.06 79.58 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 131.437 3.895 . . . . 0.0 109.202 169.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -67.06 -38.93 86.65 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 78.0 mt -54.68 -42.05 70.92 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 124.471 1.107 . . . . 0.0 112.133 168.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -71.33 -21.51 62.04 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 115.09 -2.386 . . . . 0.0 113.595 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -130.41 -39.37 1.31 Allowed 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 124.758 3.435 . . . . 0.0 110.159 -163.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -71.38 -49.39 42.62 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 124.874 2.273 . . . . 0.0 112.091 173.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 16.9 mt -96.53 3.86 52.4 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 112.766 -2.016 . . . . 0.0 115.977 170.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 56.79 33.39 63.17 Favored Glycine 0 C--N 1.337 0.593 0 O-C-N 118.037 -2.914 . . . . 0.0 115.387 172.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.71 139.94 52.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 120.952 2.376 . . . . 0.0 115.389 -168.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.23 153.86 36.18 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 127.889 2.661 . . . . 0.0 114.006 169.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . 0.251 23.8 mm -62.85 -23.18 32.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 120.557 2.179 . . . . 0.0 112.148 -172.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.67 -41.89 95.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 119.728 -1.857 . . . . 0.0 112.504 167.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -69.16 -19.18 64.0 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 116.722 -3.736 . . . . 0.0 114.188 174.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 mm -81.35 -54.16 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-O 123.969 1.842 . . . . 0.0 113.591 172.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 25.7 m -55.71 -35.17 65.79 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 118.573 -2.579 . . . . 0.0 114.86 174.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -56.81 -50.65 71.74 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 118.746 -2.471 . . . . 0.0 114.409 168.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -57.25 -42.99 93.73 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 128.402 2.905 . . . . 0.0 118.927 173.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 4.0 p -72.39 -42.41 65.22 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 175.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -47.57 -37.59 12.64 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 158.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 13.8 m -75.32 -28.75 59.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 120.086 1.312 . . . . 0.0 112.487 -176.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 mt -84.68 -43.73 14.07 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 128.179 2.591 . . . . 0.0 106.448 -178.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 18.5 tttm -54.13 -40.8 67.7 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 121.858 2.117 . . . . 0.0 110.711 176.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.05 4.55 44.77 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 117.606 2.447 . . . . 0.0 117.606 -179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.07 135.62 93.95 Favored Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 117.539 2.422 . . . . 0.0 117.539 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -51.83 128.76 27.69 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 N-CA-C 106.755 -2.056 . . . . 0.0 106.755 176.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 34.5 m -65.32 -23.21 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -163.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -62.24 -31.58 72.16 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 170.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 13.7 tp -80.28 -36.54 34.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 126.588 1.955 . . . . 0.0 112.674 171.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 58.0 mtp85 -61.92 -43.96 97.76 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 177.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.69 -37.66 85.19 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.06 1.344 . . . . 0.0 110.415 177.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 79.1 t90 -67.15 -45.62 76.51 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 124.765 2.222 . . . . 0.0 108.906 -172.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 70.2 mt -67.98 -27.26 66.43 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 111.835 -3.936 . . . . 0.0 110.378 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -68.99 -37.09 78.53 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 125.191 3.632 . . . . 0.0 109.266 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -82.04 -30.2 31.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.435 2.294 . . . . 0.0 114.852 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 76.9 t -62.17 -55.3 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 O-C-N 121.327 -0.858 . . . . 0.0 108.859 167.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . 0.29 33.2 mt -82.17 -55.2 4.69 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 124.345 2.021 . . . . 0.0 111.73 -156.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 32.1 mt -79.59 -2.78 44.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 118.087 -2.883 . . . . 0.0 114.13 -163.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -123.33 4.03 9.13 Favored 'General case' 0 N--CA 1.454 -0.268 1 C-N-CA 132.765 4.426 . . . . 0.0 110.926 -177.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 16.5 m -114.43 -35.95 4.78 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 115.532 -2.175 . . . . 0.0 110.949 162.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 33.0 t70 . . . . . 0 C--O 1.25 1.091 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 169.395 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . 0.296 61.9 mtp . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.428 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.294 . . -87.78 132.58 34.11 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 126.327 1.851 . . . . 0.0 110.054 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -109.05 132.75 53.81 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 119.513 1.051 . . . . 0.0 110.899 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -103.59 149.85 24.52 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 166.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 5' ' ' SER . . . . . 0.415 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 32.7 p -125.03 150.45 66.61 Favored Pre-proline 0 N--CA 1.45 -0.446 0 O-C-N 126.682 2.489 . . . . 0.0 109.545 177.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' C' ' 5' ' ' SER . 63.6 Cg_exo -66.32 -9.85 25.37 Favored 'Trans proline' 0 N--CA 1.446 -1.282 0 C-N-CA 124.573 3.515 . . . . 0.0 116.388 -174.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -155.08 158.08 38.52 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 118.082 -2.886 . . . . 0.0 107.589 176.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 10.6 t -150.06 121.89 8.14 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 131.311 3.844 . . . . 0.0 112.065 157.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.34 -40.9 78.98 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 116.845 -3.66 . . . . 0.0 114.579 171.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.57 -41.41 73.26 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 120.78 1.627 . . . . 0.0 115.355 172.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 25.3 mtt -56.67 -40.73 76.05 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.651 1.58 . . . . 0.0 108.694 178.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.94 -37.79 79.09 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 119.305 -2.122 . . . . 0.0 112.94 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -68.95 -16.8 63.83 Favored 'General case' 0 N--CA 1.448 -0.541 1 CA-C-O 109.224 -5.179 . . . . 0.0 116.79 165.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -84.66 -31.1 24.35 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 125.04 3.563 . . . . 0.0 110.868 163.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -33.27 75.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 124.677 1.236 . . . . 0.0 113.114 170.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . 0.265 84.7 t60 -78.59 -30.83 46.9 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 126.019 2.075 . . . . 0.0 109.62 -177.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -69.18 -23.93 63.99 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 117.413 -1.715 . . . . 0.0 114.863 171.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -77.6 -32.82 53.82 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 124.502 1.121 . . . . 0.0 111.84 -179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -64.9 -43.04 94.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 130.899 3.68 . . . . 0.0 114.225 165.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mp -66.86 -30.04 70.1 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 116.612 -3.805 . . . . 0.0 110.279 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -74.53 -34.02 62.9 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 124.085 1.898 . . . . 0.0 110.739 -175.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -59.99 -39.33 85.36 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 115.916 -1.992 . . . . 0.0 112.622 170.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 78.7 t -68.55 -46.23 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 C-N-CA 128.284 2.633 . . . . 0.0 110.983 174.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -64.77 -41.54 95.78 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 117.723 2.49 . . . . 0.0 117.723 176.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 45.7 tp -57.11 -40.94 78.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 127.442 3.496 . . . . 0.0 110.689 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 15.8 tp -71.65 -28.39 63.73 Favored 'General case' 0 N--CA 1.447 -0.579 1 O-C-N 115.955 -4.215 . . . . 0.0 116.579 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -63.86 -44.11 94.08 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.129 -1.891 . . . . 0.0 108.728 170.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -71.69 -31.39 66.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 126.834 2.584 . . . . 0.0 111.229 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.42 83.85 Favored 'General case' 0 N--CA 1.443 -0.785 0 O-C-N 119.15 -2.219 . . . . 0.0 115.232 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -58.17 -24.74 60.06 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 126.768 3.175 . . . . 0.0 117.167 169.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -76.51 -22.99 53.73 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 111.821 -2.445 . . . . 0.0 114.092 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . 0.517 HD22 HD11 ' C' ' 34' ' ' LEU . 32.7 p-10 -135.55 19.38 3.33 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.237 2.215 . . . . 0.0 112.253 -174.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.263 1.6 m-20 60.92 24.34 14.37 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 117.362 -3.336 . . . . 0.0 115.619 178.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . 0.517 HD11 HD22 ' C' ' 32' ' ' ASN . 18.4 mt -89.2 4.46 48.56 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.642 171.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . 0.402 32.6 p-80 -53.66 -56.74 14.6 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 117.454 2.39 . . . . 0.0 117.454 175.397 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.73 -57.15 27.55 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-O 115.862 -2.018 . . . . 0.0 105.813 175.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -52.69 -37.56 75.46 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 CA-C-N 124.323 2.58 . . . . 0.0 114.507 175.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 64.4 tp -74.65 -23.28 58.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 122.927 2.603 . . . . 0.0 112.654 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 35.4 mt -90.09 -38.21 13.71 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 119.512 1.051 . . . . 0.0 112.237 174.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -43.93 -38.4 3.4 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.712 1.205 . . . . 0.0 110.446 162.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 57.6 tp -83.43 -40.15 19.68 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 118.42 -2.675 . . . . 0.0 114.004 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 42' ' ' MET . . . . . 0.452 ' SD ' ' HB3' ' D' ' 54' ' ' ARG . 26.1 mmm -96.07 -6.28 38.98 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 119.786 -1.821 . . . . 0.0 112.143 -171.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 10.1 mp -119.24 146.8 44.92 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.044 1.738 . . . . 0.0 108.158 175.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . 0.387 41.6 p -70.2 156.83 91.2 Favored Pre-proline 0 N--CA 1.449 -0.487 0 C-N-CA 127.468 2.307 . . . . 0.0 114.518 158.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -50.25 -31.46 29.39 Favored 'Trans proline' 0 N--CA 1.45 -1.063 0 C-N-CA 124.743 3.629 . . . . 0.0 112.001 165.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.66 -30.6 65.9 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 127.248 2.219 . . . . 0.0 113.419 175.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -82.21 -36.87 26.83 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 120.447 -1.408 . . . . 0.0 108.453 -174.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . 0.471 ' HD2' ' CE2' ' D' ' 19' ' ' TRP . 73.1 mtm-85 -66.04 -42.33 89.72 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 115.394 -2.241 . . . . 0.0 112.903 171.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -58.04 -52.42 65.6 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 127.901 3.251 . . . . 0.0 111.271 176.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -41.88 -59.89 1.56 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 128.37 2.668 . . . . 0.0 110.791 169.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 28.7 mt -63.78 -34.42 77.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 119.213 3.042 . . . . 0.0 119.213 178.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.84 -56.47 24.95 Favored Glycine 0 C--N 1.336 0.55 0 O-C-N 126.798 2.561 . . . . 0.0 113.124 170.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . 0.315 17.6 m -45.04 -53.77 7.43 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 159.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -59.7 -33.66 71.89 Favored 'General case' 0 N--CA 1.449 -0.498 1 O-C-N 114.756 -4.965 . . . . 0.0 117.88 172.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 17.1 t -57.38 -51.63 67.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 121.19 -0.944 . . . . 0.0 110.612 169.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 45.9 mtp180 -66.52 -26.72 67.29 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 113.396 -3.192 . . . . 0.0 113.593 -174.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . 0.251 77.8 mt -70.42 -27.17 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 105.392 -2.077 . . . . 0.0 105.392 175.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 40.1 t -78.84 -39.7 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 122.369 2.35 . . . . 0.0 112.335 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -49.83 -47.09 51.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 119.042 -2.286 . . . . 0.0 111.366 169.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . 0.403 ' HA ' ' OE1' ' C' ' 60' ' ' GLU . 29.7 mm-40 -75.79 -22.3 56.52 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 115.336 -2.269 . . . . 0.0 116.034 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 63.6 mt -86.39 -15.23 41.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 123.579 2.9 . . . . 0.0 108.255 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 16.7 mt -83.03 -41.71 18.35 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 123.256 2.753 . . . . 0.0 108.824 172.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.5 ttm105 -66.02 -25.93 67.29 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 116.687 2.106 . . . . 0.0 116.687 170.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.77 2.39 0.02 OUTLIER Glycine 0 C--N 1.336 0.548 0 C-N-CA 127.517 2.484 . . . . 0.0 118.469 -178.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -66.06 -39.42 90.08 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 121.815 2.807 . . . . 0.0 110.903 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 16.0 mmt -55.58 123.15 13.08 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 124.659 2.171 . . . . 0.0 113.157 175.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 92.5 p -83.91 -174.96 5.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 112.826 -1.988 . . . . 0.0 111.791 -174.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -67.5 -28.31 67.73 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 122.208 2.276 . . . . 0.0 112.112 -173.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 34.1 ttp-105 -59.48 -64.55 0.9 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 127.63 2.372 . . . . 0.0 113.872 171.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -53.69 -39.94 65.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 128.301 2.64 . . . . 0.0 112.976 176.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 77.2 mt -64.17 -12.22 38.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.375 -1.453 . . . . 0.0 114.706 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -107.08 -48.64 3.43 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.023 2.529 . . . . 0.0 112.783 171.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -88.96 10.9 19.78 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -174.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -137.85 -36.71 0.61 Allowed 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 111.929 -3.891 . . . . 0.0 110.08 166.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 7.8 mp -95.77 0.22 52.11 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 120.477 3.51 . . . . 0.0 120.477 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 44.3 -125.36 5.87 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-O 115.199 -3.0 . . . . 0.0 119.85 171.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.04 -18.85 16.07 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 120.728 2.264 . . . . 0.0 113.149 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.11 -29.3 73.98 Favored Glycine 0 CA--C 1.523 0.57 0 O-C-N 117.299 -3.375 . . . . 0.0 109.656 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tt -43.81 -34.81 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 117.733 2.494 . . . . 0.0 117.733 162.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.64 -59.22 5.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 121.126 3.75 . . . . 0.0 121.126 173.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 9.1 m -43.62 -47.13 7.51 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 115.341 -2.266 . . . . 0.0 109.849 172.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.259 44.5 mm -60.29 -30.42 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 122.213 2.279 . . . . 0.0 113.203 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 61.0 p -118.34 3.22 11.93 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 119.127 -2.233 . . . . 0.0 114.536 -163.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 67.8 mtp85 -116.76 136.67 52.78 Favored 'General case' 0 N--CA 1.45 -0.428 1 C-N-CA 131.856 4.062 . . . . 0.0 115.039 175.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 97.76 161.59 31.05 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-O 115.794 -2.67 . . . . 0.0 113.816 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 66.7 m -56.83 -12.28 1.86 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 113.465 -3.16 . . . . 0.0 117.812 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -103.84 15.01 29.7 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 122.387 2.358 . . . . 0.0 113.698 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 3.0 p -68.05 162.91 23.54 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 116.803 -1.57 . . . . 0.0 114.504 -171.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 17.3 tp -47.01 -42.64 18.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 121.979 2.172 . . . . 0.0 115.791 -172.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -91.16 -10.76 40.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 119.989 3.329 . . . . 0.0 119.989 171.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.72 -28.53 64.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 116.872 -1.537 . . . . 0.0 109.819 167.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.77 162.98 31.8 Favored Pre-proline 0 N--CA 1.453 -0.316 0 C-N-CA 129.526 3.13 . . . . 0.0 117.716 -163.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_exo -55.36 148.14 52.94 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 124.285 3.323 . . . . 0.0 111.957 172.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 18.1 t -71.13 -45.35 72.02 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 CA-C-N 110.139 -3.21 . . . . 0.0 106.991 -169.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 18.7 pm0 -65.77 -28.43 69.02 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 113.788 -3.006 . . . . 0.0 111.672 -179.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 36.6 tp -71.36 -46.27 60.85 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 125.184 2.421 . . . . 0.0 115.57 169.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -63.18 -33.73 76.12 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 112.37 -3.681 . . . . 0.0 110.022 -177.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -83.35 -31.29 26.86 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 127.618 3.074 . . . . 0.0 113.378 173.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 82.0 t90 -63.29 -54.19 40.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 170.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 78.8 mt -55.55 -29.24 58.63 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.513 1.125 . . . . 0.0 109.329 -175.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -71.52 -34.91 70.49 Favored 'General case' 0 N--CA 1.452 -0.34 1 C-N-CA 132.08 4.152 . . . . 0.0 109.825 -178.031 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -75.19 -26.26 58.88 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 111.075 -2.784 . . . . 0.0 113.117 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 54.2 t -97.42 -47.98 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-N 113.145 -1.843 . . . . 0.0 113.142 -176.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 73.4 mt -85.38 -22.7 28.29 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -169.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 64.5 mt -111.36 17.06 20.53 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 119.088 -2.258 . . . . 0.0 112.698 176.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 20.9 pttp . . . . . 0 N--CA 1.446 -0.673 0 CA-C-O 125.941 2.781 . . . . 0.0 116.69 176.088 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 1.7 p . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -76.09 -0.04 9.87 Favored 'Trans proline' 0 N--CA 1.444 -1.383 0 CA-C-O 117.587 -1.089 . . . . 0.0 112.615 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -162.89 120.29 1.96 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.184 2.593 . . . . 0.0 110.455 165.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 15.8 p -74.82 149.88 39.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 113.147 -3.421 . . . . 0.0 110.965 -168.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.77 -33.91 73.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 126.299 1.84 . . . . 0.0 115.347 174.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.36 -14.28 59.47 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 124.474 2.083 . . . . 0.0 112.491 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 4.8 mmt -87.15 -36.13 18.22 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 117.804 -3.06 . . . . 0.0 105.81 -175.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.98 -23.25 66.29 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 116.627 -3.796 . . . . 0.0 117.331 168.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -74.35 -40.75 61.95 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 126.927 2.642 . . . . 0.0 116.035 156.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -62.72 -36.92 84.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 119.815 1.189 . . . . 0.0 109.465 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -36.25 77.17 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 115.158 -2.353 . . . . 0.0 113.735 175.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -69.88 -24.87 63.47 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 122.564 2.438 . . . . 0.0 117.412 172.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -82.09 -39.53 23.23 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.342 1.057 . . . . 0.0 108.544 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -62.92 -29.32 70.7 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 169.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . 0.471 ' CE2' ' HD2' ' C' ' 48' ' ' ARG . 38.4 t-105 -70.69 -35.84 72.98 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 117.49 -3.256 . . . . 0.0 112.859 166.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 64.4 mt -80.19 -18.36 49.86 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 119.059 -2.276 . . . . 0.0 115.442 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 42.3 ttt180 -69.05 -29.11 67.18 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 126.535 1.934 . . . . 0.0 112.857 162.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -75.09 -48.4 24.03 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 114.409 -2.71 . . . . 0.0 112.347 166.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 46.7 t -56.67 -38.78 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 124.524 3.329 . . . . 0.0 112.272 174.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -73.05 -48.27 37.54 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 125.528 1.768 . . . . 0.0 113.081 173.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 39.0 tp -52.93 -48.61 67.18 Favored 'General case' 0 N--CA 1.448 -0.563 1 O-C-N 115.173 -4.704 . . . . 0.0 109.307 173.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.25 -46.7 87.67 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 120.364 1.438 . . . . 0.0 110.507 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -51.61 -46.83 63.74 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 116.123 1.898 . . . . 0.0 116.123 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -66.73 -27.85 67.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 119.109 -2.244 . . . . 0.0 108.578 174.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.307 . . -69.66 -23.91 63.53 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.049 2.94 . . . . 0.0 114.785 173.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -76.43 -28.26 56.54 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 120.449 -1.407 . . . . 0.0 111.031 165.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -75.44 -24.28 57.03 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 119.895 -1.753 . . . . 0.0 113.085 -175.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 55.1 p30 -116.33 9.93 14.61 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 121.134 3.753 . . . . 0.0 121.134 164.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 55.59 32.54 19.39 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 116.693 -1.622 . . . . 0.0 115.278 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 60.8 mt -80.78 -1.51 43.21 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 120.411 1.46 . . . . 0.0 112.578 164.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . 0.331 0.0 OUTLIER -38.8 -75.6 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 119.418 3.118 . . . . 0.0 119.418 -179.279 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.292 50.8 mt -46.44 -45.33 44.37 Favored Pre-proline 0 N--CA 1.446 -0.631 0 CA-C-O 113.528 -3.13 . . . . 0.0 115.298 174.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -55.0 -37.23 93.86 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 124.538 3.492 . . . . 0.0 114.063 168.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 41.3 tp -75.09 -46.94 31.28 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 176.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 61.8 mt -57.85 -31.23 66.47 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.757 2.023 . . . . 0.0 112.804 171.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -79.0 -40.61 31.05 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 117.0 -3.563 . . . . 0.0 112.31 176.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 54.9 tp -51.01 -55.92 15.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 118.954 -2.341 . . . . 0.0 111.68 164.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 22.2 mmt -83.5 -25.03 31.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 115.943 -1.98 . . . . 0.0 115.401 -172.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 31.9 mt -116.96 141.3 48.42 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 122.173 2.26 . . . . 0.0 113.2 -176.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 46.4 p -70.58 156.03 92.54 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 127.923 2.489 . . . . 0.0 109.347 170.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -65.28 -36.69 34.75 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 O-C-N 117.93 -1.668 . . . . 0.0 113.868 -168.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.255 0.1 OUTLIER -69.65 -10.82 59.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.834 -2.416 . . . . 0.0 115.477 173.894 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -78.91 -40.3 32.57 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.508 1.523 . . . . 0.0 108.982 166.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 41.0 mtm-85 -71.14 -36.44 72.09 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 119.164 -2.21 . . . . 0.0 116.829 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.19 -36.19 82.82 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 119.667 -1.896 . . . . 0.0 112.493 167.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.1 -30.38 43.8 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 117.72 -3.113 . . . . 0.0 111.421 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 56.4 mt -68.84 -52.7 27.13 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 118.625 -2.547 . . . . 0.0 113.844 167.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -48.45 -36.36 17.17 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-O 115.614 -2.77 . . . . 0.0 115.162 164.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 25.6 m -76.13 -26.55 56.46 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 121.087 2.444 . . . . 0.0 113.516 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . 0.452 ' HB3' ' SD ' ' C' ' 42' ' ' MET . 72.9 mtt180 -66.22 -34.36 77.84 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 116.928 -1.51 . . . . 0.0 109.354 171.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . 0.255 42.8 t -44.71 -49.09 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-O 126.471 3.034 . . . . 0.0 115.562 171.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -86.42 -21.98 26.81 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 112.017 -2.356 . . . . 0.0 116.507 -176.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.13 -39.05 84.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 122.35 1.071 . . . . 0.0 112.932 166.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 85.0 t -60.69 -54.44 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 C-N-CA 127.928 2.491 . . . . 0.0 112.415 165.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -67.06 -35.63 80.28 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -178.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -79.24 -18.19 53.32 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 121.922 2.147 . . . . 0.0 112.484 176.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 17.0 mt -63.43 -58.8 5.9 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 117.686 -1.149 . . . . 0.0 109.09 162.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 11.1 mt -63.55 -42.48 98.38 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.242 -2.132 . . . . 0.0 105.242 -171.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -62.46 -41.6 98.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 177.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 59.16 44.53 96.33 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 118.064 1.985 . . . . 0.0 118.064 175.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -132.16 -22.52 2.26 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 121.732 2.766 . . . . 0.0 115.966 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 25.1 mmt -92.49 56.57 2.76 Favored 'General case' 0 N--CA 1.448 -0.566 1 O-C-N 129.433 4.208 . . . . 0.0 108.019 168.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 64.4 p -93.22 176.16 6.5 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 125.603 1.814 . . . . 0.0 112.777 -148.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 51.69 -82.76 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 114.653 -2.594 . . . . 0.0 112.027 168.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -88.43 -24.57 22.99 Favored 'General case' 0 N--CA 1.451 -0.39 1 CA-C-N 126.803 4.365 . . . . 0.0 113.346 -174.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -83.79 -44.06 14.77 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 53.0 mt -45.52 -43.01 11.48 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 120.534 3.531 . . . . 0.0 120.534 163.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 30.3 mtmm -79.73 -38.84 32.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 116.564 2.061 . . . . 0.0 116.564 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -112.22 -17.62 12.73 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -162.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -107.21 -50.02 3.16 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.106 1.762 . . . . 0.0 114.398 168.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.56 -27.49 51.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.551 1.541 . . . . 0.0 112.355 170.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 84.92 -157.33 32.16 Favored Glycine 0 CA--C 1.522 0.505 1 O-C-N 113.496 -5.752 . . . . 0.0 118.206 136.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.67 -23.42 11.32 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.432 1.893 . . . . 0.0 114.11 -169.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.56 14.13 25.47 Favored Glycine 0 C--N 1.334 0.47 1 O-C-N 115.227 -4.671 . . . . 0.0 114.682 177.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . 0.435 HG12 ' HG1' ' D' ' 83' ' ' THR . 14.9 tt -93.59 -15.19 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.826 0 C-N-CA 117.9 -1.52 . . . . 0.0 108.598 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.15 -18.6 42.25 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 130.303 3.441 . . . . 0.0 108.802 176.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 95.7 m -84.62 -34.03 23.19 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 121.749 -0.594 . . . . 0.0 110.256 175.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 18.6 mm -87.07 -35.65 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 C-N-CA 127.421 2.288 . . . . 0.0 111.764 -178.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 83' ' ' THR . . . . . 0.435 ' HG1' HG12 ' D' ' 79' ' ' ILE . 11.5 p -118.39 4.46 11.82 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 116.879 -1.534 . . . . 0.0 114.386 -177.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 33.1 mtp85 -119.66 -169.68 1.81 Allowed 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 120.453 1.479 . . . . 0.0 112.246 151.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.17 171.04 40.17 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.936 -159.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 90.4 p -71.43 -35.2 70.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 120.155 3.391 . . . . 0.0 120.155 -164.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -130.35 72.36 1.49 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 126.209 2.909 . . . . 0.0 104.678 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 6.5 p -88.26 -177.96 5.8 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 129.66 3.184 . . . . 0.0 111.579 173.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.07 -15.5 61.5 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 117.528 -3.232 . . . . 0.0 113.629 167.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -70.63 -25.81 63.19 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 161.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -78.96 -34.68 44.14 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -176.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 56.85 72.64 0.92 Allowed Pre-proline 0 N--CA 1.447 -0.612 0 O-C-N 126.582 2.426 . . . . 0.0 115.48 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . 0.459 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.326 0.1 OUTLIER 24.07 33.51 0.0 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.283 0 N-CA-C 116.502 1.693 . . . . 0.0 116.502 45.509 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 63.1 t -59.14 -31.17 45.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 173.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . 0.459 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.327 0.0 OUTLIER -67.91 -35.18 78.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.528 -2.607 . . . . 0.0 115.166 176.384 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 30.6 tp -66.89 -53.08 35.79 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 126.754 2.533 . . . . 0.0 107.043 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 23.8 ttp180 -52.28 -38.52 58.54 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 120.967 3.692 . . . . 0.0 120.967 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.18 -24.95 54.75 Favored 'General case' 0 N--CA 1.444 -0.729 0 O-C-N 126.23 2.206 . . . . 0.0 109.979 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 54.8 t90 -87.72 -41.12 13.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 127.693 3.12 . . . . 0.0 110.508 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 29.6 mt -60.61 -32.05 71.2 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 114.934 -2.46 . . . . 0.0 109.655 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -58.89 -44.79 91.26 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 123.013 2.642 . . . . 0.0 114.868 177.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -91.8 -5.35 53.61 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 129.186 2.994 . . . . 0.0 113.743 -173.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 98.8 t -95.44 -41.7 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 O-C-N 118.658 -2.526 . . . . 0.0 112.611 164.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 16.9 mt -97.17 -27.71 14.43 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 121.055 0.455 . . . . 0.0 111.538 -172.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.352 3.3 mp -108.38 54.98 0.65 Allowed 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 121.22 -0.925 . . . . 0.0 112.149 167.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -78.12 176.75 8.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 126.983 3.277 . . . . 0.0 112.789 -173.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 59.7 m -61.72 -27.16 68.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 117.424 2.379 . . . . 0.0 117.424 -172.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 130.831 3.652 . . . . 0.0 110.576 176.454 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 N--CA 1.447 -0.6 0 CA-C-O 115.95 -1.976 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.59 -25.6 68.04 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 120.329 1.422 . . . . 0.0 112.433 170.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -75.63 -38.9 58.53 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 117.682 -3.136 . . . . 0.0 109.817 175.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -66.0 -45.43 81.6 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.639 -0.696 . . . . 0.0 109.296 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -63.11 -22.2 66.7 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 128.729 2.811 . . . . 0.0 116.481 169.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -80.71 -48.91 11.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 125.543 1.777 . . . . 0.0 112.046 173.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -65.05 -20.82 66.67 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 125.526 1.53 . . . . 0.0 112.82 172.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -72.13 -48.95 39.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 170.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -62.01 -37.16 83.8 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.56 2.744 . . . . 0.0 115.535 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . 0.299 51.9 mt -63.73 -13.77 46.45 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.812 1.645 . . . . 0.0 115.247 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -75.31 -26.65 58.84 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 118.343 -2.723 . . . . 0.0 117.633 173.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -68.25 -26.8 65.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 124.655 1.182 . . . . 0.0 111.446 163.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.7 t -80.6 -23.71 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 122.061 2.21 . . . . 0.0 114.287 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -77.57 -41.3 39.34 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 128.744 2.817 . . . . 0.0 114.892 161.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.0 tp -67.17 -40.97 86.69 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 124.937 1.398 . . . . 0.0 113.02 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.9 tp -70.23 -31.54 69.0 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 119.447 -2.033 . . . . 0.0 113.613 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -71.12 -38.09 72.31 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 127.361 2.913 . . . . 0.0 110.801 178.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -64.68 -37.87 89.06 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 174.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.87 -36.5 82.46 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 120.038 1.29 . . . . 0.0 113.42 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -54.28 -35.26 62.39 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 118.074 2.62 . . . . 0.0 118.074 166.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -74.02 -25.66 60.0 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.208 -2.182 . . . . 0.0 115.539 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -98.81 0.06 43.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 128.541 2.736 . . . . 0.0 113.172 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 39.42 35.69 0.18 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 118.242 2.682 . . . . 0.0 118.242 -155.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.1 mt -89.02 2.41 54.06 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -71.38 -43.8 66.17 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 117.705 -3.122 . . . . 0.0 115.946 -161.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.44 -42.56 5.27 Favored Pre-proline 0 N--CA 1.452 -0.356 0 CA-C-N 121.626 2.012 . . . . 0.0 107.193 -177.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -42.4 -55.61 2.49 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 124.991 3.794 . . . . 0.0 111.895 162.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 52.7 tp -64.88 -33.17 75.37 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 177.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.3 mt -77.86 -30.63 51.0 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 122.136 2.244 . . . . 0.0 110.781 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -65.41 -29.67 70.39 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 122.297 2.317 . . . . 0.0 112.92 165.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.4 tp -67.09 -49.4 65.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 117.451 -3.281 . . . . 0.0 109.689 171.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 32.6 mmt -76.52 -36.11 57.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 126.421 1.889 . . . . 0.0 115.578 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 48.2 mt -111.39 132.91 54.08 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 122.149 2.25 . . . . 0.0 115.153 -175.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.9 p -61.79 166.41 6.09 Favored Pre-proline 0 N--CA 1.448 -0.527 0 CA-C-O 114.393 -2.717 . . . . 0.0 117.573 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -64.86 -23.4 62.31 Favored 'Trans proline' 0 N--CA 1.452 -0.943 0 N-CA-C 119.684 2.917 . . . . 0.0 119.684 -177.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -94.48 -24.2 17.39 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 124.465 1.103 . . . . 0.0 111.533 -174.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -75.31 -22.29 57.79 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 118.416 -1.314 . . . . 0.0 111.124 168.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.3 mtm-85 -72.94 -48.94 32.46 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 114.948 -2.454 . . . . 0.0 109.443 172.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -66.69 -32.05 73.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 127.306 2.879 . . . . 0.0 112.618 175.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.96 -48.77 75.18 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.193 2.269 . . . . 0.0 110.517 167.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.5 mt -65.16 -45.05 86.51 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 116.598 -3.814 . . . . 0.0 113.792 -175.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.16 -36.61 83.05 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 118.779 2.272 . . . . 0.0 118.779 171.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.3 m -67.27 -34.65 77.85 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 119.788 -2.007 . . . . 0.0 114.102 173.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -69.19 -16.92 63.73 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 115.937 1.829 . . . . 0.0 115.937 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 52.3 t -72.34 -38.49 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 126.273 1.829 . . . . 0.0 109.457 167.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 33.5 ttt180 -61.79 -42.62 99.23 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 121.927 2.149 . . . . 0.0 112.045 167.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.1 mt -53.84 -50.97 48.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 3.3 t -76.25 -25.21 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -172.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -70.97 -52.5 19.41 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 116.293 -1.813 . . . . 0.0 106.355 171.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -69.61 -23.48 63.52 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 123.525 2.875 . . . . 0.0 115.282 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.311 80.6 mt -69.48 -49.23 56.75 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 128.553 2.741 . . . . 0.0 116.136 171.022 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 40.7 tp -65.81 -40.2 91.62 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 128.219 2.607 . . . . 0.0 111.407 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -74.97 -48.31 24.91 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.974 2.11 . . . . 0.0 111.302 172.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.6 16.17 75.8 Favored Glycine 0 C--O 1.224 -0.47 0 C-N-CA 124.829 1.204 . . . . 0.0 113.517 167.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -70.83 -44.88 65.6 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.235 -3.509 . . . . 0.0 113.174 173.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 50.9 mtp -79.78 124.45 28.62 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 131.612 3.965 . . . . 0.0 111.212 168.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.5 p -97.21 177.34 5.6 Favored 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 127.215 2.822 . . . . 0.0 112.804 -174.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -54.0 -44.68 71.1 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 118.981 -2.324 . . . . 0.0 114.863 -178.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 50.2 tpt85 -71.43 -29.02 64.39 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 125.747 1.905 . . . . 0.0 107.281 -175.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -73.23 -44.05 60.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 117.199 -1.381 . . . . 0.0 108.967 178.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 36.2 mt -70.13 -10.8 59.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 116.005 -1.95 . . . . 0.0 114.219 -175.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -75.33 -42.16 55.01 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 113.479 -3.153 . . . . 0.0 109.182 171.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -55.05 -31.71 61.34 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 128.436 3.585 . . . . 0.0 117.219 171.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -91.04 -41.33 11.14 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 118.443 -2.66 . . . . 0.0 114.724 -166.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 44.5 mt -109.51 -9.5 14.91 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -176.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 83.38 -29.38 3.59 Favored Glycine 0 C--N 1.339 0.709 0 CA-C-O 115.139 -3.034 . . . . 0.0 116.237 170.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -85.77 -159.18 0.44 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 117.984 2.587 . . . . 0.0 117.984 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.49 154.74 40.67 Favored Glycine 0 C--N 1.337 0.599 0 CA-C-O 116.809 -2.106 . . . . 0.0 111.348 -166.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.3 mt -59.62 -30.04 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-O 116.221 -1.847 . . . . 0.0 111.034 170.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.91 -18.57 65.33 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.628 2.467 . . . . 0.0 115.544 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 44.0 p -60.35 -29.59 69.0 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 118.137 -0.935 . . . . 0.0 111.895 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.9 mm -83.69 -53.67 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 C-N-CA 127.789 2.436 . . . . 0.0 105.153 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.2 m -54.4 -56.27 20.29 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.606 1.962 . . . . 0.0 112.786 -174.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -58.79 -36.34 74.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.77 -37.18 75.73 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 114.05 -1.432 . . . . 0.0 114.533 177.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 5.4 m -63.44 -51.27 66.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 113.447 -1.377 . . . . 0.0 111.122 173.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -62.42 -43.38 98.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 127.028 2.131 . . . . 0.0 111.576 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.9 m -65.65 -26.75 67.94 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 114.635 -2.602 . . . . 0.0 116.916 169.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.7 tp -76.38 -34.15 58.88 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 127.418 2.949 . . . . 0.0 110.433 177.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -61.08 -31.75 71.41 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 118.032 2.604 . . . . 0.0 118.032 161.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -86.66 -4.76 59.22 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 124.284 1.992 . . . . 0.0 113.359 170.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.46 150.53 54.87 Favored Pre-proline 0 N--CA 1.445 -0.684 0 O-C-N 117.934 -2.979 . . . . 0.0 115.636 167.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -65.8 158.04 55.82 Favored 'Trans proline' 0 N--CA 1.448 -1.176 1 C-N-CA 125.895 4.397 . . . . 0.0 108.787 162.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.5 m -77.35 -38.54 26.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 O-C-N 122.204 -0.31 . . . . 0.0 111.752 -166.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -59.68 -24.3 63.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 119.561 -1.962 . . . . 0.0 112.33 177.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 16.4 tp -67.02 -55.87 12.55 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 119.903 1.228 . . . . 0.0 113.138 172.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 46.2 mtm-85 -57.1 -45.8 83.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 115.708 1.744 . . . . 0.0 115.708 169.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -63.09 -28.53 70.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.164 -2.835 . . . . 0.0 111.852 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 29.7 t90 -73.49 -44.67 57.32 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 169.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 70.7 mt -59.72 -27.89 66.86 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 115.449 -2.215 . . . . 0.0 109.751 174.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -74.3 -24.16 59.2 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 123.599 2.909 . . . . 0.0 115.024 175.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -86.28 -30.0 22.64 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.697 0.799 . . . . 0.0 112.666 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.4 t -84.37 -34.99 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 O-C-N 118.951 -2.343 . . . . 0.0 110.627 173.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 27.3 mt -94.02 -45.3 7.65 Favored 'General case' 0 N--CA 1.45 -0.454 1 O-C-N 114.857 -4.902 . . . . 0.0 112.287 -167.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 56.8 mt -111.5 0.69 16.58 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 120.799 3.629 . . . . 0.0 120.799 -169.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.254 67.9 tttt . . . . . 0 N--CA 1.45 -0.469 0 O-C-N 116.473 -3.892 . . . . 0.0 113.748 -165.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.47 0 CA-C-O 123.326 1.536 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 13.1 mmt -63.01 -40.16 96.93 Favored 'General case' 0 N--CA 1.449 -0.496 1 O-C-N 115.948 -4.22 . . . . 0.0 112.885 176.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.01 -44.83 79.34 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.873 3.269 . . . . 0.0 111.545 -178.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -62.97 -30.93 71.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 120.791 1.632 . . . . 0.0 114.313 168.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -69.94 -36.56 75.39 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 114.555 -2.64 . . . . 0.0 111.314 172.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -72.71 -27.17 61.9 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 115.433 -2.222 . . . . 0.0 113.016 176.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -71.95 -36.6 69.92 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 124.822 3.465 . . . . 0.0 113.505 168.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -67.01 -37.14 83.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 117.103 -1.427 . . . . 0.0 110.302 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -72.84 -24.62 60.91 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 114.308 -2.758 . . . . 0.0 107.741 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 7.1 t-105 -69.5 -51.39 36.27 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 124.512 3.324 . . . . 0.0 108.965 169.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.65 -16.53 49.47 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 126.52 1.928 . . . . 0.0 115.441 177.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -64.03 -48.23 77.13 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.093 1.757 . . . . 0.0 110.733 173.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -56.54 -40.41 75.05 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.213 1.405 . . . . 0.0 113.185 173.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 14.0 t -80.61 -33.93 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 O-C-N 118.968 -2.332 . . . . 0.0 114.659 -178.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -66.78 -39.22 87.75 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.113 0.965 . . . . 0.0 113.067 169.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 25.4 tp -50.62 -63.38 1.14 Allowed 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 118.979 -2.326 . . . . 0.0 107.427 161.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.252 41.8 tp -59.72 -45.83 90.97 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 121.421 1.919 . . . . 0.0 115.244 -172.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -51.93 -43.17 63.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 116.828 2.159 . . . . 0.0 116.828 170.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -67.42 -37.5 83.14 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 116.677 2.103 . . . . 0.0 116.677 170.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.28 -38.37 52.39 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.498 1.919 . . . . 0.0 111.87 173.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -64.31 -48.14 76.76 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 128.176 2.591 . . . . 0.0 113.264 175.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -44.26 -31.86 1.13 Allowed 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 117.631 -3.168 . . . . 0.0 114.523 171.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -108.57 -3.84 17.68 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 129.46 3.104 . . . . 0.0 115.167 -175.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.33 4.9 m-20 60.28 10.68 2.48 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 -176.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -69.22 1.19 3.92 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 167.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -64.4 -44.7 90.46 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 115.868 -2.015 . . . . 0.0 114.97 -171.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 65.5 tp -72.58 -36.79 3.91 Favored Pre-proline 0 N--CA 1.447 -0.609 0 CA-C-N 121.631 2.014 . . . . 0.0 112.315 -173.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 0.8 OUTLIER -58.2 -29.35 87.24 Favored 'Trans proline' 0 N--CA 1.445 -1.349 0 N-CA-C 121.537 3.63 . . . . 0.0 121.537 161.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 27.2 tp -72.75 -35.29 67.47 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 172.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . 0.253 60.8 mt -73.61 -22.81 59.91 Favored 'General case' 0 N--CA 1.445 -0.677 1 O-C-N 115.717 -4.364 . . . . 0.0 114.456 176.502 . . . . . . . . 3 2 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -70.04 -33.41 71.93 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.836 0.854 . . . . 0.0 108.952 171.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 48.8 tp -84.26 -46.63 11.63 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.077 1.751 . . . . 0.0 106.343 -178.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 15.7 mmt -86.12 -17.41 35.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 123.861 0.726 . . . . 0.0 112.296 -161.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mp -126.34 138.4 53.57 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 120.867 -1.146 . . . . 0.0 112.521 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 46.8 p -78.64 161.52 69.05 Favored Pre-proline 0 N--CA 1.446 -0.626 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -46.68 -45.39 20.04 Favored 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 123.012 2.475 . . . . 0.0 114.261 175.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.48 -36.08 68.7 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 126.626 3.108 . . . . 0.0 117.338 177.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -90.56 -25.17 20.34 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 112.062 -2.336 . . . . 0.0 113.22 -178.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 62.8 mtm-85 -61.09 -35.11 76.11 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 119.421 3.119 . . . . 0.0 119.421 155.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -73.05 -35.65 66.75 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 126.332 2.27 . . . . 0.0 111.826 174.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.35 -53.73 53.85 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 115.442 -2.218 . . . . 0.0 110.358 167.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.282 33.1 mt -63.93 -52.34 60.24 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 121.595 1.998 . . . . 0.0 112.609 178.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.97 -27.12 12.68 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 118.456 2.142 . . . . 0.0 118.456 173.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 32.0 m -80.87 -50.63 9.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 116.132 -1.89 . . . . 0.0 112.806 163.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -53.18 -32.48 48.09 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 122.774 2.534 . . . . 0.0 110.104 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.4 -41.05 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 O-C-N 117.253 -3.404 . . . . 0.0 107.78 176.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -80.92 -26.34 36.83 Favored 'General case' 0 N--CA 1.449 -0.497 1 O-C-N 114.898 -4.876 . . . . 0.0 112.265 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 68.7 mt -65.58 -45.18 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 O-C-N 118.918 -2.364 . . . . 0.0 108.436 173.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 65.6 t -69.66 -36.92 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 O-C-N 117.943 -2.973 . . . . 0.0 108.92 -179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -61.92 -47.34 85.38 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 124.357 2.027 . . . . 0.0 113.834 169.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -74.92 -22.02 58.86 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 116.359 -3.963 . . . . 0.0 111.94 -177.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 79.8 mt -70.3 -14.83 62.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.764 0.826 . . . . 0.0 111.601 167.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 84.2 mt -106.77 -13.81 15.16 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.421 1.088 . . . . 0.0 113.511 177.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 20.4 ttm105 -87.41 -47.57 8.67 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.162 -2.836 . . . . 0.0 111.962 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 65.37 69.9 1.23 Allowed Glycine 0 C--N 1.334 0.465 1 O-C-N 130.018 4.574 . . . . 0.0 115.201 -175.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -139.39 -30.69 0.71 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 119.745 1.773 . . . . 0.0 113.511 176.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 33.2 mtt -81.62 134.67 35.51 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.132 2.271 . . . . 0.0 117.132 -172.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 83.0 p -81.88 168.6 17.76 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 128.574 3.671 . . . . 0.0 112.218 179.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -64.22 -17.25 63.38 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 121.291 1.859 . . . . 0.0 114.658 -175.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -74.03 -51.11 16.87 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 168.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -75.11 -22.56 58.14 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 116.619 -2.032 . . . . 0.0 115.981 -175.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.66 -45.48 85.47 Favored 'General case' 0 N--CA 1.451 -0.417 1 CA-C-O 131.311 5.339 . . . . 0.0 111.79 170.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -66.33 -28.32 68.58 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 117.958 -2.964 . . . . 0.0 113.021 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -87.29 -75.56 0.4 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 121.614 2.007 . . . . 0.0 116.241 167.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -56.58 -33.56 66.3 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 120.563 3.542 . . . . 0.0 120.563 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 29.5 mt -101.11 -8.75 21.98 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 120.014 1.279 . . . . 0.0 109.726 169.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.54 7.49 40.75 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-O 118.285 -1.286 . . . . 0.0 112.421 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.36 156.89 21.73 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 -174.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.17 158.2 52.17 Favored Glycine 0 C--N 1.334 0.434 0 CA-C-N 110.737 -2.938 . . . . 0.0 113.922 167.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 37.3 mm -71.16 -31.85 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 C-N-CA 124.331 1.052 . . . . 0.0 111.634 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.76 -43.81 90.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 120.368 -1.458 . . . . 0.0 114.169 165.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 3.5 m -54.19 -36.9 63.92 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 113.319 -3.229 . . . . 0.0 111.56 169.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 19.2 mm -73.0 -40.66 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 O-C-N 126.361 2.288 . . . . 0.0 105.265 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 32.2 m -74.85 -33.87 62.19 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 115.586 1.698 . . . . 0.0 115.586 -167.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -49.43 -44.1 45.15 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 114.634 -2.603 . . . . 0.0 112.478 155.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.4 -55.34 15.78 Favored Glycine 0 C--N 1.335 0.479 0 C-N-CA 126.387 1.946 . . . . 0.0 111.789 177.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 2.4 p -50.52 -37.37 38.78 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 123.574 3.687 . . . . 0.0 114.189 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -71.31 -35.69 71.36 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 119.741 -1.85 . . . . 0.0 115.57 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 44.3 m -67.3 -27.96 67.6 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 166.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.91 -42.67 66.44 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.156 1.535 . . . . 0.0 109.977 178.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -67.53 -38.91 84.91 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 172.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.14 -4.51 39.15 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 115.423 -2.227 . . . . 0.0 113.229 177.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.41 157.8 55.46 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 120.626 1.557 . . . . 0.0 111.331 -169.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -54.91 132.94 55.05 Favored 'Trans proline' 0 N--CA 1.45 -1.082 1 C-N-CA 125.841 4.361 . . . . 0.0 110.461 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.309 16.6 m -59.8 -26.39 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 116.158 1.91 . . . . 0.0 116.158 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.309 17.5 pm0 -49.57 -52.67 28.53 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 126.681 1.993 . . . . 0.0 114.53 165.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 17.4 tp -63.32 -42.82 99.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 124.894 2.283 . . . . 0.0 108.344 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 60.5 mtp85 -63.62 -47.4 81.53 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.855 -1.778 . . . . 0.0 113.858 -175.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -61.37 -37.92 85.14 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 115.584 -2.151 . . . . 0.0 115.009 170.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 16.7 t90 -70.68 -38.13 73.71 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 119.97 1.259 . . . . 0.0 108.519 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 26.1 mt -68.58 -37.49 79.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 119.826 1.194 . . . . 0.0 111.86 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -65.56 -38.71 90.34 Favored 'General case' 0 N--CA 1.445 -0.678 1 O-C-N 115.443 -4.535 . . . . 0.0 114.841 173.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -62.18 -55.21 30.87 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 118.893 -2.379 . . . . 0.0 112.181 164.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.23 -34.5 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 C-N-CA 123.139 0.575 . . . . 0.0 110.015 -164.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 87.9 mt -90.38 -49.72 6.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 118.688 2.847 . . . . 0.0 118.688 -176.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 19.1 mt -82.59 -34.31 27.71 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.488 1.613 . . . . 0.0 112.921 -166.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -67.3 -16.69 64.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.971 164.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 48.9 m -103.05 6.12 38.51 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.935 -2.978 . . . . 0.0 118.944 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.312 33.6 t70 . . . . . 0 C--O 1.25 1.084 0 N-CA-C 120.112 3.375 . . . . 0.0 120.112 -169.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 1' ' ' MET . . . . . . . . . . . . 0.257 6.1 mtt . . . . . 0 N--CA 1.469 0.516 0 CA-C-O 123.926 1.822 . . . . 0.0 106.951 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.94 179.25 7.82 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 125.745 1.618 . . . . 0.0 112.629 179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -151.28 119.25 6.22 Favored 'General case' 0 N--CA 1.448 -0.529 1 O-C-N 116.115 -4.116 . . . . 0.0 107.519 -171.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -108.3 149.47 28.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.443 -2.036 . . . . 0.0 107.685 171.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 25.0 p -129.94 148.16 68.45 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 103.476 -2.787 . . . . 0.0 103.476 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -53.6 -38.93 84.42 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.071 2.514 . . . . 0.0 118.12 -171.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -145.98 166.27 26.53 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 117.568 -3.208 . . . . 0.0 107.021 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 3.1 t -154.55 132.15 11.35 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 105.143 -2.169 . . . . 0.0 105.143 170.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.35 -41.33 89.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.44 1.496 . . . . 0.0 112.676 168.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.25 86.84 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 119.028 -2.295 . . . . 0.0 111.384 177.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 37.4 mtt -60.61 -35.6 76.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 120.046 -1.659 . . . . 0.0 113.086 171.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.76 -25.2 63.7 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.116 1.366 . . . . 0.0 113.659 168.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -71.02 -26.57 63.17 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 122.679 1.228 . . . . 0.0 109.036 171.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -77.29 -38.61 50.33 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.247 -2.783 . . . . 0.0 108.665 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -37.1 86.32 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 124.193 1.949 . . . . 0.0 112.039 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -62.76 -41.63 99.31 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 112.813 -1.994 . . . . 0.0 105.985 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 -69.95 -24.32 63.33 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 117.828 -3.045 . . . . 0.0 112.346 178.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -62.93 -48.41 79.04 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 126.088 2.851 . . . . 0.0 114.206 169.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 54.9 t-105 -55.58 -42.44 74.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 116.453 -3.904 . . . . 0.0 118.058 160.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 3.8 mp -63.08 -15.16 55.7 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 122.019 2.19 . . . . 0.0 115.975 167.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 43.6 ttt-85 -87.43 -32.55 19.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 122.539 1.162 . . . . 0.0 111.363 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -54.48 -42.65 70.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.449 -3.282 . . . . 0.0 113.112 157.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 17.1 t -78.79 -26.93 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 126.462 1.905 . . . . 0.0 107.115 -171.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -83.02 -29.38 28.94 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.418 0.687 . . . . 0.0 112.627 172.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 33.2 tp -68.26 -47.3 68.09 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 121.078 -1.014 . . . . 0.0 111.03 172.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 67.2 tp -68.36 -32.11 71.96 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -176.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -55.46 -53.37 57.19 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.825 -2.422 . . . . 0.0 109.381 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -68.3 -22.58 64.71 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 125.976 2.048 . . . . 0.0 116.051 174.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.89 -27.34 65.7 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 116.869 -3.645 . . . . 0.0 113.454 -177.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -61.23 -30.95 70.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 117.795 2.517 . . . . 0.0 117.795 167.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -71.91 -22.24 61.51 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 118.345 2.72 . . . . 0.0 118.345 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 51.0 p-10 -114.8 24.19 11.99 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 120.264 -1.522 . . . . 0.0 112.342 161.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.331 18.3 m-20 57.21 24.42 9.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.914 2.486 . . . . 0.0 114.767 173.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 mt -85.96 -12.44 50.43 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 173.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -40.39 -56.3 2.05 Favored 'General case' 0 N--CA 1.448 -0.529 1 O-C-N 115.621 -4.425 . . . . 0.0 114.035 174.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 81.0 mt -68.53 -48.13 33.94 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-O 116.802 -1.57 . . . . 0.0 111.925 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . 0.31 30.3 Cg_endo -55.69 -25.32 50.25 Favored 'Trans proline' 0 N--CA 1.449 -1.098 1 C-N-CA 127.279 5.32 . . . . 0.0 115.216 168.666 . . . . . . . . 3 2 . 1 . 015 nuclear orig core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -73.92 -48.15 32.78 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 123.178 2.717 . . . . 0.0 107.109 172.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 84.8 mt -63.99 -25.34 68.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 125.752 1.907 . . . . 0.0 114.723 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -68.19 -27.79 66.71 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 119.352 0.978 . . . . 0.0 112.809 165.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 14.2 tp -78.59 -55.18 5.39 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 126.634 3.112 . . . . 0.0 110.969 172.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 55.3 mmm -67.76 -18.25 64.81 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 121.679 3.955 . . . . 0.0 121.679 -168.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . 0.269 8.5 mp -131.5 165.37 23.72 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 117.971 -2.956 . . . . 0.0 106.156 -178.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 29.3 p -91.51 154.54 44.29 Favored Pre-proline 0 N--CA 1.449 -0.509 0 C-N-CA 124.935 1.294 . . . . 0.0 112.226 165.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_exo -49.71 -31.26 24.94 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 N-CA-C 115.596 1.345 . . . . 0.0 115.596 167.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.65 -24.92 60.06 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 176.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -76.68 -36.33 57.34 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 120.416 -1.427 . . . . 0.0 113.929 168.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . 0.252 90.3 mtm-85 -57.82 -37.69 74.25 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 115.193 -2.337 . . . . 0.0 109.856 176.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -70.41 -53.34 16.88 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 128.954 3.909 . . . . 0.0 109.319 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . 0.343 . . -44.88 -49.87 10.7 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 116.301 -3.999 . . . . 0.0 117.715 165.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 33.6 mt -63.81 -44.14 94.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 117.102 -1.427 . . . . 0.0 112.817 177.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.45 -26.59 69.65 Favored Glycine 0 CA--C 1.523 0.54 0 O-C-N 126.409 2.318 . . . . 0.0 111.309 -177.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 6.0 m -80.65 -32.95 36.01 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.41 -2.818 . . . . 0.0 114.241 173.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.25 91.1 mtt180 -71.71 -19.77 62.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 115.801 -2.047 . . . . 0.0 113.092 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 23.7 t -69.14 -40.79 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 C-N-CA 128.045 2.538 . . . . 0.0 109.977 162.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -68.75 -37.0 79.09 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 112.158 -3.782 . . . . 0.0 110.507 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 37.7 mt -60.39 -43.11 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 O-C-N 126.576 2.422 . . . . 0.0 109.25 175.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 47.4 t -67.48 -42.36 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 120.917 1.69 . . . . 0.0 111.297 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -51.0 -49.31 60.64 Favored 'General case' 0 N--CA 1.449 -0.514 1 C-N-CA 131.707 4.003 . . . . 0.0 114.479 166.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -64.56 -38.23 90.28 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 118.193 -2.817 . . . . 0.0 114.479 173.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 20.1 mt -78.23 -30.53 48.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 122.406 2.366 . . . . 0.0 109.642 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 35.1 mt -80.4 -22.21 41.5 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.56 -3.212 . . . . 0.0 114.443 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -66.76 -37.16 84.08 Favored 'General case' 0 N--CA 1.449 -0.494 1 C-N-CA 134.502 5.121 . . . . 0.0 110.218 169.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.25 19.75 64.42 Favored Glycine 0 CA--C 1.521 0.431 0 CA-C-O 116.629 -2.206 . . . . 0.0 114.423 177.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -96.83 -30.76 12.98 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -171.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 18.8 mmt -55.3 142.75 30.68 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 118.003 2.594 . . . . 0.0 118.003 166.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 30.7 p -95.18 170.17 9.58 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 129.543 3.137 . . . . 0.0 109.005 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.57 -35.21 75.52 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 116.19 -1.862 . . . . 0.0 113.014 -172.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 32.8 ttp180 -67.47 -41.73 84.15 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 120.935 1.698 . . . . 0.0 115.456 172.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.11 -35.53 64.15 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 -175.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 24.2 mt -57.99 -21.1 42.98 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.311 3.044 . . . . 0.0 110.341 169.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -106.34 -29.64 9.64 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 123.87 3.032 . . . . 0.0 112.688 175.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -97.78 -37.33 9.9 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 115.539 1.681 . . . . 0.0 115.539 -174.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -90.04 -43.47 10.49 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 119.438 -2.039 . . . . 0.0 109.939 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mp -86.04 9.03 18.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-O 124.275 1.988 . . . . 0.0 114.922 173.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 58.97 -142.13 46.62 Favored Glycine 0 C--N 1.337 0.597 1 C-N-CA 130.834 4.064 . . . . 0.0 112.238 161.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.36 -26.8 23.18 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 119.469 -2.195 . . . . 0.0 113.413 164.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.13 2.81 3.68 Favored Glycine 0 CA--C 1.525 0.713 1 CA-C-O 112.586 -4.452 . . . . 0.0 116.41 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tt -66.67 -40.38 86.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 120.748 2.274 . . . . 0.0 115.259 165.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.49 -23.78 52.01 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.474 2.31 . . . . 0.0 115.775 171.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 1.7 m -71.75 -28.32 63.58 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 119.885 -1.76 . . . . 0.0 112.704 169.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 9.2 mm -92.65 -22.91 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 1 O-C-N 115.525 -4.485 . . . . 0.0 117.127 -171.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 73.0 p -123.32 -1.23 8.68 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 118.177 2.658 . . . . 0.0 118.177 -164.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 69.1 mtp85 -125.8 158.93 33.74 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 129.021 2.929 . . . . 0.0 111.575 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 76.96 164.08 19.64 Favored Glycine 0 C--O 1.224 -0.497 0 O-C-N 121.168 -0.957 . . . . 0.0 112.807 -177.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 66.7 m -67.96 -7.98 33.25 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 112.205 -3.76 . . . . 0.0 117.016 -163.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -117.82 18.62 14.01 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 131.078 3.751 . . . . 0.0 112.697 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 17.0 p -68.38 178.19 2.07 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 20.4 tp -59.86 -38.59 82.56 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 118.468 -1.293 . . . . 0.0 112.338 -173.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.346 94.1 mttt -101.75 6.41 41.74 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 127.537 2.335 . . . . 0.0 117.027 -176.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -120.61 -9.07 9.44 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 125.189 1.396 . . . . 0.0 112.135 167.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.19 160.21 18.13 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-O 125.743 2.687 . . . . 0.0 112.276 164.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -58.57 125.68 19.06 Favored 'Trans proline' 0 N--CA 1.447 -1.217 1 C-N-CA 126.221 4.614 . . . . 0.0 110.5 -177.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 50.7 t -37.64 -41.08 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 125.851 1.66 . . . . 0.0 110.711 178.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.9 pm0 -74.88 -18.3 60.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 116.285 -1.817 . . . . 0.0 110.83 -174.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -81.43 -38.42 26.48 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 122.596 2.453 . . . . 0.0 110.694 165.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 68.0 mtp180 -59.37 -52.42 65.72 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 118.605 -2.559 . . . . 0.0 110.096 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -47.6 -54.23 12.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 126.241 2.213 . . . . 0.0 114.521 166.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -66.12 -42.1 89.66 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.316 -1.311 . . . . 0.0 114.046 -173.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 61.0 mt -61.49 -48.53 80.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.449 1.9 . . . . 0.0 108.984 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -45.67 -41.42 10.37 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 116.721 -3.737 . . . . 0.0 118.823 164.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -73.95 -32.62 63.57 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.607 1.163 . . . . 0.0 109.529 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 38.9 t -88.38 -46.42 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 -175.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 51.0 mt -82.84 -18.55 40.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 117.63 -3.169 . . . . 0.0 113.028 -158.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 35.0 mt -118.33 3.31 11.92 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 120.573 1.533 . . . . 0.0 114.797 -173.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.352 21.6 pttp . . . . . 0 N--CA 1.449 -0.479 0 C-N-CA 129.771 3.228 . . . . 0.0 111.53 -170.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 98.1 p . . . . . 0 N--CA 1.448 -0.539 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -92.24 -23.35 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.927 0 N-CA-C 116.717 1.776 . . . . 0.0 116.717 175.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -151.12 129.56 12.11 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.63 3.172 . . . . 0.0 106.377 -169.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.83 137.64 42.0 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 112.444 -2.162 . . . . 0.0 110.854 176.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.24 -30.98 69.77 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 120.255 -1.528 . . . . 0.0 111.377 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.56 -14.89 59.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 114.897 -2.478 . . . . 0.0 111.695 175.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 7.2 mmt -70.25 -27.37 64.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 121.782 2.083 . . . . 0.0 113.73 169.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.45 -41.66 72.54 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 120.622 -1.299 . . . . 0.0 112.291 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 21.4 tp10 -63.4 -36.22 83.0 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 113.591 -3.1 . . . . 0.0 107.014 170.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -73.92 -34.84 64.51 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 121.533 1.969 . . . . 0.0 107.797 -174.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.298 0.0 OUTLIER -65.63 -29.37 69.94 Favored 'General case' 0 N--CA 1.447 -0.62 1 O-C-N 114.432 -5.168 . . . . 0.0 113.728 -176.997 . . . . . . . . 4 3 . 1 . 015 nuclear orig core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -77.63 -29.72 51.89 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 167.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -73.87 -28.4 61.55 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 123.003 1.382 . . . . 0.0 111.04 -178.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -89.56 -18.1 27.25 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 120.325 -1.484 . . . . 0.0 107.652 -176.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 -76.06 -47.35 24.99 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 116.914 -1.517 . . . . 0.0 111.251 162.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.48 -35.38 80.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.196 2.295 . . . . 0.0 117.196 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -63.94 -26.31 68.53 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 118.143 -1.423 . . . . 0.0 113.982 170.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -62.85 -53.46 53.79 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 113.844 -2.979 . . . . 0.0 111.142 166.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.62 -35.09 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 121.179 1.809 . . . . 0.0 110.716 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.33 -41.3 81.0 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 170.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 13.4 tp -63.73 -48.66 76.13 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 53.7 tp -51.67 -48.12 63.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 115.36 -2.257 . . . . 0.0 116.402 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 19.5 ttpp -59.32 -52.32 66.17 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 125.397 1.685 . . . . 0.0 110.078 174.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -61.62 -33.83 74.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.713 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.75 -38.75 89.97 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 123.674 2.943 . . . . 0.0 114.975 171.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 30' ' ' TYR . . . . . 0.412 ' CD2' ' HD2' ' D' ' 35' ' ' HIS . 13.9 m-85 -61.65 -29.89 70.36 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 123.769 1.747 . . . . 0.0 115.535 172.033 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -81.28 -25.18 36.75 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -177.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . 0.329 54.3 p30 -102.74 3.74 37.24 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 120.56 -1.338 . . . . 0.0 114.011 164.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.254 1.7 m-20 63.72 26.5 14.51 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 128.744 2.818 . . . . 0.0 113.337 177.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 43.9 mt -93.71 16.86 12.94 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 165.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 35' ' ' HIS . . . . . 0.412 ' HD2' ' CD2' ' D' ' 30' ' ' TYR . 0.0 OUTLIER -52.22 -58.42 6.67 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 126.972 2.109 . . . . 0.0 110.152 174.254 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.415 22.6 mt -41.87 -63.86 0.78 Allowed Pre-proline 0 N--CA 1.448 -0.549 0 C-N-CA 128.05 2.54 . . . . 0.0 110.964 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -58.87 -36.65 96.6 Favored 'Trans proline' 0 N--CA 1.451 -0.992 0 CA-C-O 114.81 -2.246 . . . . 0.0 115.916 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 33.1 tp -56.0 -54.41 45.16 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 125.226 3.648 . . . . 0.0 112.292 171.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 88.6 mt -62.55 -31.63 72.45 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 115.846 -2.026 . . . . 0.0 110.652 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -74.71 -28.35 60.76 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 117.236 -1.786 . . . . 0.0 114.474 170.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -74.07 -51.9 14.31 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 118.44 -2.662 . . . . 0.0 108.615 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 24.8 mmt -63.36 -43.63 97.11 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 113.827 -2.987 . . . . 0.0 116.664 173.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 61.4 mt -121.26 142.58 49.79 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 124.81 3.459 . . . . 0.0 107.144 -166.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 38.9 p -77.65 159.26 77.19 Favored Pre-proline 0 N--CA 1.444 -0.738 0 C-N-CA 129.848 3.259 . . . . 0.0 115.729 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -41.84 -50.35 5.08 Favored 'Trans proline' 0 N--CA 1.451 -0.99 0 O-C-N 125.052 2.08 . . . . 0.0 114.341 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -73.53 -20.63 60.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 122.285 2.311 . . . . 0.0 116.288 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -70.32 -38.27 74.87 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 123.321 2.782 . . . . 0.0 109.946 170.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 26.0 mtm-85 -74.16 -36.6 64.11 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 118.36 2.726 . . . . 0.0 118.36 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.44 -45.62 84.5 Favored 'General case' 0 N--CA 1.447 -0.62 0 O-C-N 128.672 3.732 . . . . 0.0 114.018 161.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.77 -36.68 62.56 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 117.174 2.287 . . . . 0.0 117.174 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 47.4 mt -62.18 -32.02 72.6 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 120.063 -1.648 . . . . 0.0 107.671 171.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.93 -41.69 71.39 Favored Glycine 0 C--N 1.338 0.677 0 O-C-N 119.109 -2.244 . . . . 0.0 112.365 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 24.8 m -62.77 -31.52 72.5 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.05 2.14 . . . . 0.0 112.971 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -71.6 -24.68 61.94 Favored 'General case' 0 N--CA 1.448 -0.544 1 O-C-N 116.134 -4.104 . . . . 0.0 111.834 -177.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.66 -43.26 98.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 O-C-N 118.694 -2.504 . . . . 0.0 111.044 170.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.357 3.7 ptm180 -81.92 -25.63 34.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 172.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 54.0 mt -67.0 -32.84 59.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 122.024 0.129 . . . . 0.0 110.775 170.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 57.9 t -68.94 -48.25 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.69 165.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -70.15 -27.1 64.27 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 117.721 -1.592 . . . . 0.0 115.095 -174.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -74.96 -7.93 55.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 116.242 -1.837 . . . . 0.0 113.898 165.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.13 -7.75 55.1 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 121.691 2.041 . . . . 0.0 114.288 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 44.0 mt -97.65 -35.75 10.49 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 165.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -75.33 -32.41 60.9 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 112.08 -3.819 . . . . 0.0 111.768 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 47.03 55.4 8.57 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 121.042 3.177 . . . . 0.0 121.042 168.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -130.73 -30.19 1.86 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.082 1.353 . . . . 0.0 107.579 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 22.5 mmt -94.88 51.83 1.42 Allowed 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.844 2.458 . . . . 0.0 106.18 172.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 59.1 p -66.34 171.01 5.21 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 112.194 -2.276 . . . . 0.0 115.277 -169.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.303 6.6 tp-100 49.86 -89.28 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.73 1.612 . . . . 0.0 114.774 166.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -80.82 -35.14 33.3 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.273 -2.767 . . . . 0.0 110.238 -172.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -78.24 -31.69 49.37 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 126.459 1.904 . . . . 0.0 112.294 -172.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mt -51.67 -31.1 24.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.82 1.648 . . . . 0.0 113.566 168.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -104.63 -38.65 6.65 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 128.055 2.542 . . . . 0.0 108.43 -172.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -111.33 -14.32 13.8 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 121.982 2.174 . . . . 0.0 113.141 -164.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -118.32 -24.66 6.82 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 113.346 -3.216 . . . . 0.0 115.555 167.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -83.86 -27.55 28.61 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.332 2.333 . . . . 0.0 110.752 162.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 95.13 -175.34 33.44 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 129.64 3.495 . . . . 0.0 115.647 169.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.293 . . -68.64 -10.73 57.9 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 119.887 -1.949 . . . . 0.0 115.803 -164.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.39 -23.82 43.35 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 127.415 2.436 . . . . 0.0 111.094 169.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -46.5 -33.56 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 175.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -100.67 -4.56 28.08 Favored 'General case' 0 N--CA 1.45 -0.452 1 O-C-N 116.085 -4.135 . . . . 0.0 114.678 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 53.3 m -67.86 -33.45 74.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 120.19 1.359 . . . . 0.0 109.75 148.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.389 41.1 mm -85.85 -24.32 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 C-N-CA 131.449 3.899 . . . . 0.0 112.597 -168.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 66.7 p -129.55 6.68 5.23 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 112.106 -2.315 . . . . 0.0 115.203 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -134.16 177.21 7.92 Favored 'General case' 0 N--CA 1.452 -0.354 1 O-C-N 114.616 -5.053 . . . . 0.0 108.318 165.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 84.03 157.59 25.92 Favored Glycine 0 C--N 1.337 0.587 0 O-C-N 117.043 -3.536 . . . . 0.0 111.634 -147.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 38.7 p -72.09 -26.78 62.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 118.888 2.922 . . . . 0.0 118.888 -166.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -133.54 85.81 2.24 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 124.925 2.298 . . . . 0.0 109.62 -170.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 59.5 p -131.25 -169.28 2.15 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.644 2.778 . . . . 0.0 109.301 175.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.392 5.4 mp -87.85 27.85 1.1 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 124.091 1.9 . . . . 0.0 109.886 -177.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -107.17 10.59 30.0 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 119.879 -1.763 . . . . 0.0 115.006 147.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -144.65 -3.81 0.79 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 112.414 -3.66 . . . . 0.0 109.818 -162.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 92' ' ' ALA . . . . . 0.421 ' HA ' ' N ' ' D' ' 94' ' ' VAL . . . 66.01 85.85 0.15 Allowed Pre-proline 0 N--CA 1.448 -0.564 0 CA-C-N 124.676 3.398 . . . . 0.0 117.91 169.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.309 0.0 OUTLIER 30.42 23.23 0.0 OUTLIER 'Cis proline' 0 N--CA 1.451 -1.018 0 N-CA-C 121.107 3.464 . . . . 0.0 121.107 17.373 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' D' D ' 94' ' ' VAL . . . . . 0.421 ' N ' ' HA ' ' D' ' 92' ' ' ALA . 15.1 t -65.74 -31.91 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 119.571 1.078 . . . . 0.0 110.526 161.031 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.358 0.0 OUTLIER -78.52 -36.76 44.38 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 128.716 2.806 . . . . 0.0 109.607 -178.769 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . 0.286 16.3 tp -55.96 -57.41 12.2 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.718 168.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 26.4 ttp-105 -49.09 -40.57 32.46 Favored 'General case' 0 N--CA 1.451 -0.381 1 CA-C-O 110.793 -4.432 . . . . 0.0 115.75 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -62.35 -24.12 67.17 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 127.7 3.125 . . . . 0.0 115.183 177.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -98.22 -35.12 10.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.661 -3.149 . . . . 0.0 110.84 175.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 48.0 mt -53.46 -39.74 64.71 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 120.631 1.559 . . . . 0.0 114.839 168.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . 0.297 15.5 tt0 -80.05 -13.13 59.54 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 117.016 -1.874 . . . . 0.0 107.986 -176.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -104.59 4.76 33.18 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 119.244 -2.16 . . . . 0.0 113.611 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 2.5 t -123.49 -27.06 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 114.401 -2.714 . . . . 0.0 113.73 162.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 29.0 mt -92.99 -27.39 17.05 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 123.985 3.084 . . . . 0.0 118.261 166.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.313 74.7 mt -114.66 30.45 7.32 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 122.615 2.462 . . . . 0.0 107.628 172.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -61.49 174.71 0.7 Allowed 'General case' 0 N--CA 1.449 -0.481 1 C-N-CA 131.993 4.117 . . . . 0.0 111.626 -174.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 14.6 m -58.13 -38.1 75.89 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 112.776 -2.011 . . . . 0.0 113.655 -169.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.953 2.501 . . . . 0.0 115.423 -174.478 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ttp . . . . . 0 N--CA 1.467 0.411 0 N-CA-C 117.144 2.276 . . . . 0.0 117.144 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . 0.256 . . -58.11 -27.95 64.19 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 121.622 2.01 . . . . 0.0 114.75 -176.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -45.92 -51.51 13.12 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 128.195 2.598 . . . . 0.0 112.727 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -64.07 -30.52 71.59 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 111.747 -2.479 . . . . 0.0 113.134 -174.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.3 p -90.29 175.73 3.53 Favored Pre-proline 0 N--CA 1.447 -0.599 0 CA-C-O 117.284 -1.341 . . . . 0.0 114.598 -165.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -74.11 -33.99 5.4 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 123.028 2.486 . . . . 0.0 112.785 -169.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -133.7 128.3 34.67 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 119.11 -2.244 . . . . 0.0 110.4 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 24.1 t -104.41 114.75 29.19 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 118.514 -2.617 . . . . 0.0 112.956 168.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.39 -4.05 56.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 115.612 -2.137 . . . . 0.0 115.046 168.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.265 . . -86.79 -42.35 13.36 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 115.834 -2.031 . . . . 0.0 108.376 177.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.1 ttm -64.56 -33.29 75.56 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 121.859 2.118 . . . . 0.0 109.299 173.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.2 -39.98 84.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.973 1.471 . . . . 0.0 114.973 171.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -74.42 -46.52 39.57 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -54.37 -52.94 60.07 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 118.968 0.804 . . . . 0.0 112.173 176.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -60.2 -37.0 78.92 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 173.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 40.5 t60 -62.71 -48.99 76.86 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 115.321 -2.276 . . . . 0.0 113.762 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -66.78 -36.57 82.71 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 121.127 1.785 . . . . 0.0 113.889 175.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -58.69 -33.47 70.19 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 117.47 -3.269 . . . . 0.0 110.963 169.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -77.74 -40.81 39.86 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 117.881 2.549 . . . . 0.0 117.881 175.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.8 mt -63.08 -17.88 62.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 117.825 2.528 . . . . 0.0 117.825 172.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -62.21 -52.28 64.42 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 115.275 -2.298 . . . . 0.0 109.991 167.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -53.47 -46.14 69.84 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 127.346 2.904 . . . . 0.0 108.358 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.8 t -72.46 -19.86 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 O-C-N 117.056 -3.527 . . . . 0.0 116.767 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -83.77 -39.02 20.57 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 117.516 -3.24 . . . . 0.0 112.543 163.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.4 tp -49.11 -52.28 26.88 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 124.466 2.079 . . . . 0.0 112.838 170.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.8 tp -81.24 -16.5 52.49 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 118.14 -2.85 . . . . 0.0 108.792 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -64.27 -49.85 70.25 Favored 'General case' 0 N--CA 1.449 -0.481 1 CA-C-N 126.014 4.006 . . . . 0.0 108.771 168.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 58.0 m-20 -71.34 -15.08 62.38 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 118.47 -2.644 . . . . 0.0 112.832 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.17 -36.8 61.45 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 115.265 -2.303 . . . . 0.0 115.457 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -63.0 -37.22 86.3 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.217 2.207 . . . . 0.0 116.003 170.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -67.16 -9.54 41.02 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 113.071 -1.877 . . . . 0.0 114.151 171.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -120.71 4.59 10.57 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.723 -2.486 . . . . 0.0 112.6 173.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.322 13.2 m-20 56.93 29.39 16.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 116.385 1.995 . . . . 0.0 116.385 -170.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.7 mt -102.71 0.61 33.26 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 117.802 -3.061 . . . . 0.0 115.3 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 36.5 p-80 -57.24 -45.75 83.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.927 2.091 . . . . 0.0 110.983 173.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.354 77.2 mt -55.44 -51.44 79.95 Favored Pre-proline 0 N--CA 1.445 -0.69 2 O-C-N 115.938 -4.226 . . . . 0.0 113.368 178.064 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -77.73 -37.77 0.83 Allowed 'Trans proline' 0 N--CA 1.449 -1.126 0 CA-C-O 115.634 -1.903 . . . . 0.0 108.95 -176.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.6 tp -58.6 -40.79 84.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 120.035 1.289 . . . . 0.0 113.562 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.62 -36.98 73.76 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 116.031 -1.938 . . . . 0.0 113.376 174.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -62.16 -23.15 66.42 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 119.469 3.137 . . . . 0.0 119.469 166.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.0 tp -74.25 -48.3 29.56 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 125.872 1.982 . . . . 0.0 115.7 166.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 79.0 mmm -77.29 -8.78 58.19 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.384 -1.293 . . . . 0.0 113.692 -167.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 53.2 mt -144.51 128.84 17.86 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 125.245 1.591 . . . . 0.0 113.741 -166.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 62.3 p -71.78 152.38 93.31 Favored Pre-proline 0 N--CA 1.446 -0.644 0 CA-C-O 122.281 1.038 . . . . 0.0 109.528 176.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -62.38 -13.07 30.55 Favored 'Trans proline' 0 N--CA 1.446 -1.297 0 C-N-CA 122.607 2.205 . . . . 0.0 114.398 -174.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.97 -27.17 18.86 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 119.406 -2.059 . . . . 0.0 112.205 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.81 -46.39 78.81 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 158.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 60.8 mtm-85 -63.2 -40.82 98.59 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 117.971 -1.492 . . . . 0.0 111.286 -178.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -62.03 -36.69 82.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 166.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.24 -25.78 66.26 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 117.322 -3.361 . . . . 0.0 113.798 173.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.1 mt -76.81 -40.9 46.42 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 124.956 2.313 . . . . 0.0 115.348 -177.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -47.23 -56.42 7.99 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 110.85 -2.886 . . . . 0.0 117.065 161.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.1 m -71.86 -35.2 69.74 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 112.542 -1.829 . . . . 0.0 114.311 175.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 60.4 mtt180 -61.75 -34.96 76.78 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 121.229 1.831 . . . . 0.0 111.275 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.4 t -59.29 -42.13 86.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 O-C-N 117.126 -3.484 . . . . 0.0 109.241 171.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -72.73 -26.32 61.53 Favored 'General case' 0 N--CA 1.449 -0.492 1 O-C-N 115.461 -4.525 . . . . 0.0 112.033 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 52.7 mt -67.6 -47.04 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 117.126 -1.416 . . . . 0.0 107.696 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.4 t -62.99 -38.57 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-O 116.412 -1.756 . . . . 0.0 112.069 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -61.84 -49.62 75.54 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 125.127 3.603 . . . . 0.0 112.704 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -76.08 -18.07 59.35 Favored 'General case' 0 N--CA 1.448 -0.546 1 CA-C-O 111.047 -4.311 . . . . 0.0 114.18 -173.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.9 mt -77.55 -33.02 54.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 124.944 3.52 . . . . 0.0 111.795 160.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.2 mt -78.1 -26.42 48.03 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 119.566 -0.854 . . . . 0.0 112.189 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -85.42 -30.99 23.13 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 123.682 1.706 . . . . 0.0 114.855 172.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.25 25.32 61.77 Favored Glycine 0 C--N 1.339 0.718 0 O-C-N 117.203 -3.436 . . . . 0.0 115.749 161.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -110.88 -36.46 5.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 120.544 2.172 . . . . 0.0 110.047 -170.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 55.6 mtp -64.08 139.76 58.8 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 174.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 54.0 p -83.83 173.36 11.33 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 111.793 -2.458 . . . . 0.0 111.442 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -70.72 -28.61 64.86 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 177.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.45 ' NH2' HD22 ' A' ' 73' ' ' ASN . 34.7 ttt85 -80.74 -34.79 34.09 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 114.083 -2.865 . . . . 0.0 107.656 175.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -65.37 -42.93 92.2 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 120.71 1.595 . . . . 0.0 108.761 175.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 40.4 mt -68.13 -20.26 64.89 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 123.083 2.674 . . . . 0.0 110.02 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -87.33 -38.82 15.89 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 120.787 1.63 . . . . 0.0 108.659 -177.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.45 HD22 ' NH2' ' A' ' 69' ' ' ARG . 7.5 m120 -77.11 -30.9 55.47 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 117.002 2.223 . . . . 0.0 117.002 174.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -101.59 -37.9 8.18 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 121.265 1.848 . . . . 0.0 112.215 -170.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.8 mt -106.75 -8.55 16.77 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 130.348 3.459 . . . . 0.0 115.22 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 88.28 -15.43 56.33 Favored Glycine 0 CA--C 1.526 0.742 0 O-C-N 120.033 -1.667 . . . . 0.0 114.717 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.48 119.6 16.92 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 126.833 2.053 . . . . 0.0 115.5 -159.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.59 179.15 26.67 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 119.377 2.511 . . . . 0.0 119.377 172.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 76.1 mt -53.15 -47.86 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 117.838 -1.077 . . . . 0.0 108.141 163.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.36 -49.48 72.15 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -176.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.1 m -65.5 -48.84 71.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.814 0.816 . . . . 0.0 110.958 -167.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.6 mm -65.51 -26.8 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 124.663 2.173 . . . . 0.0 114.917 175.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 55.9 m -71.62 -40.3 69.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 119.433 -2.042 . . . . 0.0 111.075 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 60.9 ttt180 -79.17 -31.45 43.9 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 127.799 2.439 . . . . 0.0 106.15 -176.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -58.37 -55.06 32.79 Favored Glycine 0 CA--C 1.521 0.436 0 O-C-N 120.013 -1.679 . . . . 0.0 112.307 165.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.6 m -69.2 -19.61 63.98 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -81.82 -38.92 24.77 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 116.316 -3.99 . . . . 0.0 107.239 174.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.3 m -66.02 -28.61 68.99 Favored 'General case' 0 N--CA 1.451 -0.415 1 O-C-N 116.192 -4.067 . . . . 0.0 116.589 171.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.85 -42.03 22.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 117.55 -3.219 . . . . 0.0 107.997 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -62.85 -27.08 69.09 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 125.328 1.643 . . . . 0.0 114.274 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.56 -17.25 20.59 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 126.043 1.737 . . . . 0.0 112.792 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.57 153.08 11.07 Favored Pre-proline 0 N--CA 1.45 -0.443 0 O-C-N 119.032 -2.293 . . . . 0.0 113.959 165.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -76.42 155.94 36.63 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 N-CA-C 109.279 -1.085 . . . . 0.0 109.279 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.5 m -66.57 -37.32 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-O 126.397 2.999 . . . . 0.0 113.578 -175.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.4 pm0 -62.46 -19.18 63.27 Favored 'General case' 0 N--CA 1.447 -0.598 1 O-C-N 114.939 -4.851 . . . . 0.0 116.947 170.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 50.8 tp -83.08 -38.67 22.18 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 124.378 1.049 . . . . 0.0 111.805 169.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -73.56 -34.29 65.09 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 117.932 -1.507 . . . . 0.0 109.525 -175.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -68.43 -33.43 74.19 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.418 ' CE2' HG22 ' A' ' 103' ' ' VAL . 84.0 t90 -81.7 -26.83 34.31 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.871 2.068 . . . . 0.0 112.711 -176.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 75.6 mt -69.92 -44.97 68.56 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 116.609 -3.807 . . . . 0.0 115.75 164.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -64.34 -2.85 2.42 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 163.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -91.08 -62.94 1.34 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 119.584 -0.847 . . . . 0.0 109.42 154.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.418 HG22 ' CE2' ' A' ' 99' ' ' TRP . 77.9 t -66.98 -35.81 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-O 118.096 -0.954 . . . . 0.0 109.032 -154.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 33.1 mt -96.01 -7.02 37.5 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 117.698 -3.127 . . . . 0.0 110.794 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 50.4 mt -124.32 7.61 8.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 123.452 2.842 . . . . 0.0 111.857 -172.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.286 60.1 tttt -107.54 -15.89 14.49 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 117.133 -3.479 . . . . 0.0 114.635 -177.082 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.5 t -75.19 -32.31 61.19 Favored 'General case' 0 N--CA 1.45 -0.449 1 N-CA-C 123.13 4.493 . . . . 0.0 123.13 175.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 . . . . . 0 C--O 1.249 1.072 1 C-N-CA 132.539 4.336 . . . . 0.0 114.512 166.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 39.8 ttp . . . . . 0 N--CA 1.473 0.725 0 CA-C-O 116.205 -1.855 . . . . 0.0 115.602 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.41 -26.42 64.62 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 122.544 2.429 . . . . 0.0 115.233 -159.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -76.89 -13.52 59.98 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 124.797 1.311 . . . . 0.0 111.64 173.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -95.59 -30.74 13.64 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 120.261 -1.524 . . . . 0.0 108.145 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 16.0 m -67.63 149.92 98.08 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.664 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -72.05 -16.55 28.81 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 CA-C-O 112.809 -3.08 . . . . 0.0 115.988 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -142.9 142.66 31.79 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 124.255 3.207 . . . . 0.0 113.414 161.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 30.2 t -125.09 110.22 13.87 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.561 1.945 . . . . 0.0 111.227 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.02 -21.5 54.5 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 119.553 -1.967 . . . . 0.0 114.313 173.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.52 -40.56 68.72 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 118.493 2.775 . . . . 0.0 118.493 163.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 26.2 ttm -76.68 -29.63 56.4 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 113.808 -2.996 . . . . 0.0 109.948 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . 0.295 . . -62.22 -44.15 97.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 123.364 2.802 . . . . 0.0 110.588 170.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -61.6 -56.43 19.99 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 115.976 -1.964 . . . . 0.0 112.45 170.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -45.6 -43.1 11.96 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 171.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . 0.26 39.4 mmt180 -70.13 -42.05 73.11 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 119.246 -2.159 . . . . 0.0 115.706 171.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -57.59 -41.88 82.07 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 117.326 -3.359 . . . . 0.0 112.588 171.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -75.51 -25.21 57.06 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 113.519 -3.134 . . . . 0.0 115.093 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -59.15 -45.58 90.6 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 122.682 2.492 . . . . 0.0 115.574 158.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 53.2 t-105 -64.04 -52.6 58.66 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.586 2.354 . . . . 0.0 116.811 175.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 89.1 mt -56.16 -31.67 63.6 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 117.295 -3.378 . . . . 0.0 111.625 169.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -69.84 -32.08 70.3 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 122.324 2.329 . . . . 0.0 106.748 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -65.24 -48.46 73.21 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 117.317 -1.325 . . . . 0.0 112.669 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 95.9 t -60.2 -49.84 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 CA-C-O 112.362 -3.685 . . . . 0.0 112.259 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -50.58 -45.92 57.54 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 124.892 3.496 . . . . 0.0 114.845 167.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 24.5 tp -56.92 -45.97 82.32 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 27.2 tp -73.44 -26.63 61.02 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 47.2 tttt -73.0 -43.26 62.36 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 116.763 -1.589 . . . . 0.0 110.125 176.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -62.42 -44.01 97.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 164.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.8 70.21 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 119.55 -1.969 . . . . 0.0 112.64 -175.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -68.38 -30.56 69.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.456 -2.652 . . . . 0.0 111.132 171.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -80.92 -4.34 54.6 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.118 -0.989 . . . . 0.0 113.291 174.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . 0.265 1.1 m-80 -124.67 13.27 8.65 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 116.304 -1.808 . . . . 0.0 113.237 170.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 53.76 23.43 3.73 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 117.064 2.246 . . . . 0.0 117.064 -175.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.1 mt -98.72 15.48 25.16 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 126.512 2.382 . . . . 0.0 112.313 172.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -74.4 -41.65 60.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 123.189 2.722 . . . . 0.0 113.534 -168.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 20.5 mt -69.99 -44.98 22.59 Favored Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-O 117.344 -1.312 . . . . 0.0 113.001 176.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.48 -46.21 30.56 Favored 'Trans proline' 0 N--CA 1.452 -0.968 0 CA-C-N 124.257 2.556 . . . . 0.0 113.475 170.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 61.2 tp -56.87 -52.23 65.93 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 127.187 2.195 . . . . 0.0 113.268 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 29.9 mt -60.48 -35.34 75.68 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 116.013 -1.946 . . . . 0.0 115.625 178.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -70.78 -32.3 69.37 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 128.336 2.655 . . . . 0.0 113.39 171.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 57.8 tp -67.55 -36.18 80.47 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 121.903 -0.498 . . . . 0.0 112.107 165.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 96.7 mmm -90.64 -24.77 20.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 121.553 3.909 . . . . 0.0 121.553 -178.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 10.1 mt -125.69 131.63 52.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 114.3 -2.762 . . . . 0.0 109.28 -176.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.252 73.0 p -71.55 153.69 93.54 Favored Pre-proline 0 N--CA 1.447 -0.583 0 O-C-N 128.545 3.653 . . . . 0.0 118.979 175.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_exo -44.87 -45.25 14.0 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.53 2.82 . . . . 0.0 108.568 -175.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -41.45 80.81 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.011 2.069 . . . . 0.0 114.376 -177.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.12 -39.46 90.09 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.084 2.153 . . . . 0.0 110.975 171.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 48.4 mtm-85 -71.38 -41.82 69.2 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.86 1.664 . . . . 0.0 110.891 -177.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.271 37.1 tt0 -68.88 -31.49 70.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 174.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.47 -35.91 73.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.812 -1.089 . . . . 0.0 111.527 172.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -75.06 -33.1 61.67 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 116.505 -3.872 . . . . 0.0 112.899 176.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.75 -29.8 75.26 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 117.453 -2.308 . . . . 0.0 116.32 172.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 99.3 m -80.56 -33.27 36.29 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 126.83 2.135 . . . . 0.0 109.278 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -59.65 -30.7 68.92 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 118.366 2.728 . . . . 0.0 118.366 173.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 9.4 t -65.75 -45.63 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 174.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -70.29 -31.61 69.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.108 -1.425 . . . . 0.0 112.988 177.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 68.5 mt -68.03 -39.67 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 123.311 2.778 . . . . 0.0 109.537 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.388 78.5 t -78.38 -41.07 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 128.057 2.543 . . . . 0.0 112.982 -175.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -48.57 -46.88 39.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 123.384 1.564 . . . . 0.0 109.898 167.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -76.73 -35.73 57.6 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 119.435 -2.041 . . . . 0.0 109.705 -171.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 39.5 mt -67.39 -17.38 64.71 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.801 -1.571 . . . . 0.0 111.945 174.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 70.4 mt -94.19 -29.76 14.95 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 114.429 -2.701 . . . . 0.0 114.428 168.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 26.2 ttm105 -72.23 -37.2 69.24 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 130.286 3.434 . . . . 0.0 109.745 173.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.98 18.59 64.73 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 128.52 2.962 . . . . 0.0 117.919 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -115.71 54.18 0.82 Allowed 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 129.93 3.959 . . . . 0.0 115.351 -171.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 6.8 mtt -144.71 146.62 32.3 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 129.52 3.128 . . . . 0.0 111.956 164.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 91.4 p -81.16 175.57 10.53 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 161.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -64.85 -38.58 91.46 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 119.487 -2.008 . . . . 0.0 112.055 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 20.0 ttt85 -56.01 -54.3 46.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 122.373 1.082 . . . . 0.0 113.235 174.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -58.16 -48.86 78.97 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.486 1.915 . . . . 0.0 112.937 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.41 -34.83 77.52 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 118.338 -2.726 . . . . 0.0 116.995 166.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 tptt -66.63 -36.02 81.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 121.627 2.012 . . . . 0.0 110.507 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -102.35 -45.15 5.18 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 120.876 -1.14 . . . . 0.0 108.997 -162.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -87.36 -34.72 18.71 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -171.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 63.7 mt -109.97 -10.93 14.7 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 117.23 2.308 . . . . 0.0 117.23 173.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.04 21.79 70.08 Favored Glycine 0 CA--C 1.526 0.73 0 C-N-CA 126.837 2.161 . . . . 0.0 111.614 177.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -103.74 96.17 6.52 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 122.423 3.111 . . . . 0.0 111.006 -177.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.37 178.61 41.28 Favored Glycine 0 C--N 1.335 0.489 0 O-C-N 126.127 2.142 . . . . 0.0 110.212 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 19.8 mt -42.12 -54.87 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 114.331 -0.935 . . . . 0.0 111.639 174.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.41 -56.0 11.15 Favored 'General case' 0 N--CA 1.451 -0.378 1 N-CA-C 121.856 4.021 . . . . 0.0 121.856 177.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 17.3 m -58.71 -47.17 85.47 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 173.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 40.7 mm -52.81 -45.61 50.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 124.581 1.152 . . . . 0.0 113.279 166.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 3.5 m -61.94 -36.92 82.83 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 123.962 1.839 . . . . 0.0 112.404 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -84.3 -27.96 27.45 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 117.578 -3.201 . . . . 0.0 109.456 -174.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.17 -38.89 28.53 Favored Glycine 0 C--N 1.334 0.434 0 O-C-N 118.435 -2.666 . . . . 0.0 111.694 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 18.8 m -65.03 -49.41 70.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 129.311 3.044 . . . . 0.0 107.658 175.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -52.55 -50.02 63.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 127.558 2.343 . . . . 0.0 111.313 170.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 13.5 m -66.06 -33.45 75.83 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.961 -1.712 . . . . 0.0 114.246 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 13.4 mt -61.45 -42.56 98.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 123.798 0.839 . . . . 0.0 112.861 167.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 39.3 mttm -65.73 -38.31 88.79 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 125.509 1.755 . . . . 0.0 113.551 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.06 -25.41 62.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.954 1.701 . . . . 0.0 111.875 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.38 165.74 6.46 Favored Pre-proline 0 N--CA 1.45 -0.464 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -69.11 162.1 43.12 Favored 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.788 2.326 . . . . 0.0 112.645 168.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 m -74.67 -30.56 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 O-C-N 119.109 -2.245 . . . . 0.0 111.156 171.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -70.85 -20.02 62.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.481 2.312 . . . . 0.0 111.254 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 13.3 tp -75.88 -56.46 4.65 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 114.538 -2.649 . . . . 0.0 110.1 167.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 92.9 mtm-85 -56.51 -46.67 80.41 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 121.22 1.827 . . . . 0.0 109.893 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -59.25 -30.35 68.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.729 -176.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 80.5 t90 -96.89 -33.09 11.74 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.066 -2.271 . . . . 0.0 112.488 -173.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.55 -33.38 73.75 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 118.664 -1.214 . . . . 0.0 111.798 166.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.7 -32.49 74.08 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 117.284 2.327 . . . . 0.0 117.284 171.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -75.32 -16.59 60.4 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 112.732 -2.031 . . . . 0.0 115.319 169.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 48.7 t -103.26 -41.14 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 O-C-N 117.069 -3.519 . . . . 0.0 115.416 171.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 88.6 mt -85.07 -35.47 21.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 121.903 2.138 . . . . 0.0 115.266 -168.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 33.2 mt -101.62 -10.34 20.14 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 118.828 -2.42 . . . . 0.0 109.543 -171.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -77.88 -7.69 57.06 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.339 1.855 . . . . 0.0 112.308 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . 0.25 14.4 m -89.36 -17.68 28.38 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.67 2.388 . . . . 0.0 116.549 178.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.27 70.4 m-20 . . . . . 0 C--O 1.248 0.986 0 C-N-CA 129.183 2.993 . . . . 0.0 109.129 171.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 62.4 ttp . . . . . 0 N--CA 1.474 0.751 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.92 168.96 11.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 120.491 1.496 . . . . 0.0 107.051 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -133.4 149.53 51.82 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.499 -2.626 . . . . 0.0 109.789 176.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -157.22 138.71 13.9 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 105.834 -1.913 . . . . 0.0 105.834 -177.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 32.6 p -139.91 171.4 7.94 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 130.62 3.568 . . . . 0.0 111.808 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -50.05 -33.42 34.72 Favored 'Trans proline' 0 N--CA 1.446 -1.278 0 N-CA-C 119.477 2.837 . . . . 0.0 119.477 174.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -151.02 148.06 27.89 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 115.851 -2.023 . . . . 0.0 107.109 -161.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 26.0 t -150.55 131.37 14.13 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.06 -23.66 60.59 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 114.653 -2.594 . . . . 0.0 113.269 167.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.85 -35.04 78.64 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 113.026 -3.369 . . . . 0.0 114.426 169.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 53.9 mtt -68.98 -43.23 75.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 127.178 2.799 . . . . 0.0 108.635 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . 0.254 . . -57.2 -37.62 72.48 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 174.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -64.96 -28.31 69.43 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 117.438 -3.289 . . . . 0.0 116.61 170.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -72.84 -44.94 60.81 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 120.373 -1.454 . . . . 0.0 113.401 170.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -36.15 71.76 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 126.144 1.778 . . . . 0.0 111.994 167.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -61.92 -44.89 95.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 120.251 -1.53 . . . . 0.0 111.234 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -75.52 -22.05 57.45 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 177.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -62.39 -45.22 94.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.838 1.255 . . . . 0.0 111.931 167.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 23.6 t-105 -59.5 -52.71 64.41 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 123.459 1.6 . . . . 0.0 114.423 169.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 15.3 mt -69.14 -24.63 64.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.148 -1.387 . . . . 0.0 112.858 -171.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -78.1 -32.35 50.55 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 117.17 -1.395 . . . . 0.0 113.555 165.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -58.9 -58.77 7.16 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 117.75 -1.58 . . . . 0.0 113.576 168.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.56 -46.42 95.03 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-O 122.452 1.12 . . . . 0.0 110.451 -171.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -58.74 -42.71 89.45 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 -177.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 60.9 tp -67.67 -46.51 72.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 131.389 3.876 . . . . 0.0 107.064 172.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.75 -31.46 72.46 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 128.015 3.322 . . . . 0.0 114.819 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . 0.32 27.3 ttpp -65.21 -41.33 94.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 117.621 2.452 . . . . 0.0 117.621 162.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -58.49 -27.57 64.57 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 124.327 3.239 . . . . 0.0 114.557 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.76 -38.01 86.41 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.757 1.623 . . . . 0.0 113.765 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -60.94 -16.75 46.07 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -82.71 -21.33 34.85 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 34.1 p-10 -126.62 8.03 6.95 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.374 2.0 m-20 73.59 23.18 2.47 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 119.862 -1.774 . . . . 0.0 114.006 175.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.61 5.57 31.18 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 122.026 2.194 . . . . 0.0 114.626 171.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -67.85 -43.48 79.37 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.203 -2.811 . . . . 0.0 116.557 -166.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.295 82.5 mt -72.1 -43.35 10.28 Favored Pre-proline 0 N--CA 1.45 -0.435 0 O-C-N 125.245 1.591 . . . . 0.0 114.139 170.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.61 -32.03 95.86 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 CA-C-O 124.57 1.821 . . . . 0.0 113.627 172.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 19.2 tp -72.39 -33.93 67.55 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.358 -2.714 . . . . 0.0 115.837 172.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 40.4 mt -77.33 -28.27 53.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.93 0.892 . . . . 0.0 109.757 173.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -73.46 -31.17 63.63 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 131.015 3.726 . . . . 0.0 109.883 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -72.29 -51.05 22.58 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 128.206 2.603 . . . . 0.0 115.766 168.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 91.7 mmm -85.4 -29.11 24.67 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.147 -1.406 . . . . 0.0 110.632 -164.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 9.1 mp -115.61 153.26 31.57 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 119.308 0.958 . . . . 0.0 110.153 -175.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 11.9 p -75.59 159.04 82.47 Favored Pre-proline 0 N--CA 1.449 -0.477 0 C-N-CA 127.03 2.132 . . . . 0.0 112.514 163.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.61 -24.77 46.79 Favored 'Trans proline' 0 N--CA 1.451 -1.024 1 C-N-CA 126.404 4.736 . . . . 0.0 116.446 173.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.76 -26.85 25.59 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.029 1.332 . . . . 0.0 109.412 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -77.37 -35.24 54.66 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 118.668 0.667 . . . . 0.0 112.558 172.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 86.6 mtm-85 -55.43 -52.17 64.49 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 124.955 1.302 . . . . 0.0 111.615 166.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -69.27 -39.51 78.34 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 115.603 -2.141 . . . . 0.0 110.846 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.39 -46.37 88.88 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.629 2.013 . . . . 0.0 111.454 169.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . 0.265 28.8 mt -63.89 -27.48 69.18 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 120.273 1.397 . . . . 0.0 113.658 -174.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.85 -25.1 42.67 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 117.62 1.808 . . . . 0.0 117.62 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 24.3 m -74.2 -37.56 63.87 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 116.015 -1.945 . . . . 0.0 112.07 166.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -56.78 -38.58 72.71 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 128.973 2.909 . . . . 0.0 114.877 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 69.1 t -59.31 -43.99 91.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 115.806 -2.045 . . . . 0.0 108.997 170.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 48.9 mtp180 -68.11 -34.13 75.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 122.006 2.185 . . . . 0.0 110.487 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 50.0 mt -72.51 -36.85 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 120.009 -1.682 . . . . 0.0 111.735 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 78.4 t -56.83 -47.59 82.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 N-CA-C 118.086 2.625 . . . . 0.0 118.086 160.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -53.91 -48.24 70.35 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 129.113 2.965 . . . . 0.0 115.92 175.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -69.06 -19.37 64.08 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.124 -1.417 . . . . 0.0 111.825 -177.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 95.8 mt -89.0 -30.07 19.01 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.161 -1.876 . . . . 0.0 114.666 177.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 37.8 mt -64.44 -43.86 92.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 119.357 0.981 . . . . 0.0 111.703 165.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -62.74 -51.04 68.71 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 127.405 2.282 . . . . 0.0 113.464 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.36 -5.05 79.27 Favored Glycine 0 C--N 1.338 0.644 0 CA-C-O 115.355 -2.914 . . . . 0.0 112.383 158.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -69.65 -15.16 63.13 Favored 'General case' 0 N--CA 1.447 -0.599 1 N-CA-C 121.879 4.029 . . . . 0.0 121.879 -174.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . 0.263 39.2 mtt -59.44 127.1 30.37 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 129.902 3.281 . . . . 0.0 110.199 173.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 96.4 p -81.47 168.29 18.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 125.517 1.761 . . . . 0.0 109.71 175.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -56.83 -26.28 57.89 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 117.061 -1.447 . . . . 0.0 114.248 174.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 mtp-105 -69.44 -26.21 64.49 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 126.448 1.899 . . . . 0.0 112.553 167.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -99.78 -34.31 10.21 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 128.126 2.57 . . . . 0.0 116.653 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . 0.25 24.7 mt -62.5 -22.51 66.32 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.88 -1.763 . . . . 0.0 109.251 168.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -91.11 -53.74 4.24 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 125.467 1.729 . . . . 0.0 113.689 168.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -104.87 -1.02 26.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 119.39 3.108 . . . . 0.0 119.39 -166.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 23.9 tp10 -122.74 -31.94 3.62 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 128.698 2.799 . . . . 0.0 116.502 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 tp -88.93 -31.39 18.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 121.464 -0.772 . . . . 0.0 112.583 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 93.05 -179.37 39.49 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-O 117.828 -1.54 . . . . 0.0 116.235 172.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.75 -21.13 54.69 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 125.168 2.413 . . . . 0.0 112.308 169.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.67 -15.47 18.76 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-O 124.894 2.386 . . . . 0.0 116.547 171.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 6.0 tt -70.16 -34.38 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 120.276 -1.72 . . . . 0.0 112.451 176.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.89 -27.29 68.04 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 171.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 25.2 m -72.63 -27.75 62.33 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 122.22 2.282 . . . . 0.0 110.414 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.317 39.2 mm -97.56 -22.8 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 126.876 2.07 . . . . 0.0 116.173 -173.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 39.4 p -118.39 -3.14 10.98 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 120.833 3.642 . . . . 0.0 120.833 -176.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -126.18 153.06 45.16 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 117.865 -3.022 . . . . 0.0 111.962 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 94.13 167.64 37.33 Favored Glycine 0 C--N 1.335 0.505 0 N-CA-C 117.484 1.754 . . . . 0.0 117.484 -172.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 93.9 p -80.61 2.92 23.7 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 117.854 2.539 . . . . 0.0 117.854 -174.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -117.72 -9.65 10.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.962 -1.971 . . . . 0.0 112.607 171.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 57.5 p -47.77 168.28 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 -173.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 tp -53.78 -38.96 65.01 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 120.714 3.598 . . . . 0.0 120.714 -163.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.256 57.1 mttt -88.51 -12.56 42.56 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 124.808 1.318 . . . . 0.0 114.406 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.13 -10.63 41.2 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 129.789 3.235 . . . . 0.0 112.242 169.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.05 150.59 69.56 Favored Pre-proline 0 N--CA 1.446 -0.648 0 CA-C-O 115.142 -2.361 . . . . 0.0 112.997 172.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -39.06 141.21 0.39 Allowed 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 123.794 2.996 . . . . 0.0 118.45 166.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 2.1 t -59.78 -45.28 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 CA-C-O 113.536 -3.126 . . . . 0.0 110.441 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.6 pm0 -61.12 -16.87 49.01 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 121.145 1.793 . . . . 0.0 115.414 -176.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 14.8 tp -82.64 -41.54 19.32 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 117.017 2.229 . . . . 0.0 117.017 164.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -60.82 -37.17 81.08 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 116.519 -3.863 . . . . 0.0 110.038 176.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -71.23 -35.02 71.32 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.971 1.708 . . . . 0.0 111.68 175.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -75.11 -40.27 59.99 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 31.1 mt -61.35 -36.71 80.95 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.972 1.709 . . . . 0.0 109.744 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.99 -27.92 67.84 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 170.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -79.36 -17.64 54.07 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 122.504 2.411 . . . . 0.0 111.137 174.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 92.8 t -108.93 -28.77 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 O-C-N 117.901 -2.999 . . . . 0.0 114.28 -176.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 65.9 mt -95.79 -45.9 6.8 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.079 0.942 . . . . 0.0 109.696 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 33.1 mt -92.98 16.85 11.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 120.992 -1.068 . . . . 0.0 113.271 -171.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -52.05 163.38 0.36 Allowed 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 118.506 -2.621 . . . . 0.0 116.813 157.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -132.12 39.24 3.44 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 117.426 -3.296 . . . . 0.0 109.124 172.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 25.1 t70 . . . . . 0 C--O 1.251 1.18 0 CA-C-N 121.77 2.077 . . . . 0.0 112.721 -160.523 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 29.5 ttp . . . . . 0 N--CA 1.47 0.565 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.04 122.46 16.12 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 -162.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -150.18 58.14 0.96 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -170.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -84.44 148.67 26.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.588 0.755 . . . . 0.0 111.003 -173.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 21.0 p -126.62 153.13 75.45 Favored Pre-proline 0 N--CA 1.447 -0.583 0 C-N-CA 124.333 1.053 . . . . 0.0 108.519 175.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 99.5 Cg_exo -53.25 -49.91 15.82 Favored 'Trans proline' 0 N--CA 1.449 -1.142 1 C-N-CA 125.651 4.234 . . . . 0.0 115.522 177.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -151.35 126.05 9.61 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.341 1.856 . . . . 0.0 114.547 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 14.5 t -47.12 113.66 0.71 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 166.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.16 -44.83 32.71 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 113.244 -1.798 . . . . 0.0 109.686 171.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.88 -26.47 62.36 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.612 2.078 . . . . 0.0 116.612 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 11' ' ' MET . . . . . 0.419 ' O ' ' HD2' ' D' ' 15' ' ' ARG . 17.8 mmt -71.32 -31.22 67.16 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 126.058 2.098 . . . . 0.0 111.244 168.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.42 -21.99 52.23 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 118.374 -2.704 . . . . 0.0 111.064 176.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -79.22 -34.87 42.43 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.817 1.189 . . . . 0.0 109.705 166.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -62.39 -43.3 99.13 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 123.666 1.698 . . . . 0.0 111.325 -177.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . 0.419 ' HD2' ' O ' ' D' ' 11' ' ' MET . 0.0 OUTLIER -64.57 -33.14 75.21 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 118.99 2.959 . . . . 0.0 118.99 169.719 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -72.51 -12.88 61.26 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 119.089 -2.257 . . . . 0.0 113.228 166.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -94.09 -32.54 13.73 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 118.894 2.924 . . . . 0.0 118.894 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -67.62 -26.55 66.3 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 111.248 -2.705 . . . . 0.0 109.019 169.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 8.2 t-105 -74.04 -53.44 10.0 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 123.727 1.727 . . . . 0.0 110.97 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.92 -15.64 44.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 117.926 -2.983 . . . . 0.0 112.764 173.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -75.46 -23.83 56.93 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 120.256 1.389 . . . . 0.0 113.99 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -78.51 -35.05 46.87 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.748 2.019 . . . . 0.0 109.328 174.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 91.9 t -62.2 -47.23 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 O-C-N 124.209 0.943 . . . . 0.0 109.174 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -70.87 -40.11 72.49 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.574 1.15 . . . . 0.0 112.468 174.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 20.7 tp -50.92 -45.11 60.27 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 121.129 1.786 . . . . 0.0 113.255 168.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 56.6 tp -73.87 -38.06 64.55 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 123.445 1.593 . . . . 0.0 115.187 -176.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . 0.466 ' HA ' ' CD2' ' D' ' 30' ' ' TYR . 27.9 ttpt -61.84 -49.29 76.86 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 120.358 -1.464 . . . . 0.0 108.163 169.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -58.84 -22.08 58.17 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.931 -2.981 . . . . 0.0 117.557 171.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.81 -26.43 25.74 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 120.27 -1.519 . . . . 0.0 112.455 176.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . 0.466 ' CD2' ' HA ' ' D' ' 27' ' ' LYS . 16.7 m-30 -56.69 -45.42 81.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 118.941 -2.35 . . . . 0.0 110.442 166.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -73.16 -25.59 60.86 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.886 2.074 . . . . 0.0 108.069 -163.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.2 p30 -115.22 5.35 14.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.211 1.804 . . . . 0.0 114.963 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 57.61 28.45 15.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 -178.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 15.3 mt -83.59 1.43 42.19 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.234 2.214 . . . . 0.0 112.067 164.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -60.08 3.73 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 118.212 2.671 . . . . 0.0 118.212 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 9.0 mt -57.37 -54.31 56.27 Favored Pre-proline 0 N--CA 1.451 -0.412 0 CA-C-O 114.396 -2.716 . . . . 0.0 109.677 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -43.68 -46.24 10.42 Favored 'Trans proline' 0 N--CA 1.447 -1.238 0 CA-C-N 124.696 2.713 . . . . 0.0 115.393 159.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 22.5 tp -74.44 -39.09 62.8 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 116.379 -3.951 . . . . 0.0 114.744 -176.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 42.4 mt -59.7 -48.44 81.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.18 -2.2 . . . . 0.0 107.185 166.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 33.0 m-20 -63.43 -31.57 72.76 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 121.393 1.906 . . . . 0.0 114.516 -178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 31.4 tp -71.15 -41.78 69.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 116.175 -1.869 . . . . 0.0 106.601 172.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 8.0 mmm -83.47 -23.3 32.26 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -170.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 29.5 mt -127.45 141.74 51.59 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 104.69 -2.337 . . . . 0.0 104.69 -173.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 71.7 p -60.22 158.05 29.88 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-O 114.745 -2.55 . . . . 0.0 116.82 171.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -48.15 -50.52 11.82 Favored 'Trans proline' 0 N--CA 1.447 -1.237 1 C-N-CA 126.684 4.923 . . . . 0.0 114.386 170.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -71.82 -17.83 62.13 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 117.738 2.496 . . . . 0.0 117.738 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -73.15 -42.14 63.16 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.412 163.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -61.18 -41.89 97.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 126.815 2.046 . . . . 0.0 108.02 175.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -66.07 -38.75 89.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.528 1.131 . . . . 0.0 110.927 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.59 -33.94 23.27 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.776 2.031 . . . . 0.0 112.911 -177.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 84.0 mt -58.65 -43.54 89.84 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.065 -2.397 . . . . 0.0 116.183 160.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.7 -34.44 70.41 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-N 121.102 1.774 . . . . 0.0 113.691 170.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 17.8 m -77.07 -38.14 53.12 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 122.335 1.064 . . . . 0.0 112.929 -177.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -61.54 -31.17 71.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 112.444 -3.646 . . . . 0.0 110.852 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.71 -49.94 70.95 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 CA-C-N 123.702 2.956 . . . . 0.0 112.515 170.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.307 9.4 ptm180 -65.64 -22.18 66.63 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 118.267 2.691 . . . . 0.0 118.267 169.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 10.2 mt -70.93 -42.49 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 124.194 3.179 . . . . 0.0 112.484 171.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 3.2 t -61.9 -48.12 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 128.163 3.415 . . . . 0.0 111.724 169.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -63.06 -38.82 92.73 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.313 -2.742 . . . . 0.0 108.976 -174.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -75.14 -26.9 59.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 115.679 -2.105 . . . . 0.0 112.305 174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 63.4 mt -68.73 -23.62 64.36 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 116.734 -1.603 . . . . 0.0 110.389 174.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 29.8 mt -84.09 -38.72 20.43 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 170.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -69.64 -29.32 66.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 127.327 2.892 . . . . 0.0 114.455 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.42 36.99 92.5 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-O 115.727 -2.707 . . . . 0.0 113.481 158.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -111.63 -25.17 9.67 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 114.774 -2.536 . . . . 0.0 110.157 173.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . 0.256 33.6 mtm -89.23 30.84 0.93 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 169.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 77.7 p -85.36 172.83 10.77 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 119.47 -2.019 . . . . 0.0 111.022 -163.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.268 5.5 tp60 65.15 -17.64 0.09 Allowed 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 116.598 -3.814 . . . . 0.0 119.305 169.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 35.0 ttt85 -146.96 -59.85 0.28 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 129.995 3.318 . . . . 0.0 116.169 176.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -84.38 -35.86 22.87 Favored 'General case' 0 N--CA 1.446 -0.644 1 O-C-N 115.47 -4.519 . . . . 0.0 114.16 -152.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.72 -41.99 15.96 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 116.369 -3.957 . . . . 0.0 116.05 178.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt -61.14 -38.91 88.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 112.822 -1.99 . . . . 0.0 108.997 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -84.2 -20.56 32.12 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 126.49 2.369 . . . . 0.0 114.233 -176.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -97.3 -38.88 9.49 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 127.963 2.505 . . . . 0.0 110.986 -173.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -120.9 -16.91 8.02 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 85.47 -171.23 45.4 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-O 123.707 1.726 . . . . 0.0 116.746 165.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.254 . . -43.43 -16.69 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.88 -20.47 68.6 Favored Glycine 0 C--N 1.335 0.522 0 CA-C-N 122.585 2.448 . . . . 0.0 112.537 171.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 5.0 tt -46.05 -18.06 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 C-N-CA 126.498 1.919 . . . . 0.0 114.959 168.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -103.99 -21.9 13.54 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 117.866 -1.534 . . . . 0.0 112.65 -178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 17.7 m -66.72 -39.4 87.99 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.375 1.47 . . . . 0.0 109.816 165.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 8.5 mm -87.06 -18.18 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 O-C-N 117.755 -3.09 . . . . 0.0 114.444 -172.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 31.0 p -109.25 -24.89 10.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 120.99 3.7 . . . . 0.0 120.99 168.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.8 mtp85 -83.84 162.42 20.57 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.894 -3.004 . . . . 0.0 110.827 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.31 154.73 30.95 Favored Glycine 0 N--CA 1.446 -0.66 0 O-C-N 127.247 2.842 . . . . 0.0 112.275 -177.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 24.6 m -74.38 -7.2 52.08 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 115.847 -2.025 . . . . 0.0 114.943 -168.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . 0.276 18.2 m-80 -134.36 33.38 3.31 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 123.606 2.912 . . . . 0.0 105.963 -171.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 59.9 p -77.28 -175.5 3.72 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.415 2.746 . . . . 0.0 118.415 175.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 29.7 tp -56.24 -32.12 64.19 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 118.389 -2.695 . . . . 0.0 113.951 165.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -74.46 -16.92 60.84 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.161 0.584 . . . . 0.0 110.569 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -104.49 -15.24 15.42 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 113.634 -3.079 . . . . 0.0 113.372 -166.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . 0.405 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 45.07 87.19 0.12 Allowed Pre-proline 0 N--CA 1.449 -0.513 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 165.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . 0.568 ' C ' ' H ' ' D' ' 95' ' ' GLU . 50.7 Cg_exo 34.19 42.24 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.168 0 C-N-CA 122.447 -1.897 . . . . 0.0 115.861 36.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -72.73 15.19 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 111.062 -2.79 . . . . 0.0 110.743 -170.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . 0.568 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -144.25 -30.0 0.48 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -169.066 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 58.8 tp -50.82 -55.38 17.15 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.663 157.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . 0.31 24.2 ptt180 -59.3 -37.19 77.09 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 112.685 -3.531 . . . . 0.0 112.512 -176.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -71.16 -23.52 62.08 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.455 2.302 . . . . 0.0 110.72 176.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . 0.255 79.3 t90 -87.28 -42.48 12.89 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.709 1.204 . . . . 0.0 111.398 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 51.6 mt -59.76 -55.02 39.49 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 129.454 3.102 . . . . 0.0 106.432 169.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -44.47 -31.36 1.07 Allowed 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 173.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -89.49 -29.34 19.04 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 69.5 t -91.15 -22.83 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 O-C-N 121.316 -0.865 . . . . 0.0 110.729 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 65.9 mt -102.84 -27.67 12.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 119.915 -1.741 . . . . 0.0 112.308 -172.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 28.5 mt -101.78 12.01 37.78 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -62.2 152.16 34.03 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 127.478 2.986 . . . . 0.0 109.77 -171.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 47.8 m -66.38 -27.3 67.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 117.751 2.5 . . . . 0.0 117.751 -168.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . 0.255 0.6 OUTLIER . . . . . 0 C--O 1.25 1.099 0 O-C-N 126.899 2.625 . . . . 0.0 116.256 169.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.96 -28.78 69.16 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 116.587 2.069 . . . . 0.0 116.587 -163.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -77.89 -44.21 27.78 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 125.853 1.971 . . . . 0.0 112.257 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . 0.25 55.0 tt0 -79.33 -20.73 47.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.448 -178.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.7 p -57.54 172.67 0.4 Allowed Pre-proline 0 N--CA 1.45 -0.428 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 171.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -64.91 -32.22 55.3 Favored 'Trans proline' 0 N--CA 1.449 -1.113 0 N-CA-C 119.929 3.011 . . . . 0.0 119.929 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -156.05 127.71 7.3 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 176.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.0 t -85.66 95.73 9.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.802 -0.561 . . . . 0.0 110.738 172.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.69 90.61 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.499 -1.239 . . . . 0.0 111.294 160.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.01 -38.57 86.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 120.602 1.546 . . . . 0.0 112.7 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.4 ttp -81.07 -24.92 37.45 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 121.433 1.924 . . . . 0.0 112.344 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.87 -25.5 60.07 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 124.617 2.151 . . . . 0.0 116.691 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -64.91 -30.41 71.4 Favored 'General case' 0 N--CA 1.445 -0.698 0 O-C-N 120.07 -1.644 . . . . 0.0 113.337 165.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -80.65 -38.69 28.68 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 118.563 -1.255 . . . . 0.0 108.232 -170.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.7 mmt-85 -62.11 -25.03 67.48 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 125.8 1.938 . . . . 0.0 114.839 176.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.0 t60 -61.52 -46.64 89.12 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 117.836 2.532 . . . . 0.0 117.836 171.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -68.93 -26.09 64.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 171.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -72.13 -48.79 41.09 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.496 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG . 20.2 t-105 -60.91 -45.59 94.03 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.31 1.844 . . . . 0.0 112.22 172.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.52 -18.94 62.95 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 177.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -69.45 -29.09 66.7 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 119.003 0.819 . . . . 0.0 110.205 170.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -62.1 -46.28 89.79 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 120.315 -1.491 . . . . 0.0 112.092 165.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.8 t -84.46 -0.21 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 115.6 1.704 . . . . 0.0 115.6 -170.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -96.52 -39.07 9.73 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 113.894 -1.503 . . . . 0.0 109.485 164.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 66.0 tp -60.68 -34.52 74.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 127.121 2.168 . . . . 0.0 108.382 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.6 tp -85.18 -22.87 28.58 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 126.8 2.563 . . . . 0.0 109.741 -169.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -79.62 -31.53 41.68 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 121.399 -0.813 . . . . 0.0 112.013 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . 0.256 25.9 m-20 -82.17 -22.27 36.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 118.683 -2.511 . . . . 0.0 111.153 175.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.76 -43.54 92.94 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 169.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -55.47 -46.51 76.84 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 123.684 1.707 . . . . 0.0 111.391 172.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -66.31 -24.86 66.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.562 1.945 . . . . 0.0 112.806 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -104.96 11.13 33.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 113.855 -2.974 . . . . 0.0 114.209 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.417 1.8 m-20 61.03 22.38 12.64 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 125.64 1.838 . . . . 0.0 112.144 174.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.3 mt -109.88 4.15 21.32 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.365 1.866 . . . . 0.0 112.837 177.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -49.53 -43.55 45.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 -179.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.391 80.1 mt -58.13 -60.49 9.95 Favored Pre-proline 0 N--CA 1.45 -0.46 0 N-CA-C 116.314 1.968 . . . . 0.0 116.314 172.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . 0.269 27.2 Cg_endo -60.21 -39.97 63.75 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 117.225 -1.383 . . . . 0.0 112.704 -176.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 tp -55.29 -40.33 70.92 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.488 -2.633 . . . . 0.0 115.846 172.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 85.5 mt -75.12 -35.13 61.74 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.766 0.826 . . . . 0.0 109.036 178.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -62.74 -40.5 97.42 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 123.521 0.513 . . . . 0.0 111.052 176.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.9 tp -68.25 -30.39 69.41 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 115.674 -2.108 . . . . 0.0 114.088 174.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 85.3 mmm -97.64 -22.15 16.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 123.494 2.861 . . . . 0.0 112.372 -168.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mp -134.13 150.13 51.11 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 126.091 1.757 . . . . 0.0 109.661 -176.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 64.3 p -81.57 163.34 54.69 Favored Pre-proline 0 N--CA 1.451 -0.401 0 C-N-CA 126.704 2.002 . . . . 0.0 111.724 173.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -64.15 -32.45 63.31 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 CA-C-N 119.509 0.86 . . . . 0.0 111.998 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.19 -35.32 77.81 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 115.645 -2.121 . . . . 0.0 110.432 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.21 -24.07 60.47 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 122.955 2.616 . . . . 0.0 114.18 174.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.0 mtm-85 -84.98 -35.31 22.07 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 126.014 2.071 . . . . 0.0 115.204 171.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.3 -39.14 82.08 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.404 1.882 . . . . 0.0 110.316 170.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.47 83.86 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 130.565 3.546 . . . . 0.0 113.486 174.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.2 mt -72.33 -36.47 68.85 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 118.017 -2.927 . . . . 0.0 107.143 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.03 -51.39 54.14 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 174.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.25 8.8 m -62.99 -30.82 71.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 128.889 2.876 . . . . 0.0 113.143 175.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.7 mtt180 -80.88 -32.79 34.75 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 117.715 -1.594 . . . . 0.0 108.373 -168.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 83.8 t -45.43 -46.4 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-O 115.16 -2.353 . . . . 0.0 114.738 154.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -79.51 -27.98 41.41 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.448 2.386 . . . . 0.0 108.657 -169.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.6 mt -63.53 -55.21 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 C-N-CA 125.27 1.428 . . . . 0.0 110.49 166.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.1 t -61.72 -35.16 65.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 117.019 -1.872 . . . . 0.0 113.514 -173.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . 0.256 28.8 tt0 -46.6 -60.09 2.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 118.137 -2.852 . . . . 0.0 113.136 166.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -58.82 -29.33 66.8 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 175.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 42.3 mt -76.09 -28.75 57.68 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 118.701 -1.2 . . . . 0.0 112.427 173.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.3 mt -74.28 -31.32 62.47 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 119.117 -2.239 . . . . 0.0 113.196 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 43.3 ttm105 -71.95 -41.48 67.73 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 129.805 3.242 . . . . 0.0 112.918 173.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.54 35.15 21.56 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 120.065 2.786 . . . . 0.0 120.065 -174.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -98.2 -37.43 9.7 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 119.863 1.831 . . . . 0.0 113.096 168.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 42.5 mtt -75.28 127.19 32.6 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 118.939 -1.105 . . . . 0.0 109.568 -177.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 54.0 p -47.94 165.75 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 127.227 2.211 . . . . 0.0 114.59 151.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -68.58 -33.65 74.43 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 127.407 2.283 . . . . 0.0 109.63 170.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.3 tpt85 -55.3 -54.35 44.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.248 1.019 . . . . 0.0 111.247 168.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -58.49 -48.58 80.34 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 175.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.5 mt -54.53 -29.09 49.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 115.463 1.653 . . . . 0.0 115.463 171.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -77.52 -50.03 13.48 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 118.305 -2.747 . . . . 0.0 109.084 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -64.18 -41.82 96.94 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 119.606 3.187 . . . . 0.0 119.606 172.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -81.06 -42.24 21.34 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 125.539 2.59 . . . . 0.0 114.072 -171.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.8 mt -120.9 -5.41 9.6 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 117.984 -2.948 . . . . 0.0 114.12 -172.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 82.32 -12.18 46.5 Favored Glycine 0 CA--C 1.523 0.577 0 O-C-N 116.664 -3.772 . . . . 0.0 115.686 175.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.55 120.69 17.49 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 125.498 1.352 . . . . 0.0 111.242 -174.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.8 -172.26 41.33 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-N 113.407 -1.724 . . . . 0.0 115.815 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.7 mt -55.37 -46.86 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-O 114.395 -2.717 . . . . 0.0 110.427 165.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.12 86.7 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 122.091 2.223 . . . . 0.0 115.228 -171.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 62.5 p -94.19 -25.57 17.03 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 124.003 1.859 . . . . 0.0 115.957 -174.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 31.1 mm -74.28 -34.2 36.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 O-C-N 118.446 -2.659 . . . . 0.0 107.717 171.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.1 m -62.39 -52.78 62.21 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 121.889 2.132 . . . . 0.0 109.071 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.6 ttt180 -63.17 -57.92 8.94 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 117.706 -1.14 . . . . 0.0 109.688 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.09 -31.42 4.38 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-O 123.19 1.439 . . . . 0.0 116.244 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.2 m -69.33 -50.79 43.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 119.998 -1.883 . . . . 0.0 111.108 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -56.82 -39.6 74.47 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 119.927 -1.733 . . . . 0.0 114.378 175.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.4 m -72.17 -41.32 67.17 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 115.018 -2.42 . . . . 0.0 112.263 176.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.7 tt -67.21 -40.91 86.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 122.844 2.566 . . . . 0.0 114.374 173.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -67.6 -23.3 65.36 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 118.121 2.637 . . . . 0.0 118.121 177.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.47 -13.66 25.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.848 1.659 . . . . 0.0 113.467 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.97 154.25 92.77 Favored Pre-proline 0 N--CA 1.452 -0.348 0 O-C-N 118.941 -2.349 . . . . 0.0 111.223 -177.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -64.99 141.52 70.9 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 125.008 3.805 . . . . 0.0 113.36 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.8 m -54.4 -32.04 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 O-C-N 126.877 2.611 . . . . 0.0 113.687 -177.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.5 pm0 -75.53 -22.91 56.69 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.559 -1.655 . . . . 0.0 113.739 -177.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 20.1 tp -76.76 -42.15 42.05 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 119.033 -2.292 . . . . 0.0 106.475 174.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . 0.331 22.9 mtm180 -67.76 -54.94 15.22 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 123.714 1.721 . . . . 0.0 114.415 -164.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -59.29 -13.96 9.7 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 129.983 3.313 . . . . 0.0 115.026 169.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 37.4 t90 -96.47 -28.49 14.4 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 115.092 -2.385 . . . . 0.0 109.675 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 84.9 mt -77.99 -35.79 49.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 123.834 3.015 . . . . 0.0 113.916 173.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.08 -30.5 71.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 116.551 -2.059 . . . . 0.0 115.305 170.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -65.79 -55.02 19.39 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 118.282 2.697 . . . . 0.0 118.282 162.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 84.9 t -80.83 -26.74 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 O-C-N 120.477 -1.389 . . . . 0.0 110.203 -167.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.9 mt -96.59 -32.53 12.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -175.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 44.2 mt -98.59 -11.27 22.31 Favored 'General case' 0 N--CA 1.446 -0.658 0 O-C-N 117.785 -3.072 . . . . 0.0 114.36 -171.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -98.18 42.22 1.1 Allowed 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 124.089 0.868 . . . . 0.0 112.182 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.0 m -119.73 -42.1 2.64 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 175.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 . . . . . 0 C--O 1.253 1.253 0 O-C-N 127.646 3.091 . . . . 0.0 113.136 179.258 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 27.7 ttp . . . . . 0 N--CA 1.469 0.508 0 CA-C-O 119.327 -0.368 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.48 -20.93 64.63 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 114.738 1.385 . . . . 0.0 114.738 -154.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -96.84 -22.27 17.02 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 120.844 1.657 . . . . 0.0 112.277 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -71.4 -34.47 70.39 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 126.216 1.806 . . . . 0.0 113.946 164.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 28.8 m -60.57 146.32 85.65 Favored Pre-proline 0 N--CA 1.446 -0.646 0 CA-C-O 116.803 -1.57 . . . . 0.0 112.302 177.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -71.0 -31.65 14.67 Favored 'Trans proline' 0 N--CA 1.449 -1.145 0 O-C-N 124.169 1.615 . . . . 0.0 113.654 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -144.98 159.99 42.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 127.539 2.336 . . . . 0.0 112.691 177.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 10.9 t -144.49 117.41 8.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 121.275 1.852 . . . . 0.0 112.433 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.77 87.22 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 129.072 2.949 . . . . 0.0 111.475 -170.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.99 -50.85 72.53 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 128.466 2.706 . . . . 0.0 110.771 176.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 12.3 ttm -70.86 -32.79 69.92 Favored 'General case' 0 N--CA 1.45 -0.448 1 O-C-N 116.047 -4.158 . . . . 0.0 108.654 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.56 -37.99 80.39 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.738 1.732 . . . . 0.0 111.825 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -61.76 -53.37 56.91 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.247 -2.158 . . . . 0.0 109.45 175.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -55.56 -20.37 13.11 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 117.497 2.406 . . . . 0.0 117.497 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 14.1 mmm180 -84.38 -33.51 23.79 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 170.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -66.35 -34.07 77.15 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 115.439 -2.22 . . . . 0.0 112.764 166.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -79.59 -27.52 41.1 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 115.808 -2.044 . . . . 0.0 109.838 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -65.29 -30.29 71.14 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 120.929 1.695 . . . . 0.0 114.96 164.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 18.6 t-105 -74.84 -45.68 41.6 Favored 'General case' 0 N--CA 1.445 -0.685 1 O-C-N 114.806 -4.934 . . . . 0.0 112.903 173.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 8.9 mt -60.72 -23.36 64.85 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 113.15 -3.309 . . . . 0.0 114.038 166.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 53.6 ttt180 -72.31 -34.37 68.07 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 125.325 3.693 . . . . 0.0 111.55 173.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -55.82 -50.69 69.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 119.649 1.113 . . . . 0.0 112.416 167.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 87.3 t -74.08 -33.58 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 O-C-N 127.159 2.787 . . . . 0.0 108.874 -171.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.82 -45.76 93.18 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 119.878 -1.764 . . . . 0.0 115.384 167.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 23.0 tp -62.75 -46.75 86.59 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.14 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 59.7 tp -69.32 -25.7 64.35 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 118.353 -2.717 . . . . 0.0 117.178 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -59.02 -61.28 2.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 118.265 -2.772 . . . . 0.0 110.011 162.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -60.32 -29.52 68.92 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.179 -3.451 . . . . 0.0 111.82 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.67 -32.28 69.49 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 130.766 3.626 . . . . 0.0 115.034 175.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -66.05 -52.46 48.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.962 1.305 . . . . 0.0 110.653 172.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -50.57 -43.38 56.35 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 115.94 -1.981 . . . . 0.0 115.511 167.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -91.18 3.68 54.2 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 130.27 3.428 . . . . 0.0 108.775 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.365 6.1 m-20 62.57 21.06 12.42 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 118.922 2.934 . . . . 0.0 118.922 -177.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -104.11 12.68 33.67 Favored 'General case' 0 N--CA 1.446 -0.636 1 O-C-N 114.46 -5.15 . . . . 0.0 114.651 -175.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 11.5 p-80 -57.86 -49.13 77.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 128.001 2.52 . . . . 0.0 116.151 -170.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 15.6 mt -66.21 -39.44 28.09 Favored Pre-proline 0 N--CA 1.449 -0.494 0 C-N-CA 126.881 2.072 . . . . 0.0 116.418 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.301 26.5 Cg_exo -59.03 -45.34 28.72 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 N-CA-C 115.193 1.19 . . . . 0.0 115.193 164.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 29.5 tp -56.62 -54.09 50.1 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 119.963 -1.711 . . . . 0.0 112.166 176.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 63.1 mt -54.58 -34.76 62.46 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 119.524 -1.985 . . . . 0.0 113.537 170.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -71.27 -29.44 65.08 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 117.796 -1.097 . . . . 0.0 110.685 173.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . 0.408 16.1 tp -75.04 -43.42 53.59 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 116.238 -1.839 . . . . 0.0 114.544 174.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 19.5 mmt -94.84 -20.92 19.04 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 125.283 1.614 . . . . 0.0 112.272 -168.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -114.28 133.93 55.3 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 121.077 1.762 . . . . 0.0 111.122 173.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 73.2 p -72.98 152.95 90.93 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 122.038 2.199 . . . . 0.0 110.971 170.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 99.4 Cg_exo -28.3 -54.87 0.14 Allowed 'Trans proline' 0 N--CA 1.449 -1.105 1 C-N-CA 126.325 4.683 . . . . 0.0 112.559 166.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -62.3 -43.02 99.79 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 127.627 3.08 . . . . 0.0 115.847 -175.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -64.19 -39.23 93.56 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 119.611 3.189 . . . . 0.0 119.611 166.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . 0.496 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 37.8 mtm-85 -61.42 -40.34 94.05 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 115.006 -2.426 . . . . 0.0 107.209 169.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -66.5 -31.36 72.05 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 124.25 3.205 . . . . 0.0 113.151 175.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.2 -47.55 82.12 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 118.38 -2.7 . . . . 0.0 114.323 168.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.12 -37.57 83.28 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 120.007 3.336 . . . . 0.0 120.007 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.09 -18.76 76.72 Favored Glycine 0 C--N 1.34 0.767 0 C-N-CA 117.705 -2.188 . . . . 0.0 112.009 176.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -85.06 -36.31 21.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 119.243 -2.328 . . . . 0.0 109.82 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 85.9 mtt180 -60.3 -25.9 66.11 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.327 1.451 . . . . 0.0 114.216 171.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . 0.319 16.6 t -59.37 -56.96 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 C-N-CA 126.085 1.754 . . . . 0.0 111.025 164.113 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -72.25 -32.49 66.73 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 120.369 1.44 . . . . 0.0 112.422 -176.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 9.1 mt -59.6 -56.14 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 121.221 1.828 . . . . 0.0 113.214 162.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.261 29.6 t -66.7 -36.24 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 O-C-N 117.818 -3.051 . . . . 0.0 112.759 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -45.19 -59.49 2.61 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 128.972 2.909 . . . . 0.0 112.248 159.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -69.2 -21.07 63.98 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 119.024 -2.297 . . . . 0.0 114.852 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 12.2 mt -67.03 -19.03 65.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 116.705 -3.747 . . . . 0.0 110.468 167.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mt -96.02 -40.56 9.2 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 122.694 2.497 . . . . 0.0 109.874 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 27.6 ttm180 -58.79 -59.24 5.75 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 125.006 1.441 . . . . 0.0 113.25 174.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.49 48.48 23.4 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 115.983 -3.008 . . . . 0.0 115.347 -179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -126.49 -27.71 3.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 126.568 1.981 . . . . 0.0 114.371 -178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 16.9 mtt -62.77 141.52 58.56 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 115.44 1.645 . . . . 0.0 115.44 177.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.7 p -72.65 157.97 36.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 162.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -64.29 -16.12 61.54 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 115.719 -2.086 . . . . 0.0 113.894 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -67.3 -48.48 67.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.708 1.203 . . . . 0.0 113.788 166.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -67.43 -34.06 76.44 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 128.506 2.723 . . . . 0.0 110.314 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . 0.252 79.4 mt -61.07 -55.14 36.07 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 123.501 1.62 . . . . 0.0 112.194 175.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -63.73 -44.79 92.52 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 119.844 -1.785 . . . . 0.0 110.56 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -97.23 -24.65 15.6 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 116.356 -1.783 . . . . 0.0 113.402 -160.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -117.1 -35.39 4.09 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 116.826 -1.95 . . . . 0.0 112.373 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 45.0 mt -92.43 -7.3 47.97 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 129.018 2.927 . . . . 0.0 115.38 177.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 55.31 41.17 78.85 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-O 118.893 -0.948 . . . . 0.0 115.156 -176.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.28 101.37 7.93 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 117.003 -1.475 . . . . 0.0 111.599 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.8 171.28 30.99 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 119.966 2.746 . . . . 0.0 119.966 161.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . 0.251 55.0 mt -40.9 -41.33 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 175.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . 0.334 . . -58.73 -37.87 77.12 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.639 1.175 . . . . 0.0 113.136 176.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.2 m -79.76 -35.01 39.32 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 120.785 -1.197 . . . . 0.0 113.161 178.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 16.3 mm -70.76 -39.66 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-O 118.011 -0.995 . . . . 0.0 109.943 174.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 93.1 m -59.68 -59.18 5.85 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.715 2.406 . . . . 0.0 112.41 171.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -70.91 -33.53 70.63 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -173.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.25 -34.52 85.92 Favored Glycine 0 CA--C 1.524 0.649 0 O-C-N 116.68 -3.762 . . . . 0.0 115.116 169.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 75.1 m -76.16 -34.39 59.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -67.52 -27.58 67.1 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 119.478 -2.014 . . . . 0.0 112.135 172.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 22.4 m -76.64 -32.91 58.3 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 126.842 2.057 . . . . 0.0 113.593 176.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.4 mt -65.4 -48.62 72.23 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 116.54 -1.695 . . . . 0.0 112.991 168.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -71.27 -25.98 62.69 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 126.987 2.68 . . . . 0.0 112.874 -178.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . 0.367 . . -84.47 4.62 30.88 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 116.943 -3.598 . . . . 0.0 114.969 170.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.53 167.47 29.88 Favored Pre-proline 0 N--CA 1.448 -0.555 0 CA-C-N 119.595 1.089 . . . . 0.0 113.77 166.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -74.21 155.54 46.79 Favored 'Trans proline' 0 N--CA 1.448 -1.191 0 N-CA-C 117.068 1.911 . . . . 0.0 117.068 169.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 m -61.58 -39.55 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 115.918 -1.991 . . . . 0.0 115.15 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 12.3 pm0 -66.78 -25.33 66.42 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 126.27 2.231 . . . . 0.0 110.636 173.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.5 tp -73.51 -39.76 64.57 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.408 -3.308 . . . . 0.0 111.458 174.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 89.5 mtm-85 -68.12 -33.2 74.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 114.029 -2.891 . . . . 0.0 115.163 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -66.05 -30.25 70.75 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 128.371 3.544 . . . . 0.0 105.593 168.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -84.69 -45.74 12.16 Favored 'General case' 0 N--CA 1.45 -0.465 1 O-C-N 115.882 -4.262 . . . . 0.0 105.63 -169.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 22.4 mt -70.8 -35.82 72.7 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 124.96 1.412 . . . . 0.0 114.661 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -61.85 -17.65 57.18 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 170.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -102.92 -19.77 14.5 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 177.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 92.6 t -95.02 -38.91 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 CA-C-O 124.115 1.912 . . . . 0.0 112.754 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 6.6 mt -86.74 -68.33 0.75 Allowed 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 117.768 -3.083 . . . . 0.0 111.13 -174.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 79.9 mt -64.01 -33.61 76.14 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 126.888 3.233 . . . . 0.0 113.459 -165.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -55.17 -17.23 3.96 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.11 2.964 . . . . 0.0 114.175 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 3.4 m -71.47 -20.75 62.04 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 170.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.695 2.798 . . . . 0.0 113.266 171.105 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.47 0.539 0 N-CA-C 104.908 -2.256 . . . . 0.0 104.908 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -51.26 134.65 27.46 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 124.783 2.23 . . . . 0.0 114.751 -175.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -109.11 148.72 30.4 Favored 'General case' 0 N--CA 1.445 -0.724 1 N-CA-C 121.97 4.063 . . . . 0.0 121.97 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -165.13 152.53 11.01 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 121.166 1.803 . . . . 0.0 109.062 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 12.6 p -152.71 162.67 25.83 Favored Pre-proline 0 N--CA 1.448 -0.55 0 C-N-CA 128.176 2.59 . . . . 0.0 108.896 164.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -47.73 -25.25 5.55 Favored 'Trans proline' 0 N--CA 1.449 -1.091 1 N-CA-C 124.069 4.603 . . . . 0.0 124.069 -158.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -142.81 160.72 39.79 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.288 178.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 13.6 t -157.32 125.94 5.7 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 127.095 2.158 . . . . 0.0 110.297 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.39 -27.73 59.2 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 119.412 -2.055 . . . . 0.0 112.697 175.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.15 -36.54 83.39 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 -170.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 34.0 mtt -77.82 -31.25 51.56 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 117.534 -3.229 . . . . 0.0 115.539 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.76 95.16 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.811 1.244 . . . . 0.0 112.248 174.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 tp10 -72.54 -29.46 63.59 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 126.648 2.468 . . . . 0.0 111.54 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . 0.301 50.9 tt0 -72.26 -36.01 68.92 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.652 0.739 . . . . 0.0 111.991 164.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -31.53 71.74 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 118.061 -2.9 . . . . 0.0 114.88 177.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -64.58 -51.43 62.76 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.417 2.287 . . . . 0.0 112.869 170.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.376 80.8 mm-40 -55.97 -42.53 76.43 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 114.877 -2.487 . . . . 0.0 112.621 170.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 68.2 mt-10 -66.74 -52.47 44.0 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 125.777 1.923 . . . . 0.0 112.44 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -55.93 -37.75 69.38 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 170.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.66 -29.64 68.98 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 117.849 -3.032 . . . . 0.0 115.165 167.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 37.5 ttt-85 -71.74 -27.26 62.87 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 127.126 2.766 . . . . 0.0 109.548 170.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -66.62 -54.13 26.71 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.894 -2.379 . . . . 0.0 111.397 171.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 88.7 t -57.7 -39.64 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 123.618 1.675 . . . . 0.0 112.429 -174.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -61.13 -58.5 8.11 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.712 2.005 . . . . 0.0 108.215 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 58.8 tp -50.78 -39.37 52.36 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 129.768 3.227 . . . . 0.0 112.321 175.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 46.6 tp -68.03 -50.04 57.77 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.726 2.41 . . . . 0.0 105.602 179.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -70.95 -29.39 65.4 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 120.23 -1.544 . . . . 0.0 114.868 -175.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -63.49 -32.09 73.44 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.848 -1.549 . . . . 0.0 113.85 166.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.99 -23.35 60.63 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.78 1.632 . . . . 0.0 112.852 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -69.88 -11.21 60.7 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 116.699 -3.75 . . . . 0.0 117.205 171.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -87.54 -25.61 23.56 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 128.955 2.902 . . . . 0.0 111.812 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -124.74 17.71 8.71 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 124.144 3.156 . . . . 0.0 111.44 -178.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 61.23 31.18 19.5 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 116.135 -1.888 . . . . 0.0 114.629 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 mt -103.36 13.99 32.48 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 175.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -78.39 -26.82 46.64 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 -170.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.4 83.8 mt -69.42 -48.11 25.63 Favored Pre-proline 0 N--CA 1.448 -0.553 0 O-C-N 126.691 2.494 . . . . 0.0 114.772 168.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -55.51 -38.96 93.55 Favored 'Trans proline' 0 N--CA 1.447 -1.261 1 C-N-CA 127.576 5.518 . . . . 0.0 111.995 171.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 40.2 tp -77.35 -37.64 51.92 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 119.524 -1.985 . . . . 0.0 112.323 -176.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 34.2 mt -74.42 -31.29 62.26 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 122.19 2.268 . . . . 0.0 107.344 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -70.16 -35.6 74.13 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 167.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 30.5 tp -63.52 -43.72 96.34 Favored 'General case' 0 N--CA 1.448 -0.543 1 O-C-N 115.969 -4.207 . . . . 0.0 111.136 170.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 12.9 mmt -74.01 -49.93 22.12 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.931 2.892 . . . . 0.0 116.374 -174.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.7 mp -106.5 130.0 54.36 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 129.948 3.299 . . . . 0.0 112.276 -176.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 71.0 p -56.35 153.45 19.65 Favored Pre-proline 0 N--CA 1.448 -0.555 0 O-C-N 127.241 2.838 . . . . 0.0 117.867 157.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . 0.271 13.5 Cg_exo -49.92 -39.96 49.18 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 C-N-CA 115.803 -2.331 . . . . 0.0 115.418 171.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.95 -31.6 71.15 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.706 1.602 . . . . 0.0 114.979 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -77.42 -30.94 53.73 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 113.666 -3.064 . . . . 0.0 111.429 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 46.4 mtm-85 -81.33 -27.68 34.85 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 126.478 2.361 . . . . 0.0 111.859 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -68.63 -43.38 76.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 119.261 -2.15 . . . . 0.0 113.199 163.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.29 86.5 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 116.845 -1.55 . . . . 0.0 112.5 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 19.4 mt -78.37 -25.66 46.36 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 117.876 2.547 . . . . 0.0 117.876 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.18 -35.72 70.74 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 119.07 -1.538 . . . . 0.0 114.157 169.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 7.0 m -54.55 -49.09 71.15 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 118.528 -2.748 . . . . 0.0 114.966 163.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -58.14 -24.14 57.76 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 126.014 2.071 . . . . 0.0 113.322 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 40.6 t -71.72 -37.27 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 115.541 -2.171 . . . . 0.0 110.003 170.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -73.29 -16.38 61.38 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 122.49 2.404 . . . . 0.0 113.429 174.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 11.6 mt -73.62 -35.27 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 121.271 -0.893 . . . . 0.0 111.354 170.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 47.6 t -70.78 -43.86 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 O-C-N 120.728 -1.233 . . . . 0.0 109.865 170.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.05 -42.22 98.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 117.671 -3.143 . . . . 0.0 115.852 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -68.71 -25.65 64.87 Favored 'General case' 0 N--CA 1.449 -0.508 1 O-C-N 115.741 -4.349 . . . . 0.0 113.822 174.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 86.7 mt -87.91 8.95 23.83 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 116.843 -3.661 . . . . 0.0 112.525 172.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 62.5 mt -112.99 -20.25 11.61 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 120.152 1.342 . . . . 0.0 111.935 162.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 39.0 ttm105 -78.15 -38.08 44.46 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 127.836 2.455 . . . . 0.0 112.978 171.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.58 25.71 67.52 Favored Glycine 0 CA--C 1.524 0.653 0 CA-C-O 126.22 3.122 . . . . 0.0 115.449 161.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -92.83 -33.9 14.07 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 112.306 -1.947 . . . . 0.0 113.989 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 53.9 mtt -62.87 142.74 58.14 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 127.356 2.91 . . . . 0.0 112.007 178.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 61.0 p -71.54 159.31 34.69 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.91 1.284 . . . . 0.0 113.15 160.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -59.8 -28.47 67.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 166.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . 0.254 23.6 ttp-105 -53.13 -49.18 67.08 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 127.772 2.429 . . . . 0.0 113.366 162.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -68.39 -59.38 3.22 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.108 1.763 . . . . 0.0 111.13 170.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mt -44.23 -38.85 4.04 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.991 -2.943 . . . . 0.0 116.481 176.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -53.15 -43.45 67.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 126.761 2.024 . . . . 0.0 115.374 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -112.21 -41.98 3.82 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 120.637 1.562 . . . . 0.0 112.479 -171.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -90.54 -33.1 16.05 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 120.176 -1.578 . . . . 0.0 109.157 -166.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 6.2 tp -84.24 -21.88 31.0 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 119.447 -2.033 . . . . 0.0 114.778 168.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.95 -174.77 28.8 Favored Glycine 0 C--N 1.335 0.508 0 N-CA-C 121.393 3.317 . . . . 0.0 121.393 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.21 68.26 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 111.895 -2.153 . . . . 0.0 115.87 -168.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.58 -13.17 2.77 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 121.191 3.236 . . . . 0.0 121.191 169.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 9.3 tt -60.22 -20.57 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.82 -27.78 58.04 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 120.532 -1.355 . . . . 0.0 111.356 -179.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 93.2 m -64.83 -29.88 70.86 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 127.103 2.161 . . . . 0.0 110.2 172.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 7.5 mm -96.38 -31.17 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 115.835 -2.031 . . . . 0.0 110.98 -174.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 29.7 p -117.57 -0.86 11.78 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 125.425 1.703 . . . . 0.0 113.597 -163.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -124.06 148.94 46.68 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 120.998 -1.064 . . . . 0.0 113.007 172.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 98.79 169.74 31.18 Favored Glycine 0 C--N 1.338 0.639 0 CA-C-O 123.713 1.73 . . . . 0.0 112.19 -171.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 92.7 p -66.63 -34.52 78.06 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -177.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -89.34 10.69 21.48 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 115.195 -2.336 . . . . 0.0 112.022 -176.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 60.4 p -79.3 169.8 17.57 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 126.443 2.339 . . . . 0.0 114.542 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 21.0 tp -51.25 -42.76 61.25 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 116.822 -3.673 . . . . 0.0 113.922 -165.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -97.18 24.17 6.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 124.016 3.098 . . . . 0.0 111.791 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -141.43 -19.99 0.77 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 115.648 -2.12 . . . . 0.0 112.304 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.04 150.87 1.26 Allowed Pre-proline 0 N--CA 1.449 -0.495 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 164.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.54 156.1 62.71 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 CA-C-N 121.886 1.709 . . . . 0.0 113.475 -174.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 70.6 t -77.22 -27.5 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-O 112.757 -3.496 . . . . 0.0 108.338 -161.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -68.79 -29.32 67.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 124.849 3.477 . . . . 0.0 113.509 173.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 18.3 tp -78.75 -45.7 20.53 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 120.472 1.487 . . . . 0.0 108.547 176.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -50.38 -39.31 46.43 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 170.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -74.24 -35.88 63.87 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.235 -1.364 . . . . 0.0 108.347 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 36.2 t90 -81.55 -22.3 37.93 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 118.334 2.716 . . . . 0.0 118.334 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.15 -32.26 70.16 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.971 -0.456 . . . . 0.0 111.709 171.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.98 -35.18 80.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 115.0 1.482 . . . . 0.0 115.0 171.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -83.3 -29.29 28.47 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 118.512 -2.617 . . . . 0.0 115.258 -173.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 t -85.46 -41.24 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 171.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 7.0 mt -88.38 -5.02 58.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 121.771 3.989 . . . . 0.0 121.771 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . 0.286 99.3 mt -129.56 50.6 2.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 125.972 2.045 . . . . 0.0 112.11 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 16.8 pttt -115.1 139.05 50.21 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 117.925 -2.984 . . . . 0.0 113.07 -166.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 44.8 m -123.32 63.39 1.01 Allowed 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 123.011 1.386 . . . . 0.0 108.292 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 33.8 t0 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 116.277 -1.821 . . . . 0.0 113.324 -167.028 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 33.8 ttp . . . . . 0 N--CA 1.471 0.582 0 CA-C-O 122.061 0.934 . . . . 0.0 108.542 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.42 149.56 42.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -167.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 66.3 tt0 -150.9 130.57 13.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 128.249 2.62 . . . . 0.0 113.765 172.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -155.69 146.79 22.47 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 126.85 2.594 . . . . 0.0 109.21 168.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 3.4 p -87.36 167.84 19.68 Favored Pre-proline 0 N--CA 1.45 -0.432 0 C-N-CA 126.159 1.784 . . . . 0.0 108.991 175.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.64 -52.3 2.51 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-N 123.763 2.38 . . . . 0.0 110.808 177.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -141.73 128.87 20.91 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 128.905 2.882 . . . . 0.0 113.295 167.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.6 t -61.21 137.41 58.24 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 118.682 2.845 . . . . 0.0 118.682 -175.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.61 -35.49 72.54 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 131.047 3.739 . . . . 0.0 110.272 170.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.56 -14.23 59.71 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.494 -2.629 . . . . 0.0 112.21 175.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 11.3 mmt -87.14 -31.85 20.18 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.588 1.995 . . . . 0.0 115.381 168.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . 0.303 . . -62.88 -33.69 75.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.369 -2.253 . . . . 0.0 116.324 167.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -61.54 -38.26 86.78 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 128.382 3.551 . . . . 0.0 113.935 168.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -81.56 -35.47 30.2 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 114.179 -2.82 . . . . 0.0 109.534 -169.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.62 -21.5 66.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 117.392 2.367 . . . . 0.0 117.392 174.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -84.57 -37.16 21.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.995 2.118 . . . . 0.0 113.312 173.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -76.86 -37.23 55.96 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 125.08 1.487 . . . . 0.0 111.579 176.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -63.85 -18.99 64.71 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 116.072 -2.251 . . . . 0.0 112.422 166.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 -79.89 -47.61 14.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.835 1.254 . . . . 0.0 110.986 175.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 63.2 mt -52.52 -32.84 42.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.2 -2.333 . . . . 0.0 113.972 170.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 41.5 ttt180 -76.73 -19.49 57.6 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 114.867 -2.492 . . . . 0.0 110.265 173.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -75.56 -41.94 53.56 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 123.91 3.05 . . . . 0.0 114.836 155.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 77.8 t -60.19 -38.24 76.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 121.557 1.98 . . . . 0.0 111.826 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -74.44 -32.12 62.52 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 120.778 3.621 . . . . 0.0 120.778 168.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 21.4 tp -63.1 -44.08 96.69 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 165.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 26.2 tp -67.71 -43.16 80.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 120.462 1.483 . . . . 0.0 109.377 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . 0.451 ' HB3' ' HE2' ' D' ' 27' ' ' LYS . 35.9 ttpt -57.34 -41.43 79.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 118.479 -2.638 . . . . 0.0 115.397 175.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -69.7 -32.49 71.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 116.674 -1.631 . . . . 0.0 110.243 171.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.263 . . -68.7 -20.93 64.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 121.419 1.918 . . . . 0.0 115.239 168.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -66.42 -45.61 79.32 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 123.236 2.744 . . . . 0.0 108.686 170.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -67.33 -5.79 15.88 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.628 -1.92 . . . . 0.0 114.644 -166.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 39.4 p-10 -137.25 16.08 2.99 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 125.428 1.705 . . . . 0.0 112.442 165.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 60.92 33.91 19.7 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 115.927 1.825 . . . . 0.0 115.927 172.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 48.1 mt -93.18 3.1 56.25 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 111.169 -2.741 . . . . 0.0 115.984 161.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.28 -60.68 2.99 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 130.753 3.621 . . . . 0.0 113.741 -178.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.13 -47.89 89.35 Favored Pre-proline 0 N--CA 1.451 -0.421 0 O-C-N 117.376 -3.327 . . . . 0.0 113.866 -174.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -64.01 -18.61 64.34 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 CA-C-N 123.035 2.119 . . . . 0.0 111.0 174.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . 0.315 38.1 tp -64.64 -70.81 0.21 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 123.353 2.797 . . . . 0.0 110.148 167.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 3.9 mt -36.09 -53.32 0.79 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 116.469 -1.729 . . . . 0.0 115.289 170.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . 0.291 26.8 m-20 -74.89 -22.27 58.74 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 116.998 -1.881 . . . . 0.0 111.194 -176.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 35.9 tp -65.65 -38.5 89.54 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 121.723 2.056 . . . . 0.0 112.84 166.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 72.1 mmm -89.85 -32.74 16.76 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 126.191 2.182 . . . . 0.0 114.223 -165.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 73.4 mt -105.61 122.3 45.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 118.041 -2.912 . . . . 0.0 112.888 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . 0.323 73.1 p -57.23 151.82 34.35 Favored Pre-proline 0 N--CA 1.45 -0.47 0 N-CA-C 119.223 3.046 . . . . 0.0 119.223 160.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -42.26 -53.3 3.7 Favored 'Trans proline' 0 N--CA 1.448 -1.201 0 C-N-CA 124.816 3.677 . . . . 0.0 116.864 -175.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.299 0.9 OUTLIER -84.22 -3.93 58.5 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 115.762 -2.066 . . . . 0.0 112.045 -169.704 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -75.41 -44.1 46.44 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 125.863 1.665 . . . . 0.0 109.199 162.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 36.9 mtm-85 -67.61 -33.58 75.27 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 115.318 -2.277 . . . . 0.0 111.781 171.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -67.59 -44.83 77.19 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 175.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.25 . . -56.31 -48.07 77.44 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 121.446 1.93 . . . . 0.0 113.289 176.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 mt -65.78 -39.38 90.94 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.877 -1.765 . . . . 0.0 114.429 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.33 -36.74 53.78 Favored Glycine 0 N--CA 1.448 -0.504 0 O-C-N 119.526 -1.984 . . . . 0.0 113.601 167.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 29.5 m -94.73 -31.83 13.61 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 120.203 -1.763 . . . . 0.0 109.438 -171.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -52.37 -33.84 45.09 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 119.273 3.064 . . . . 0.0 119.273 170.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.46 -39.47 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 N-CA-C 115.932 1.827 . . . . 0.0 115.932 173.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -80.25 -25.08 39.69 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 174.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 78.8 mt -56.22 -50.21 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 O-C-N 120.631 -1.293 . . . . 0.0 112.34 158.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 41.9 t -64.47 -50.54 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 O-C-N 125.338 1.649 . . . . 0.0 114.349 176.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -51.67 -42.28 62.01 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 125.165 2.412 . . . . 0.0 109.823 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -72.78 -19.3 61.38 Favored 'General case' 0 N--CA 1.451 -0.409 1 O-C-N 115.051 -4.78 . . . . 0.0 117.193 178.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 62.8 mt -79.49 -18.93 50.92 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 126.449 2.343 . . . . 0.0 115.425 166.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 10.4 mt -94.83 -25.99 16.39 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.956 2.102 . . . . 0.0 108.548 175.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 31.4 ttm105 -77.23 -38.47 51.17 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 122.627 2.467 . . . . 0.0 110.822 163.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.37 17.63 74.51 Favored Glycine 0 C--N 1.339 0.696 0 CA-C-N 123.441 2.837 . . . . 0.0 116.869 169.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -92.93 -40.49 10.55 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 119.034 1.417 . . . . 0.0 110.841 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 49.5 mtm -75.15 44.51 0.25 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.094 2.558 . . . . 0.0 108.154 173.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 85.5 p -87.24 175.45 8.03 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 119.673 3.212 . . . . 0.0 119.673 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 63.92 -33.33 0.13 Allowed 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 129.918 3.287 . . . . 0.0 112.797 174.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -146.75 -46.13 0.18 Allowed 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 129.119 2.968 . . . . 0.0 108.771 -176.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -75.39 -40.79 57.56 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 117.738 -3.101 . . . . 0.0 118.537 -149.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 tt -62.83 -43.0 99.96 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.81 0.844 . . . . 0.0 109.575 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -54.0 -22.51 10.68 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.133 0.973 . . . . 0.0 112.434 175.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -110.78 -37.56 5.39 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 116.942 2.201 . . . . 0.0 116.942 174.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -64.6 -51.12 64.37 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.435 3.094 . . . . 0.0 115.79 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.37 1.3 mm? -99.23 -22.75 15.48 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.563 1.545 . . . . 0.0 109.884 170.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 77.57 -149.7 35.49 Favored Glycine 0 CA--C 1.523 0.593 1 N-CA-C 123.949 4.34 . . . . 0.0 123.949 166.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -45.51 -24.1 0.29 Allowed 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 128.031 2.842 . . . . 0.0 118.154 -164.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.05 -20.43 79.97 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-O 125.72 2.845 . . . . 0.0 118.984 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . 0.308 2.1 tt -44.31 -39.13 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 111.846 -2.177 . . . . 0.0 114.739 176.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.79 -17.43 44.15 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 129.548 3.139 . . . . 0.0 110.414 -175.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 1.7 m -74.73 -39.61 61.76 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 125.473 2.558 . . . . 0.0 112.598 164.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 15.2 mm -73.62 -19.87 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 120.991 3.7 . . . . 0.0 120.991 173.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 72.5 p -111.54 -40.98 4.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 117.565 -3.209 . . . . 0.0 105.826 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.279 35.0 mtp85 -70.79 169.53 14.39 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 122.765 2.53 . . . . 0.0 114.28 171.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 100.73 133.37 8.11 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 104.763 -3.335 . . . . 0.0 104.763 -174.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -49.68 -24.79 2.44 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -145.11 42.89 1.31 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 127.688 2.395 . . . . 0.0 112.847 -169.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 60.2 p -75.95 -177.93 4.1 Favored 'General case' 0 N--CA 1.45 -0.464 1 O-C-N 129.252 4.095 . . . . 0.0 107.918 174.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.285 3.0 tt -52.98 -31.67 42.05 Favored 'General case' 0 N--CA 1.45 -0.44 1 N-CA-C 122.356 4.206 . . . . 0.0 122.356 160.152 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -72.09 -24.59 61.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.418 1.887 . . . . 0.0 112.214 172.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.69 -19.57 16.0 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.614 -1.66 . . . . 0.0 114.728 -175.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 41.5 84.5 0.18 Allowed Pre-proline 0 N--CA 1.449 -0.489 0 C-N-CA 128.736 2.814 . . . . 0.0 113.581 163.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . 0.573 ' C ' ' H ' ' D' ' 95' ' ' GLU . 50.2 Cg_exo 22.82 54.07 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 O-C-N 115.231 -3.089 . . . . 0.0 112.933 58.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 4.7 t -74.03 31.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 CA-C-O 122.612 1.196 . . . . 0.0 110.325 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . 0.573 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -137.18 -37.42 0.64 Allowed 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 116.199 -1.858 . . . . 0.0 114.788 174.597 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . 0.259 26.4 tp -55.68 -46.46 77.57 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.588 -1.672 . . . . 0.0 109.204 163.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 26.2 ptt180 -65.38 -35.04 79.76 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 117.0 -1.88 . . . . 0.0 114.217 -176.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -71.08 -35.54 71.89 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 115.038 1.495 . . . . 0.0 115.038 -172.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 29.9 t90 -63.65 -46.91 83.48 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 160.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 21.2 mt -63.22 -38.79 92.57 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 122.776 1.274 . . . . 0.0 113.234 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -47.38 -42.71 22.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 117.797 2.517 . . . . 0.0 117.797 163.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -95.15 -20.59 19.13 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 118.349 -2.719 . . . . 0.0 108.352 -166.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 89.8 t -85.61 -32.79 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 128.532 2.733 . . . . 0.0 114.185 165.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 64.9 mt -102.26 -6.09 23.54 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -171.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 51.9 mt -120.54 21.33 11.62 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 119.992 -1.692 . . . . 0.0 108.465 170.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 14.1 pttp -59.59 159.89 7.86 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 116.648 2.092 . . . . 0.0 116.648 -173.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.8 m -71.46 5.64 2.23 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 119.881 3.289 . . . . 0.0 119.881 -172.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 C--O 1.248 0.992 0 C-N-CA 127.167 2.187 . . . . 0.0 112.68 150.33 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.61 -31.61 69.65 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 116.437 -3.914 . . . . 0.0 117.522 -169.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -82.45 -29.14 30.84 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 115.72 -2.086 . . . . 0.0 110.24 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -71.9 -26.83 62.48 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 121.2 1.818 . . . . 0.0 108.113 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.6 p -80.53 172.56 9.5 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 129.069 2.948 . . . . 0.0 109.407 -171.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -64.85 -32.41 55.57 Favored 'Trans proline' 0 N--CA 1.45 -1.076 0 CA-C-O 116.349 -1.604 . . . . 0.0 114.269 -170.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -149.65 132.91 16.43 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.989 2.115 . . . . 0.0 112.007 177.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.2 t -89.8 97.84 11.42 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 124.738 2.209 . . . . 0.0 110.334 -167.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.53 -16.08 44.27 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 112.518 -2.128 . . . . 0.0 111.806 173.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.32 -36.51 29.67 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 120.784 -1.197 . . . . 0.0 108.764 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.5 ttp -74.9 -26.27 59.53 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 125.254 2.454 . . . . 0.0 114.685 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.78 -26.43 67.25 Favored 'General case' 0 N--CA 1.452 -0.346 1 O-C-N 114.173 -5.329 . . . . 0.0 111.616 166.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -88.19 -27.21 21.97 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 127.077 2.151 . . . . 0.0 114.485 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -85.15 -44.01 13.33 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 103.447 -2.797 . . . . 0.0 103.447 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -67.18 -45.63 76.38 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 104.054 -2.573 . . . . 0.0 104.054 -175.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -59.09 -46.29 88.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 117.737 -1.585 . . . . 0.0 114.349 175.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.11 -24.18 67.36 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 120.318 -1.488 . . . . 0.0 108.42 178.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.54 -28.83 61.13 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.969 -2.957 . . . . 0.0 109.569 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -94.52 -33.8 12.93 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 125.53 2.586 . . . . 0.0 112.583 -172.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.7 mt -60.75 -15.06 25.43 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 116.943 -3.598 . . . . 0.0 119.699 163.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -68.87 -48.32 63.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 130.472 3.509 . . . . 0.0 105.39 173.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -71.93 -37.29 70.04 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.549 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.3 t -65.45 -41.19 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-O 124.453 2.073 . . . . 0.0 112.264 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -69.96 -34.66 73.69 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 119.634 -1.916 . . . . 0.0 110.202 172.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 24.5 tp -73.96 -45.72 48.42 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 117.847 -3.033 . . . . 0.0 109.579 -173.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 tp -59.09 -36.59 75.38 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.437 ' HB2' ' CE1' ' B' ' 30' ' ' TYR . 69.8 tttt -62.62 -46.65 87.29 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 112.434 -2.166 . . . . 0.0 115.47 170.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -57.21 -39.19 74.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 126.205 1.802 . . . . 0.0 106.963 172.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.98 -31.27 56.39 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 114.395 -2.716 . . . . 0.0 108.597 -177.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -58.24 -42.2 85.86 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 173.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -75.68 -15.09 60.35 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 127.536 2.334 . . . . 0.0 110.553 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -131.78 16.69 4.76 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.34 3.4 m-20 73.3 1.75 4.1 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 168.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.2 mt -75.29 6.0 4.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.529 1.157 . . . . 0.0 113.562 168.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . 0.341 17.2 p-80 -67.47 -62.39 1.44 Allowed 'General case' 0 N--CA 1.451 -0.416 1 O-C-N 113.847 -5.533 . . . . 0.0 111.564 -166.436 . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.262 26.7 mt -49.1 -46.79 76.12 Favored Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-O 114.115 -2.85 . . . . 0.0 117.338 167.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -58.96 -42.88 47.71 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 124.665 3.577 . . . . 0.0 113.089 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 17.7 tp -69.69 -46.83 65.14 Favored 'General case' 0 N--CA 1.452 -0.372 1 O-C-N 115.025 -4.797 . . . . 0.0 110.726 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 74.7 mt -55.16 -42.46 73.15 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 126.416 2.323 . . . . 0.0 115.577 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -77.82 -4.6 47.35 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.084 1.353 . . . . 0.0 113.388 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 23.6 tp -99.36 -29.13 12.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 114.144 -2.836 . . . . 0.0 113.276 169.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 59.8 mmm -107.72 -9.48 15.81 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.076 2.11 . . . . 0.0 116.543 -177.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.5 mp -118.36 152.11 36.46 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 118.839 -2.413 . . . . 0.0 109.339 159.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.8 p -110.46 165.45 12.66 Favored Pre-proline 0 N--CA 1.452 -0.343 0 C-N-CA 124.972 1.309 . . . . 0.0 107.79 -170.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -61.34 -40.68 47.2 Favored 'Trans proline' 0 N--CA 1.446 -1.315 0 C-N-CA 124.307 3.338 . . . . 0.0 117.994 -163.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -22.56 62.56 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 116.632 -1.651 . . . . 0.0 109.969 176.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -72.0 -41.86 67.1 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 121.219 1.827 . . . . 0.0 112.517 175.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 20.6 mtm180 -65.23 -49.82 68.2 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 123.946 0.899 . . . . 0.0 110.944 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -55.92 -39.3 71.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 171.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.43 -37.15 84.56 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 117.261 -1.352 . . . . 0.0 110.14 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 30.2 mt -74.88 -27.88 60.42 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 124.664 3.393 . . . . 0.0 110.571 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.41 -44.39 98.09 Favored Glycine 0 CA--C 1.522 0.517 0 O-C-N 119.757 -1.839 . . . . 0.0 113.67 171.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -60.66 -32.13 71.33 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.288 1.435 . . . . 0.0 114.131 171.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.262 93.9 mtt180 -68.67 -34.42 75.66 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.545 -0.74 . . . . 0.0 111.232 -177.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.96 -48.21 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 168.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -55.01 -39.43 69.07 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 112.624 -3.56 . . . . 0.0 114.473 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 52.8 mt -63.43 -49.13 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 123.285 2.766 . . . . 0.0 111.849 167.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.0 -35.33 71.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 O-C-N 117.772 -3.08 . . . . 0.0 108.541 -174.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -60.45 -54.53 44.4 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 118.824 -2.423 . . . . 0.0 108.686 174.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -60.5 -27.6 67.72 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 171.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.5 mt -76.28 -25.31 54.77 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 117.456 -3.277 . . . . 0.0 111.149 176.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.9 mt -92.35 -40.06 11.12 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 127.725 2.41 . . . . 0.0 112.226 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.6 ttm105 -46.73 -56.49 6.11 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 117.044 -3.535 . . . . 0.0 112.454 148.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.67 44.94 61.12 Favored Glycine 0 C--N 1.337 0.611 0 C-N-CA 117.602 -2.237 . . . . 0.0 112.702 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -121.04 -52.08 2.09 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 127.653 2.381 . . . . 0.0 114.762 178.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.0 mtt -67.7 130.81 44.17 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 119.101 -2.249 . . . . 0.0 114.516 175.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.1 p -83.54 178.32 8.05 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 120.459 1.481 . . . . 0.0 110.033 -178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -63.87 -46.45 84.92 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 116.507 -2.077 . . . . 0.0 112.855 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.9 tpt85 -63.01 -10.07 12.46 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 119.792 3.256 . . . . 0.0 119.792 170.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -86.66 -42.89 13.05 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 120.938 1.699 . . . . 0.0 110.668 165.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 19.8 mt -63.83 -26.32 68.57 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.963 -1.71 . . . . 0.0 111.259 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -63.45 -21.81 66.52 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.356 1.062 . . . . 0.0 111.427 -176.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -102.08 -53.03 3.02 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 129.36 3.064 . . . . 0.0 111.125 166.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -74.59 -27.06 60.32 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 124.011 3.096 . . . . 0.0 115.523 -168.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.4 mt -121.83 -5.23 9.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 118.707 2.854 . . . . 0.0 118.707 170.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 82.35 5.15 89.83 Favored Glycine 0 CA--C 1.523 0.555 0 CA-C-O 116.137 -2.48 . . . . 0.0 115.027 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.67 138.78 43.08 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 117.438 2.384 . . . . 0.0 117.438 -170.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.73 171.53 55.13 Favored Glycine 0 C--N 1.34 0.779 0 CA-C-O 124.552 2.196 . . . . 0.0 116.159 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.8 mt -54.31 -59.29 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 1 O-C-N 115.096 -4.767 . . . . 0.0 112.656 173.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.11 -34.96 75.79 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.99 1.716 . . . . 0.0 113.842 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.15 -36.2 66.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 124.121 0.968 . . . . 0.0 110.538 177.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.39 49.7 mm -69.33 -45.15 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 O-C-N 118.465 -2.647 . . . . 0.0 114.338 164.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.1 m -65.36 -52.35 54.26 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.629 -177.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -74.55 -32.86 62.57 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 121.201 1.818 . . . . 0.0 110.462 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.12 -34.97 90.75 Favored Glycine 0 C--N 1.338 0.668 0 O-C-N 120.142 -1.599 . . . . 0.0 111.566 169.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.0 m -68.67 -45.0 72.87 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.126 -2.985 . . . . 0.0 111.036 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -57.94 -40.87 81.57 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 172.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 75.8 m -72.16 -25.94 61.89 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 113.656 -1.611 . . . . 0.0 113.848 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.6 tp -71.0 -33.09 70.06 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 166.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -69.04 -32.51 72.07 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 113.491 -3.147 . . . . 0.0 112.193 169.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.91 -5.68 40.09 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 128.109 3.381 . . . . 0.0 114.892 170.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.4 143.0 87.33 Favored Pre-proline 0 N--CA 1.448 -0.538 1 O-C-N 115.679 -4.388 . . . . 0.0 108.692 172.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -73.2 149.15 45.31 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 123.574 2.849 . . . . 0.0 110.202 175.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.2 m -65.98 -32.47 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 116.873 -3.642 . . . . 0.0 107.953 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.265 18.2 pm0 -65.07 -26.24 68.15 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 119.92 1.236 . . . . 0.0 111.192 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 48.2 tp -80.99 -41.9 22.02 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 116.757 -1.592 . . . . 0.0 110.853 177.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -68.59 -38.09 80.37 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 121.89 2.132 . . . . 0.0 111.79 176.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -53.79 -37.27 63.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 129.534 3.133 . . . . 0.0 111.815 168.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 34.2 t90 -77.19 -49.69 14.61 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.891 1.276 . . . . 0.0 109.098 176.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 79.1 mt -68.64 -33.42 73.99 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 -174.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.21 -36.18 81.16 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 121.64 2.018 . . . . 0.0 113.855 169.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -74.55 -34.43 62.94 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 118.959 -2.338 . . . . 0.0 114.548 170.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.4 t -70.55 -44.07 77.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 O-C-N 119.589 -1.944 . . . . 0.0 110.184 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . 0.286 12.0 mt -97.34 -27.98 14.24 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -172.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.6 mt -103.82 19.81 19.26 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 117.162 -3.461 . . . . 0.0 114.991 -167.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -126.61 17.13 7.53 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 119.848 -1.783 . . . . 0.0 115.417 -170.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.8 m -99.54 -58.44 1.93 Allowed 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 126.779 2.549 . . . . 0.0 110.388 -168.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 . . . . . 0 C--O 1.252 1.198 0 N-CA-C 117.38 2.363 . . . . 0.0 117.38 -173.88 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 24.5 ttp . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.67 -16.98 63.64 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 126.719 2.512 . . . . 0.0 111.467 -159.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -86.85 -22.01 26.04 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 120.527 -1.358 . . . . 0.0 110.738 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -69.75 -37.24 76.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.23 -2.169 . . . . 0.0 110.616 172.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 14.6 m -75.21 143.71 77.39 Favored Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.865 -167.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -52.13 -42.76 57.43 Favored 'Trans proline' 0 N--CA 1.449 -1.121 1 C-N-CA 126.916 5.077 . . . . 0.0 112.369 163.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -116.83 148.06 41.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.138 1.775 . . . . 0.0 114.838 173.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 13.8 t -148.09 132.48 17.58 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.713 1.605 . . . . 0.0 111.823 158.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.23 -44.91 43.9 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 124.907 2.289 . . . . 0.0 110.204 163.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.91 -24.02 62.38 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 116.617 -3.802 . . . . 0.0 109.581 -172.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 4.0 mtt -87.61 -43.0 12.3 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 103.95 -2.611 . . . . 0.0 103.95 -176.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.65 -37.36 63.05 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 128.114 2.566 . . . . 0.0 116.183 170.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -66.23 -57.27 7.94 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 130.559 3.544 . . . . 0.0 107.724 -178.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -47.93 -46.14 31.71 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 129.397 3.079 . . . . 0.0 115.394 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -74.7 -43.27 55.99 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 126.407 1.883 . . . . 0.0 109.837 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -62.9 -26.66 68.9 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.179 1.354 . . . . 0.0 114.393 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -73.81 -50.72 19.14 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 116.278 -1.82 . . . . 0.0 110.581 174.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -43.12 -51.84 5.72 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 127.718 3.136 . . . . 0.0 114.26 163.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 -57.09 -49.84 74.64 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.934 1.694 . . . . 0.0 115.028 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 38.7 mt -63.46 -23.34 67.36 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 119.751 -1.843 . . . . 0.0 112.009 -176.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . 0.259 67.5 ttt180 -67.93 -30.19 69.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.788 2.035 . . . . 0.0 112.301 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -79.77 -36.83 36.59 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 115.899 -2.0 . . . . 0.0 111.358 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 20.9 t -59.28 -39.69 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 O-C-N 126.402 2.314 . . . . 0.0 112.914 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -80.1 -35.23 37.17 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 116.464 -1.732 . . . . 0.0 114.872 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 25.8 tp -58.74 -47.43 84.66 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 126.175 2.893 . . . . 0.0 114.63 168.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 28.8 tp -70.53 -32.93 70.58 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 116.863 -3.648 . . . . 0.0 112.526 -177.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . 0.317 59.2 tttt -49.7 -50.59 43.21 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 126.318 2.961 . . . . 0.0 110.854 165.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -81.91 -20.04 39.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 116.958 -3.588 . . . . 0.0 111.51 -174.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.49 -36.32 57.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 172.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . 0.437 ' CE1' ' HB2' ' A' ' 27' ' ' LYS . 6.3 m-85 -50.53 -39.73 49.78 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 170.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -90.28 6.28 43.6 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.375 2.361 . . . . 0.0 117.375 178.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -119.67 6.21 11.01 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 119.409 -2.057 . . . . 0.0 107.93 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 57.82 43.5 21.65 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 117.231 -3.418 . . . . 0.0 112.793 -173.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 89.3 mt -125.15 5.51 7.86 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.46 -2.65 . . . . 0.0 111.523 -174.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -62.76 -39.49 94.31 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 119.197 -2.189 . . . . 0.0 113.555 -178.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' B' ' 36' ' ' LEU . 12.3 mt -66.54 -52.42 35.59 Favored Pre-proline 0 N--CA 1.446 -0.662 1 O-C-N 115.21 -4.681 . . . . 0.0 109.143 -173.281 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -70.53 -26.16 24.26 Favored 'Trans proline' 0 N--CA 1.447 -1.215 0 C-N-CA 121.665 1.576 . . . . 0.0 110.833 -177.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 tp -64.76 -44.47 89.93 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.583 1.553 . . . . 0.0 114.864 174.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 83.1 mt -78.84 -32.03 45.97 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.848 2.459 . . . . 0.0 111.456 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -62.33 -28.06 69.48 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 123.567 2.894 . . . . 0.0 109.276 165.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 51.6 tp -89.36 -34.79 16.4 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.643 1.977 . . . . 0.0 113.844 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 16.6 mmt -86.99 -21.47 26.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 115.085 -2.388 . . . . 0.0 112.077 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 44.5 mt -137.81 124.55 21.08 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 128.891 2.876 . . . . 0.0 110.153 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 77.1 p -68.9 166.79 24.23 Favored Pre-proline 0 N--CA 1.451 -0.423 0 C-N-CA 124.769 1.228 . . . . 0.0 112.292 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -40.54 -52.51 3.07 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 124.65 3.567 . . . . 0.0 113.726 167.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -66.7 -24.63 66.28 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 121.719 2.054 . . . . 0.0 114.816 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -83.49 -33.79 25.49 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 127.296 2.239 . . . . 0.0 115.912 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 56.6 mtm-85 -72.71 -40.53 66.11 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 127.442 2.297 . . . . 0.0 108.848 177.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.286 38.8 tt0 -63.57 -37.47 87.45 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 126.579 2.425 . . . . 0.0 115.688 176.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.7 -53.44 58.01 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.987 174.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.0 mt -59.14 -37.48 77.37 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 121.134 3.753 . . . . 0.0 121.134 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.19 -30.73 74.6 Favored Glycine 0 CA--C 1.523 0.594 0 C-N-CA 126.638 2.066 . . . . 0.0 115.313 166.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 74.1 m -87.29 -45.08 10.92 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 112.191 -3.766 . . . . 0.0 104.221 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -51.01 -45.93 61.35 Favored 'General case' 0 N--CA 1.452 -0.359 1 CA-C-N 126.227 4.103 . . . . 0.0 109.879 176.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.0 t -50.62 -55.07 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 116.627 -1.654 . . . . 0.0 111.773 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -56.18 -35.02 66.77 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 116.116 1.895 . . . . 0.0 116.116 172.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 80.7 mt -67.55 -45.37 85.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 120.545 1.521 . . . . 0.0 113.33 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 43.7 t -83.56 -1.9 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 126.285 1.834 . . . . 0.0 114.608 -172.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . 0.292 57.4 tt0 -92.36 -28.21 17.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.062 -1.829 . . . . 0.0 106.062 171.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -78.57 -20.96 49.4 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 126.467 1.907 . . . . 0.0 115.616 177.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 91.9 mt -63.93 -33.79 76.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 160.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . 0.267 13.2 mt -77.03 -33.27 57.37 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 120.6 3.556 . . . . 0.0 120.6 174.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 37.4 ttm105 -87.42 -58.67 2.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 127.867 3.229 . . . . 0.0 108.5 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.71 39.5 20.93 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 118.98 2.352 . . . . 0.0 118.98 175.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -123.5 -6.09 8.15 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 117.705 -1.141 . . . . 0.0 111.648 -168.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 5.1 mtt -83.37 152.33 25.1 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 30.5 p -83.45 159.56 21.73 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 117.662 -3.149 . . . . 0.0 115.989 157.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -61.97 -31.15 71.48 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 119.86 -1.775 . . . . 0.0 109.119 -173.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -59.29 -39.76 84.03 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 119.275 -2.141 . . . . 0.0 114.497 171.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -72.1 -38.1 69.41 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 119.822 -1.799 . . . . 0.0 108.5 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 46.3 mt -55.98 -48.85 75.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 118.95 -2.344 . . . . 0.0 107.554 176.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -66.39 -40.3 89.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 116.505 -2.078 . . . . 0.0 114.881 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -99.38 -17.86 17.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 125.691 2.663 . . . . 0.0 117.317 -164.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -105.2 -49.62 3.42 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 128.98 2.912 . . . . 0.0 112.236 176.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 60.7 mt -95.85 -4.83 42.98 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 126.452 2.345 . . . . 0.0 113.604 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.84 19.27 60.74 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-O 118.895 -0.947 . . . . 0.0 114.14 -178.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -100.79 118.25 36.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 116.418 2.007 . . . . 0.0 116.418 -165.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.01 167.98 54.36 Favored Glycine 0 CA--C 1.523 0.556 1 CA-C-O 128.364 4.313 . . . . 0.0 110.688 174.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 80.6 mt -52.23 -39.71 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 O-C-N 116.467 -3.961 . . . . 0.0 112.399 171.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . 0.275 . . -78.65 -39.29 37.39 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 116.798 -3.689 . . . . 0.0 115.013 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 9.2 m -56.92 -36.82 70.65 Favored 'General case' 0 N--CA 1.454 -0.272 1 O-C-N 114.22 -5.3 . . . . 0.0 113.171 166.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 14.3 mm -64.1 -53.07 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 170.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 24.1 m -55.07 -48.28 73.74 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 121.309 1.868 . . . . 0.0 114.455 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 20.1 ttt180 -63.88 -41.37 97.76 Favored 'General case' 0 N--CA 1.451 -0.408 1 O-C-N 116.239 -4.038 . . . . 0.0 112.524 175.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.68 -46.82 66.04 Favored Glycine 0 C--N 1.334 0.46 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 172.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m -71.6 -29.66 64.93 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 117.008 -1.472 . . . . 0.0 113.953 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -61.27 -58.79 6.82 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 119.79 1.177 . . . . 0.0 111.119 169.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -60.04 -33.24 71.75 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.078 2.151 . . . . 0.0 114.225 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 20.2 mt -58.69 -36.25 73.92 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 113.59 -3.1 . . . . 0.0 114.446 162.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 58.8 mttt -70.33 1.79 4.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 122.6 2.455 . . . . 0.0 112.39 173.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -117.52 -5.79 11.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 127.897 2.479 . . . . 0.0 115.761 174.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.4 131.84 64.15 Favored Pre-proline 0 N--CA 1.448 -0.567 0 C-N-CA 124.225 1.01 . . . . 0.0 109.809 -174.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -61.69 153.27 68.51 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 117.843 -0.971 . . . . 0.0 109.839 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.0 m -55.89 -33.77 35.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 126.52 2.388 . . . . 0.0 114.084 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 -74.49 -27.89 60.76 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 117.508 2.41 . . . . 0.0 117.508 -177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 52.7 tp -66.34 -50.79 62.38 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 117.343 -3.348 . . . . 0.0 111.437 164.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 15.3 mtm180 -61.47 -45.02 96.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 -173.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -53.98 -38.8 65.43 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 118.679 -2.513 . . . . 0.0 115.651 163.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -74.16 -35.44 64.03 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.42 -31.31 72.43 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 175.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -75.54 -18.78 59.68 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 124.488 1.117 . . . . 0.0 113.035 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -84.6 -31.85 24.07 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 131.617 3.967 . . . . 0.0 115.663 170.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 84.8 t -104.68 -52.63 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 116.287 -1.816 . . . . 0.0 111.956 -170.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 79.1 mt -76.41 -50.11 14.98 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 121.446 1.93 . . . . 0.0 108.665 -173.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 45.0 mt -67.91 -30.45 69.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.226 2.204 . . . . 0.0 110.376 -173.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . 0.283 89.1 mttt -70.06 -11.69 61.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 120.038 -1.664 . . . . 0.0 114.281 172.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.3 m -82.31 -9.37 59.5 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 116.554 -3.842 . . . . 0.0 116.506 168.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 . . . . . 0 C--O 1.248 1.013 0 CA-C-N 123.608 2.913 . . . . 0.0 112.428 170.165 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 14.9 ttt . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 124.975 2.321 . . . . 0.0 108.466 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.53 159.44 31.28 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 111.867 -2.424 . . . . 0.0 114.166 -168.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -131.86 148.4 52.54 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -127.09 127.22 44.3 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 128.462 2.705 . . . . 0.0 110.943 169.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 5' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 74.5 p -119.95 167.92 11.41 Favored Pre-proline 0 N--CA 1.451 -0.382 0 O-C-N 127.735 3.147 . . . . 0.0 113.45 168.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' C' ' 5' ' ' SER 0.269 87.4 Cg_exo -59.52 -31.59 94.84 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.983 3.122 . . . . 0.0 117.18 179.535 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . 0.271 68.9 t80 -148.66 141.56 24.74 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 119.346 -2.096 . . . . 0.0 108.539 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 2.7 t -141.37 120.89 13.26 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.443 -1.253 . . . . 0.0 112.328 166.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.82 -5.74 22.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 121.558 3.91 . . . . 0.0 121.558 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.91 -17.02 59.2 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 117.596 2.443 . . . . 0.0 117.596 171.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 33.1 mtt -86.58 -39.31 16.29 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 126.215 1.806 . . . . 0.0 108.015 173.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.07 -28.06 54.5 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 177.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -70.89 -28.93 64.9 Favored 'General case' 0 N--CA 1.449 -0.494 1 O-C-N 116.287 -4.008 . . . . 0.0 109.942 170.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -76.07 -31.66 58.88 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 115.86 -2.019 . . . . 0.0 113.457 171.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -35.34 79.09 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 121.535 1.97 . . . . 0.0 109.576 165.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -66.29 -49.56 66.67 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 125.92 2.012 . . . . 0.0 107.414 -174.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 71.4 mm-40 -63.9 -30.58 71.65 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -67.36 -34.31 77.03 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.199 -2.188 . . . . 0.0 109.207 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . 0.465 ' CE2' ' HD2' ' D' ' 48' ' ' ARG . 58.3 t-105 -82.98 -40.27 20.24 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 -175.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 21.8 mt -64.85 -37.14 86.62 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 117.463 -1.695 . . . . 0.0 112.318 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -53.59 -36.78 62.31 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 128.172 2.589 . . . . 0.0 113.627 167.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . 0.274 75.7 t80 -52.24 -59.92 3.82 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 127.239 2.216 . . . . 0.0 106.153 171.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 98.8 t -74.38 -32.48 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 125.162 1.538 . . . . 0.0 110.671 -170.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -68.4 -34.34 75.86 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 116.698 -3.751 . . . . 0.0 112.02 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 35.8 tp -77.44 -28.35 52.44 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 119.095 -2.253 . . . . 0.0 109.276 174.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 15.6 tp -70.72 -28.33 64.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 115.652 -2.118 . . . . 0.0 113.848 170.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp -88.11 -28.66 21.15 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 121.901 2.137 . . . . 0.0 110.365 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -60.98 -28.67 69.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.863 1.665 . . . . 0.0 110.952 164.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.44 -7.22 48.68 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 122.98 1.371 . . . . 0.0 111.786 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -99.64 0.75 42.66 Favored 'General case' 0 N--CA 1.451 -0.402 1 O-C-N 115.968 -4.207 . . . . 0.0 110.89 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -70.69 -36.56 73.34 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 124.474 3.306 . . . . 0.0 111.402 175.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 49.8 p-10 -124.1 17.65 9.2 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 120.408 -1.432 . . . . 0.0 108.859 -171.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.292 4.2 m-20 56.31 32.55 20.64 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 116.939 2.2 . . . . 0.0 116.939 -175.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 21.9 mt -89.2 10.04 23.51 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.105 -2.872 . . . . 0.0 107.567 173.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -58.23 -47.03 84.8 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 123.011 2.641 . . . . 0.0 110.96 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.283 62.8 mt -67.55 -44.61 45.16 Favored Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-O 113.227 -3.273 . . . . 0.0 110.466 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -70.27 -20.3 32.6 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 CA-C-N 123.731 2.368 . . . . 0.0 111.629 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 26.5 tp -81.17 -30.02 34.5 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 122.088 2.222 . . . . 0.0 115.215 167.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 75.1 mt -65.34 -27.98 68.97 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 120.452 -1.405 . . . . 0.0 111.795 165.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -92.94 -0.64 57.18 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 126.913 2.085 . . . . 0.0 109.235 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 30.7 tp -100.63 -44.41 5.84 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 127.939 3.733 . . . . 0.0 115.106 167.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . 0.252 9.1 mmt -77.57 -36.47 52.04 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 117.51 -3.244 . . . . 0.0 114.284 -175.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.53 152.6 33.77 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 125.128 1.518 . . . . 0.0 111.787 -173.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 27.8 p -76.46 162.43 70.94 Favored Pre-proline 0 N--CA 1.452 -0.347 0 C-N-CA 127.024 2.129 . . . . 0.0 115.909 163.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -56.9 -37.29 98.62 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 CA-C-N 124.241 2.55 . . . . 0.0 116.72 -176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -79.61 -4.32 51.04 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 127.985 3.303 . . . . 0.0 114.871 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -97.38 -16.58 20.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.006 -1.452 . . . . 0.0 113.39 171.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -84.5 -44.62 13.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 117.613 -1.184 . . . . 0.0 111.02 167.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -57.4 -43.9 84.08 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 104.31 -2.478 . . . . 0.0 104.31 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.05 -40.61 64.96 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 118.62 -2.55 . . . . 0.0 110.887 -169.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . 0.409 HD22 ' CE2' ' D' ' 22' ' ' PHE . 3.3 mt -60.29 -45.63 92.68 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 125.427 2.537 . . . . 0.0 108.988 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.66 -43.26 96.36 Favored Glycine 0 CA--C 1.524 0.652 0 CA-C-O 116.781 -2.122 . . . . 0.0 111.667 173.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 60.6 m -60.37 -42.67 96.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.152 1.976 . . . . 0.0 112.982 173.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.309 96.0 mtt180 -57.61 -24.61 57.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 119.716 -1.865 . . . . 0.0 112.543 -172.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 98.5 t -63.8 -38.84 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 106.322 -1.732 . . . . 0.0 106.322 178.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 68.2 mtp180 -83.27 -15.53 49.87 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 123.855 1.788 . . . . 0.0 112.048 -171.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 32.6 mt -74.95 -47.23 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 C-N-CA 126.272 1.829 . . . . 0.0 106.522 169.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 35.1 t -61.16 -48.98 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 122.602 1.192 . . . . 0.0 113.553 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -49.83 -42.54 47.48 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 117.44 2.385 . . . . 0.0 117.44 173.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -69.4 -50.74 43.2 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 115.149 -2.357 . . . . 0.0 109.684 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 mt -66.06 -7.22 16.17 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 123.238 2.744 . . . . 0.0 117.464 177.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 80.1 mt -93.74 -33.25 13.69 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.449 2.3 . . . . 0.0 110.387 167.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 45.5 ttm180 -80.02 -38.7 31.47 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.54 22.23 74.95 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 122.672 3.829 . . . . 0.0 122.672 170.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -83.54 -16.08 46.84 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 116.665 -3.844 . . . . 0.0 115.763 165.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 35.4 mtt -77.96 130.13 36.16 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 117.708 -1.597 . . . . 0.0 113.095 173.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 81.7 p -80.8 168.31 18.94 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 124.065 0.853 . . . . 0.0 111.992 159.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -41.37 -43.63 2.57 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 130.023 3.329 . . . . 0.0 110.52 172.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -52.77 -41.62 64.25 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 118.05 -2.906 . . . . 0.0 112.263 -176.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -90.38 -38.3 13.41 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 131.592 3.957 . . . . 0.0 109.616 -169.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 62.8 mt -62.23 -21.49 65.2 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 120.133 -1.604 . . . . 0.0 111.689 174.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 31.7 tttp -80.46 -46.43 15.93 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 118.133 -1.427 . . . . 0.0 113.199 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -86.59 -54.0 4.65 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 119.02 -2.3 . . . . 0.0 112.506 -176.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -71.41 -32.97 69.01 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.327 -1.483 . . . . 0.0 113.67 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 mp -101.22 -3.24 29.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 116.447 2.017 . . . . 0.0 116.447 174.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 72.23 -142.17 32.46 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-O 117.112 -1.938 . . . . 0.0 112.698 159.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -99.48 -7.04 26.56 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 131.446 3.899 . . . . 0.0 114.169 164.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.38 -32.45 52.07 Favored Glycine 0 C--N 1.337 0.595 0 C-N-CA 126.778 2.132 . . . . 0.0 112.567 172.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 13.1 tt -54.29 -40.9 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-O 114.705 -2.569 . . . . 0.0 117.161 175.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.65 -34.28 77.85 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.148 1.53 . . . . 0.0 109.972 -178.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 31.5 m -60.25 -33.13 71.87 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 115.418 -2.229 . . . . 0.0 114.054 168.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 28.1 mm -88.97 -17.41 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 126.825 2.05 . . . . 0.0 111.492 -177.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.2 p -117.48 -19.73 9.35 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -165.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -119.23 151.03 39.1 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 118.494 -2.629 . . . . 0.0 114.609 -175.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.7 170.0 44.17 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 120.879 3.111 . . . . 0.0 120.879 -164.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 67.8 p -84.96 0.85 49.89 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 118.103 -2.998 . . . . 0.0 113.654 -168.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -117.98 5.93 12.13 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.74 2.416 . . . . 0.0 114.325 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 74.6 p -61.14 158.35 14.03 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 119.939 3.311 . . . . 0.0 119.939 175.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 15.7 tp -57.11 -28.18 62.45 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 120.016 -1.677 . . . . 0.0 115.41 -163.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -103.4 16.67 25.93 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -119.68 -7.78 10.02 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 128.181 2.592 . . . . 0.0 112.867 169.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.64 163.32 61.74 Favored Pre-proline 0 N--CA 1.451 -0.379 0 C-N-CA 128.167 2.587 . . . . 0.0 109.587 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -61.63 146.68 96.63 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.504 2.803 . . . . 0.0 110.506 -176.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 12.9 t -67.15 -42.34 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 CA-C-N 113.376 -1.738 . . . . 0.0 113.42 -178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pm0 -56.5 -12.05 1.56 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 160.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . 0.285 14.3 tp -93.36 -41.3 9.92 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.632 -3.168 . . . . 0.0 115.073 164.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -51.68 -34.1 36.87 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 129.243 3.017 . . . . 0.0 113.69 167.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -94.47 -42.13 9.01 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 116.795 -1.574 . . . . 0.0 108.148 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -58.14 -40.49 81.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 116.713 -1.613 . . . . 0.0 113.562 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 82.6 mt -62.61 -38.67 91.09 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 125.707 1.879 . . . . 0.0 110.696 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -71.68 -8.23 52.88 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 172.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -99.25 -5.72 29.35 Favored 'General case' 0 N--CA 1.447 -0.595 2 CA-C-N 127.383 4.628 . . . . 0.0 110.75 175.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 90.0 t -125.49 -42.97 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.675 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 8.3 mt -80.6 -15.24 57.11 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.95 -2.344 . . . . 0.0 109.786 -176.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 83.9 mt -136.42 15.76 3.19 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 116.84 2.163 . . . . 0.0 116.84 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -74.09 132.5 42.35 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 118.441 -2.662 . . . . 0.0 116.409 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 1.5 m -111.49 3.79 18.34 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.964 1.706 . . . . 0.0 112.231 -168.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 17.1 t70 . . . . . 0 C--O 1.247 0.932 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 174.727 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 43.6 ttp . . . . . 0 N--CA 1.473 0.682 0 CA-C-O 116.497 -1.715 . . . . 0.0 113.691 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.95 165.15 22.91 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.267 0.939 . . . . 0.0 111.028 176.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -172.86 133.0 0.55 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.556 1.942 . . . . 0.0 110.268 -169.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -145.93 131.84 19.16 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 120.313 3.449 . . . . 0.0 120.313 -176.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 79.1 p -68.37 133.78 91.16 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 113.934 -2.936 . . . . 0.0 110.7 171.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.42 -27.97 46.68 Favored 'Trans proline' 0 N--CA 1.448 -1.148 1 C-N-CA 128.105 5.87 . . . . 0.0 113.973 -176.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -142.81 145.13 32.91 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 143.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 31.0 t -70.93 129.26 38.57 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 125.435 2.54 . . . . 0.0 110.829 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.45 -19.34 50.12 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 128.911 2.884 . . . . 0.0 108.485 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . 0.252 . . -67.61 -50.85 56.17 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 128.18 2.592 . . . . 0.0 110.285 167.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 17.1 mmt -63.27 -41.64 99.05 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 119.368 -2.082 . . . . 0.0 110.509 168.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.42 -33.62 72.77 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 120.588 1.54 . . . . 0.0 114.427 -176.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -51.89 -65.21 0.6 Allowed 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 119.157 -2.214 . . . . 0.0 114.114 158.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -52.05 -35.5 47.48 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 118.53 2.789 . . . . 0.0 118.53 -174.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -34.67 78.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 120.261 -1.524 . . . . 0.0 113.768 171.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -78.76 -25.01 44.39 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 112.394 -3.67 . . . . 0.0 108.148 165.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -72.0 -33.33 67.99 Favored 'General case' 0 N--CA 1.45 -0.465 1 CA-C-N 126.17 4.077 . . . . 0.0 115.351 177.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -70.03 -25.25 63.49 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.095 1.758 . . . . 0.0 112.09 174.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 24.9 t-105 -79.83 -52.34 8.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 127.264 2.852 . . . . 0.0 106.451 177.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 61.5 mt -49.77 -32.97 15.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 116.762 2.134 . . . . 0.0 116.762 167.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -73.07 -31.0 64.1 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.611 1.564 . . . . 0.0 114.011 176.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . 0.409 ' CE2' HD22 ' C' ' 51' ' ' LEU . 69.3 t80 -69.07 -46.43 67.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 126.656 2.472 . . . . 0.0 115.062 165.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 77.5 t -59.07 -36.92 65.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 120.255 1.389 . . . . 0.0 110.787 175.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . 0.326 20.8 t70 -61.26 -62.98 1.45 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 127.081 2.152 . . . . 0.0 111.7 169.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 13.2 tp -47.68 -42.98 26.09 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 115.493 -2.194 . . . . 0.0 110.352 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 60.1 tp -71.27 -50.96 27.34 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 127.765 2.426 . . . . 0.0 108.8 -174.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -56.35 -35.21 67.38 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.072 -2.268 . . . . 0.0 114.249 170.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -68.52 -40.46 80.77 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 116.962 -1.895 . . . . 0.0 110.597 173.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.76 -15.32 62.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 127.219 2.208 . . . . 0.0 113.578 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . 0.298 18.3 m-30 -75.26 -26.2 58.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 118.034 -2.916 . . . . 0.0 111.007 161.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -83.91 -23.95 30.97 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 124.288 3.222 . . . . 0.0 114.788 -168.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -103.28 4.74 36.89 Favored 'General case' 0 N--CA 1.451 -0.397 1 N-CA-C 121.863 4.024 . . . . 0.0 121.863 153.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.261 39.9 m-20 68.11 26.56 7.14 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.593 1.957 . . . . 0.0 113.762 170.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 91.1 mt -93.94 5.67 50.92 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.12 2.568 . . . . 0.0 113.294 175.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -52.79 59.83 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.531 2.332 . . . . 0.0 114.063 176.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.7 -45.91 66.79 Favored Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-O 115.808 -2.044 . . . . 0.0 108.758 -168.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.251 26.5 Cg_endo -64.4 -28.57 62.76 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 CA-C-N 122.428 1.903 . . . . 0.0 113.211 176.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 44.4 tp -68.2 -50.17 55.96 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 95.4 mt -58.28 -38.37 76.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.542 1.537 . . . . 0.0 114.128 166.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . 0.395 6.1 m-20 -68.01 -29.64 68.7 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 117.503 -1.237 . . . . 0.0 111.04 177.214 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 17.1 tp -75.29 -35.41 61.31 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 123.247 1.499 . . . . 0.0 113.439 172.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 7.4 mmm -87.24 -19.97 27.57 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 116.154 -2.218 . . . . 0.0 114.359 -176.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 93.8 mt -125.78 126.4 44.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.534 -2.604 . . . . 0.0 107.968 -172.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 61.8 p -62.67 157.97 54.34 Favored Pre-proline 0 N--CA 1.449 -0.524 0 CA-C-O 114.152 -2.832 . . . . 0.0 117.646 174.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -59.69 -37.42 87.67 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 CA-C-N 125.429 2.975 . . . . 0.0 117.221 -173.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -63.68 -31.81 73.1 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 120.44 -1.413 . . . . 0.0 113.327 169.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -73.15 -30.13 63.37 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 120.351 -1.468 . . . . 0.0 110.958 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . 0.465 ' HD2' ' CE2' ' C' ' 19' ' ' TRP . 77.9 mtm-85 -76.59 -41.17 47.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.933 2.093 . . . . 0.0 111.898 176.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -54.96 -60.44 3.37 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 125.379 1.472 . . . . 0.0 111.933 166.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.15 -43.23 66.85 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 73.3 mt -64.58 -53.92 40.22 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 126.163 2.165 . . . . 0.0 114.08 173.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -37.89 -36.93 0.36 Allowed Glycine 0 C--N 1.336 0.534 0 CA-C-N 120.224 1.374 . . . . 0.0 116.315 159.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 87.3 m -77.84 -35.94 50.55 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.017 2.127 . . . . 0.0 110.633 -176.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 22.7 mtt180 -71.87 -20.94 61.73 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 114.199 -2.81 . . . . 0.0 110.445 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 85.8 t -55.79 -46.63 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 116.285 1.957 . . . . 0.0 116.285 166.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -84.81 -26.52 27.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 126.689 2.493 . . . . 0.0 110.22 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 15.4 mt -70.31 -36.72 68.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 O-C-N 118.759 -2.463 . . . . 0.0 108.737 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 94.9 t -67.93 -32.62 57.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 118.097 2.629 . . . . 0.0 118.097 170.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -70.82 -45.22 64.96 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.407 -1.724 . . . . 0.0 111.667 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.18 -32.7 74.38 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.428 1.491 . . . . 0.0 110.045 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 19.7 mt -71.88 -17.09 62.14 Favored 'General case' 0 N--CA 1.447 -0.579 1 O-C-N 115.027 -4.796 . . . . 0.0 114.676 172.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -91.21 -32.11 15.91 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 124.249 1.976 . . . . 0.0 113.025 165.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -61.78 -52.79 62.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.733 -1.854 . . . . 0.0 113.029 170.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.63 26.23 69.61 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-O 115.362 -2.91 . . . . 0.0 118.792 174.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -99.75 -45.59 5.69 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 100.808 -3.775 . . . . 0.0 100.808 -166.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 5.1 mtm -88.88 56.57 3.78 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 23.7 p -90.36 -171.77 3.21 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 123.428 1.585 . . . . 0.0 113.629 -168.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.376 7.2 tp60 61.25 -82.64 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 121.3 3.815 . . . . 0.0 121.3 170.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 25.7 ttt85 -93.84 -31.96 14.14 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 126.247 2.217 . . . . 0.0 112.53 175.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -76.49 -44.22 36.27 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 -165.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.54 -44.42 69.2 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 172.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . 0.285 27.1 mtmt -72.96 -19.2 61.28 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 114.988 -2.434 . . . . 0.0 109.674 -177.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -123.9 -11.31 7.66 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 125.872 1.983 . . . . 0.0 111.812 -168.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 -103.85 -47.6 4.16 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 128.642 2.777 . . . . 0.0 109.816 176.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.21 -45.06 11.0 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 128.316 3.51 . . . . 0.0 105.448 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 76.73 -135.0 16.1 Favored Glycine 0 N--CA 1.444 -0.822 0 O-C-N 117.784 -3.072 . . . . 0.0 118.035 172.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.298 . . -78.28 36.83 0.25 Allowed 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 118.683 2.846 . . . . 0.0 118.683 -154.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.41 -15.64 2.7 Favored Glycine 0 N--CA 1.447 -0.594 1 C-N-CA 130.861 4.077 . . . . 0.0 113.626 168.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 3.9 tt -68.21 -15.45 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-O 114.091 -2.862 . . . . 0.0 116.217 -172.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -95.75 -27.32 15.31 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 127.183 2.802 . . . . 0.0 109.853 178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.3 m -52.46 -39.98 61.74 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 124.289 3.222 . . . . 0.0 111.65 159.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.259 34.2 mm -71.28 -45.03 72.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 C-N-CA 125.447 1.499 . . . . 0.0 112.237 -176.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 19.5 p -86.4 -24.02 25.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 115.465 -2.207 . . . . 0.0 114.606 174.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -90.95 168.23 11.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 126.479 3.038 . . . . 0.0 106.099 177.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.11 147.33 18.52 Favored Glycine 0 N--CA 1.447 -0.585 0 CA-C-O 125.102 2.501 . . . . 0.0 107.527 172.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 5.9 m -68.15 -27.99 66.91 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 118.155 -2.968 . . . . 0.0 114.742 -154.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -128.42 33.99 4.61 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 122.786 1.279 . . . . 0.0 110.956 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 90.7 p -73.72 -177.84 2.92 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 118.16 -2.837 . . . . 0.0 111.686 170.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.6 tt -69.89 -23.88 63.32 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 117.364 -3.335 . . . . 0.0 112.725 -164.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -60.56 -17.46 46.29 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 128.802 2.841 . . . . 0.0 111.265 167.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.09 -35.62 10.75 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.062 -1.923 . . . . 0.0 110.311 175.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 56.96 80.54 0.28 Allowed Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 119.909 3.3 . . . . 0.0 119.909 -175.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . 0.621 ' C ' ' H ' ' D' ' 95' ' ' GLU 0.413 67.2 Cg_exo 32.66 27.82 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.114 0 O-C-N 123.223 1.118 . . . . 0.0 114.399 46.197 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 47.9 t -51.17 -8.31 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 117.608 2.448 . . . . 0.0 117.608 174.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . 0.621 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -117.72 -21.85 8.29 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 113.262 -1.79 . . . . 0.0 110.506 -173.195 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 40.3 tp -63.77 -53.79 45.47 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.761 -2.066 . . . . 0.0 109.657 151.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -46.1 -60.86 2.03 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 120.523 3.527 . . . . 0.0 120.523 171.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -60.41 -18.17 48.97 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 127.358 2.263 . . . . 0.0 115.03 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 59.1 t90 -88.3 -42.43 12.24 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 170.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 42.0 mt -51.62 -46.36 63.61 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 170.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -60.88 -35.08 75.71 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.797 2.839 . . . . 0.0 109.96 -170.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.61 9.31 21.69 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 127.194 2.197 . . . . 0.0 116.544 177.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 88.6 t -125.24 -35.06 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 112.338 -2.21 . . . . 0.0 111.243 177.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 82.5 mt -97.7 -23.05 16.11 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.264 1.826 . . . . 0.0 114.376 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 60.0 mt -117.23 12.78 14.49 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 125.32 1.638 . . . . 0.0 107.021 -174.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -70.33 161.8 29.73 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 120.027 -1.67 . . . . 0.0 110.912 -174.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -62.67 -32.3 73.34 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 126.122 1.769 . . . . 0.0 111.928 -177.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 C--O 1.251 1.152 0 C-N-CA 127.823 2.449 . . . . 0.0 109.938 170.306 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.473 0.725 0 CA-C-O 118.425 -0.797 . . . . 0.0 109.843 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.46 -12.47 60.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.933 2.093 . . . . 0.0 113.848 -171.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -77.26 -29.93 54.17 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.429 -1.419 . . . . 0.0 111.183 162.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -83.84 -26.63 29.35 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 117.421 -1.712 . . . . 0.0 107.258 -171.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 53.6 p -84.36 151.17 58.95 Favored Pre-proline 0 N--CA 1.449 -0.508 0 O-C-N 119.908 -1.745 . . . . 0.0 112.588 -171.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . 0.304 77.0 Cg_exo -35.96 -52.16 1.02 Allowed 'Trans proline' 0 N--CA 1.448 -1.171 0 O-C-N 126.354 2.765 . . . . 0.0 115.691 -176.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -115.06 171.34 7.73 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 129.455 3.102 . . . . 0.0 111.803 174.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.5 t -130.01 108.38 10.05 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 128.951 2.9 . . . . 0.0 108.876 165.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.62 -19.83 61.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 126.091 2.12 . . . . 0.0 111.615 172.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.59 -33.43 69.03 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 131.409 3.883 . . . . 0.0 116.947 167.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 53.9 ttp -82.56 -23.25 34.56 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 120.524 -1.36 . . . . 0.0 110.453 169.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -38.2 90.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 126.786 2.554 . . . . 0.0 113.754 172.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -59.59 -48.42 81.73 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 115.127 -2.368 . . . . 0.0 109.112 170.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -67.48 -42.4 83.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 126.407 2.317 . . . . 0.0 110.981 -169.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 86.8 mmt-85 -66.01 -25.38 67.05 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 126.54 2.4 . . . . 0.0 114.504 175.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -82.1 -30.04 31.44 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.574 -0.704 . . . . 0.0 110.762 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -73.43 -27.97 61.72 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.813 -3.054 . . . . 0.0 112.039 169.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -63.18 -35.0 78.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 116.556 -3.84 . . . . 0.0 115.334 170.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -62.07 -53.61 53.1 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 128.151 3.834 . . . . 0.0 115.863 168.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.1 mt -67.59 -26.53 66.32 Favored 'General case' 0 N--CA 1.447 -0.609 1 O-C-N 112.933 -6.104 . . . . 0.0 116.977 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.415 HH12 ' CD ' ' B' ' 59' ' ' GLU . 67.0 ttt180 -49.33 -43.26 43.56 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 116.35 -1.786 . . . . 0.0 110.342 162.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -75.01 -23.21 58.18 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 114.954 -2.45 . . . . 0.0 115.764 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.3 t -81.65 -14.71 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 119.987 1.267 . . . . 0.0 113.177 171.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -88.88 -45.97 9.29 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 117.863 -3.023 . . . . 0.0 116.258 161.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.3 tp -54.18 -42.19 69.38 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 118.264 -2.772 . . . . 0.0 111.239 170.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.262 29.9 tp -67.12 -38.8 86.22 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.829 1.252 . . . . 0.0 114.092 175.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -67.47 -48.61 66.69 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 116.932 -1.508 . . . . 0.0 109.957 174.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.7 m-20 -59.06 -20.52 54.03 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 119.422 1.01 . . . . 0.0 113.586 174.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.29 -36.95 29.21 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -63.79 -44.58 92.94 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 119.314 -2.116 . . . . 0.0 112.538 168.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.77 -29.51 70.18 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.327 -1.797 . . . . 0.0 112.581 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -95.97 9.41 40.79 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.386 7.8 m-20 54.98 21.94 4.05 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 118.143 2.646 . . . . 0.0 118.143 -168.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.8 mt -89.47 9.15 27.53 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.27 -2.769 . . . . 0.0 107.143 172.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -55.63 -51.8 65.97 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.989 2.177 . . . . 0.0 113.587 -171.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.52 -53.36 52.47 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-O 115.84 -2.029 . . . . 0.0 114.221 177.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_exo -35.0 -53.02 0.69 Allowed 'Trans proline' 0 N--CA 1.448 -1.162 0 C-N-CA 122.563 2.175 . . . . 0.0 113.563 162.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.6 tp -74.87 -32.42 61.88 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.575 -3.203 . . . . 0.0 115.573 -171.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -63.43 -44.95 93.09 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 130.335 3.454 . . . . 0.0 114.782 171.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -60.76 -34.92 75.18 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 127.063 2.145 . . . . 0.0 108.995 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.0 tp -74.56 -42.87 58.03 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 120.517 3.525 . . . . 0.0 120.517 170.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 95.9 mmm -78.73 -21.5 47.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 114.745 -2.55 . . . . 0.0 116.857 177.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 mp -132.93 141.13 48.19 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.126 1.77 . . . . 0.0 108.041 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.3 p -80.39 153.76 74.03 Favored Pre-proline 0 N--CA 1.446 -0.628 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -55.68 -17.16 16.83 Favored 'Trans proline' 0 N--CA 1.452 -0.94 1 C-N-CA 125.594 4.196 . . . . 0.0 116.233 -173.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -76.88 -45.18 29.17 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 167.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . 0.279 42.1 mt-10 -74.7 -31.37 61.85 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 123.509 1.623 . . . . 0.0 109.997 -175.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -67.12 -54.41 21.64 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 119.361 -2.087 . . . . 0.0 115.374 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -47.75 -44.58 28.2 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.274 1.83 . . . . 0.0 112.738 163.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.81 -38.12 89.93 Favored 'General case' 0 N--CA 1.448 -0.561 1 O-C-N 114.787 -4.946 . . . . 0.0 114.962 174.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -62.77 -37.29 86.05 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 116.402 -1.761 . . . . 0.0 113.366 165.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.51 -36.83 48.27 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 119.999 2.76 . . . . 0.0 119.999 159.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.1 m -74.38 -40.62 61.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 120.996 2.398 . . . . 0.0 110.901 173.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.267 97.6 mtt180 -53.16 -36.11 60.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 67.3 t -63.18 -38.94 83.43 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 167.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.6 mtp180 -74.71 -25.74 59.35 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 114.726 -2.559 . . . . 0.0 110.759 175.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.251 63.2 mt -68.84 -51.09 48.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 115.514 -2.184 . . . . 0.0 108.857 167.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 53.9 t -62.38 -31.26 51.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 115.041 -2.409 . . . . 0.0 115.036 177.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -59.34 -55.46 34.44 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 127.454 2.971 . . . . 0.0 108.274 169.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -73.26 -14.86 61.41 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 122.658 2.481 . . . . 0.0 115.85 -178.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.9 mt -84.25 -27.38 27.95 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.318 1.847 . . . . 0.0 113.148 173.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.51 -18.37 41.78 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 117.934 -2.979 . . . . 0.0 118.336 165.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.6 ttm105 -82.22 -53.48 6.03 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 170.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.3 37.29 90.66 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 129.589 3.471 . . . . 0.0 107.727 170.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -86.32 -49.76 7.43 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 120.199 -1.765 . . . . 0.0 109.684 170.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 44.2 mtt -63.58 135.1 56.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 123.65 1.691 . . . . 0.0 109.527 165.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.2 p -99.37 -174.87 2.84 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 110.042 -3.254 . . . . 0.0 111.738 161.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -75.93 -33.49 59.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 117.359 -3.338 . . . . 0.0 109.132 -170.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.0 tpt85 -58.87 -26.97 64.74 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 131.067 3.747 . . . . 0.0 114.021 172.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -87.49 -42.93 12.42 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 120.283 -1.511 . . . . 0.0 111.971 173.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.31 -23.98 67.66 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -174.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.8 tptp -66.2 -40.1 90.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 113.958 -1.474 . . . . 0.0 110.864 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -83.64 -34.48 25.03 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 124.578 2.132 . . . . 0.0 112.456 179.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -85.25 -55.62 3.94 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.355 -2.716 . . . . 0.0 108.099 -170.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.0 mt -112.17 6.05 18.84 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 128.504 2.722 . . . . 0.0 114.343 -165.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.82 10.95 73.15 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-O 115.624 -2.765 . . . . 0.0 110.417 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.32 119.63 27.78 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 122.116 2.958 . . . . 0.0 118.312 -174.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.91 162.23 9.55 Favored Glycine 0 C--N 1.342 0.892 0 O-C-N 126.658 2.474 . . . . 0.0 118.396 159.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 52.1 mt -59.34 -45.84 92.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 131.535 3.934 . . . . 0.0 111.791 -172.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.33 -39.2 63.0 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.6 p -63.77 -41.35 97.99 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 114.785 -2.531 . . . . 0.0 117.364 169.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 31.0 mm -62.05 -37.34 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 125.931 3.968 . . . . 0.0 112.795 163.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . 0.369 54.3 m -64.67 -49.62 70.26 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.189 -2.194 . . . . 0.0 113.386 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -62.58 -53.47 54.23 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.248 -2.158 . . . . 0.0 107.653 173.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -41.75 -38.57 2.36 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 126.368 1.937 . . . . 0.0 115.609 175.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.4 m -77.03 -36.12 56.42 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 117.863 0.832 . . . . 0.0 110.274 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -68.44 -35.52 77.72 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 121.597 -0.69 . . . . 0.0 112.718 170.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 7.8 m -62.68 -38.26 89.64 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 173.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . 0.259 35.7 tp -68.28 -31.16 70.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.986 2.114 . . . . 0.0 113.926 174.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -84.35 -33.61 23.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 119.75 1.159 . . . . 0.0 112.434 171.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . 0.261 . . -71.48 -18.4 62.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 117.485 2.402 . . . . 0.0 117.485 166.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.56 136.76 92.47 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 158.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.5 153.03 79.29 Favored 'Trans proline' 0 N--CA 1.446 -1.288 0 CA-C-O 126.836 2.765 . . . . 0.0 113.831 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.5 m -61.8 -26.17 39.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-O 115.344 -2.265 . . . . 0.0 111.461 -169.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.266 22.9 pm0 -69.47 -32.45 71.37 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 123.414 2.824 . . . . 0.0 110.108 175.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 4.6 tp -76.13 -38.24 57.06 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 124.288 3.222 . . . . 0.0 113.162 173.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 56.1 mtm-85 -56.7 -37.06 70.39 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.57 1.948 . . . . 0.0 115.126 161.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -72.41 -31.19 65.32 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 121.748 2.067 . . . . 0.0 112.304 170.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -72.59 -50.07 27.92 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 115.586 -2.15 . . . . 0.0 116.24 172.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.27 -21.25 59.84 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 122.326 2.33 . . . . 0.0 110.912 -170.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -77.96 -15.39 59.02 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.691 1.996 . . . . 0.0 112.695 176.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -92.89 -33.27 14.28 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 121.854 2.116 . . . . 0.0 110.542 166.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . 0.411 47.0 t -84.16 -26.06 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-O 115.289 -2.291 . . . . 0.0 116.546 -168.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.7 mt -107.56 -3.99 18.8 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 123.692 1.71 . . . . 0.0 113.537 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 75.4 mt -133.45 8.64 3.95 Favored 'General case' 0 N--CA 1.447 -0.584 1 O-C-N 113.324 -5.86 . . . . 0.0 111.478 -156.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.6 mtpt -116.63 14.08 15.36 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 122.257 2.298 . . . . 0.0 115.668 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 67.1 m -110.24 -26.86 9.39 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 119.683 -1.886 . . . . 0.0 114.068 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 . . . . . 0 C--O 1.252 1.227 0 N-CA-C 121.721 3.971 . . . . 0.0 121.721 -165.876 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 47.3 ttp . . . . . 0 N--CA 1.474 0.759 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -52.83 -10.47 0.17 Allowed 'General case' 0 N--CA 1.45 -0.449 1 N-CA-C 122.763 4.357 . . . . 0.0 122.763 -177.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -106.86 -20.05 13.45 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 170.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -85.09 -37.99 19.64 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 116.527 -1.701 . . . . 0.0 109.272 174.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 29.4 m -78.36 140.13 60.34 Favored Pre-proline 0 N--CA 1.448 -0.535 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 177.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -63.12 -20.86 72.12 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 122.667 2.245 . . . . 0.0 114.094 178.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -131.73 130.81 42.42 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 120.906 1.685 . . . . 0.0 115.045 171.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.2 t -133.69 130.88 38.8 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 127.877 3.703 . . . . 0.0 107.386 166.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -86.71 -27.78 23.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 119.209 -2.182 . . . . 0.0 115.325 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.76 -34.51 73.07 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 122.651 1.215 . . . . 0.0 108.713 168.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . 0.295 42.6 mtt -65.13 -51.22 62.52 Favored 'General case' 0 N--CA 1.444 -0.751 0 O-C-N 121.523 -0.735 . . . . 0.0 111.226 176.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.59 -40.94 69.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.392 1.077 . . . . 0.0 113.834 177.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -70.74 -32.4 69.56 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 126.912 2.085 . . . . 0.0 110.68 177.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -73.93 -41.18 62.43 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 118.396 -2.69 . . . . 0.0 109.488 178.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -65.55 -42.51 91.78 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 169.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -63.8 -36.7 84.77 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 167.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -63.36 -40.74 98.09 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 117.307 -1.757 . . . . 0.0 113.476 170.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -53.17 -49.2 67.14 Favored 'General case' 0 N--CA 1.452 -0.36 1 O-C-N 115.79 -4.319 . . . . 0.0 111.617 172.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -52.64 -49.08 65.87 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 127.677 2.391 . . . . 0.0 110.631 171.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 79.4 mt -69.42 -30.32 68.23 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 116.175 -4.078 . . . . 0.0 109.677 -178.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -63.07 -26.43 68.83 Favored 'General case' 0 N--CA 1.453 -0.319 1 CA-C-N 126.057 4.026 . . . . 0.0 113.427 171.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -76.09 -46.12 30.56 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.186 1.794 . . . . 0.0 111.958 174.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 18.7 t -64.91 -37.81 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 119.941 -1.725 . . . . 0.0 106.417 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -64.36 -50.24 68.49 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.504 -1.998 . . . . 0.0 108.635 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 39.0 tp -60.67 -39.3 87.91 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 120.073 -1.642 . . . . 0.0 111.627 -174.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 23.8 tp -75.97 -35.94 59.45 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 119.449 -2.032 . . . . 0.0 112.375 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -48.36 -39.72 23.14 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 124.465 2.078 . . . . 0.0 112.988 168.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -89.06 -23.48 22.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 118.93 -2.357 . . . . 0.0 109.987 -176.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.55 -26.61 66.39 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-O 116.092 -1.909 . . . . 0.0 109.213 174.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -76.38 -30.32 57.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 127.15 2.18 . . . . 0.0 112.509 175.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -70.71 -26.25 63.32 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 165.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -105.76 -4.86 20.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 124.678 2.18 . . . . 0.0 110.897 -175.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.278 7.4 m-20 57.21 42.34 25.55 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 116.522 -3.861 . . . . 0.0 111.797 -175.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 22.9 mt -120.31 13.46 11.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.842 2.457 . . . . 0.0 112.619 174.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -65.07 -39.91 93.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 112.78 -3.486 . . . . 0.0 114.375 174.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 11.3 mt -55.04 -48.28 96.43 Favored Pre-proline 0 N--CA 1.452 -0.346 0 CA-C-N 121.899 2.136 . . . . 0.0 112.857 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.302 58.4 Cg_endo -66.77 -40.76 12.08 Favored 'Trans proline' 0 N--CA 1.445 -1.352 0 O-C-N 117.581 -1.852 . . . . 0.0 114.787 172.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 24.0 tp -52.66 -40.71 63.12 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 125.581 1.801 . . . . 0.0 109.722 174.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 68.8 mt -80.65 -36.64 32.23 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.133 -2.854 . . . . 0.0 110.335 -171.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -60.88 -42.0 97.1 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 173.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 46.4 tp -67.41 -45.11 77.11 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.866 1.266 . . . . 0.0 111.095 -175.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 14.9 mmt -75.1 -34.4 61.72 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.778 2.031 . . . . 0.0 115.415 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 33.7 mt -128.1 122.69 32.67 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 125.235 1.414 . . . . 0.0 109.218 -170.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 35.7 p -75.32 162.6 72.23 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 126.331 1.852 . . . . 0.0 114.978 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . 0.274 9.7 Cg_endo -67.8 -21.28 44.78 Favored 'Trans proline' 0 N--CA 1.446 -1.31 0 CA-C-N 125.136 2.87 . . . . 0.0 116.244 -164.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.61 -37.63 73.88 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.552 1.941 . . . . 0.0 111.543 169.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -72.62 -35.24 67.78 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 173.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 45.9 mtm-85 -66.61 -37.3 84.58 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 116.209 -1.853 . . . . 0.0 112.715 169.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.46 -46.75 87.87 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 126.3 2.25 . . . . 0.0 115.662 165.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.2 -30.11 66.0 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 116.734 -1.603 . . . . 0.0 109.307 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 17.7 mt -75.42 -28.43 59.4 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 121.238 1.836 . . . . 0.0 113.989 174.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.41 -41.47 77.47 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 125.504 1.526 . . . . 0.0 111.971 172.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 27.2 m -76.44 -37.65 56.69 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.011 -0.995 . . . . 0.0 112.119 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -58.92 -31.14 68.39 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 124.874 1.359 . . . . 0.0 108.797 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 91.9 t -59.16 -49.22 84.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 O-C-N 116.895 -3.628 . . . . 0.0 115.279 167.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -56.51 -32.92 65.53 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 116.94 -3.6 . . . . 0.0 109.432 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 62.9 mt -72.04 -44.59 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-O 115.912 -1.994 . . . . 0.0 114.746 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 54.7 t -66.88 -41.69 87.99 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 119.638 1.108 . . . . 0.0 110.439 176.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . 0.415 ' CD ' HH12 ' A' ' 21' ' ' ARG . 36.5 tt0 -52.47 -41.07 63.02 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 169.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -82.78 -25.19 33.0 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 117.579 2.437 . . . . 0.0 117.579 173.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 14.0 mt -48.79 -44.74 39.31 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 120.332 1.424 . . . . 0.0 113.657 154.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 44.3 mt -85.73 -2.61 58.39 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 115.158 -2.353 . . . . 0.0 114.426 -178.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 ttm105 -93.34 -71.7 0.64 Allowed 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 125.634 1.834 . . . . 0.0 114.701 176.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.16 55.75 1.92 Allowed Glycine 0 CA--C 1.525 0.702 0 CA-C-N 114.3 -1.318 . . . . 0.0 113.338 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -137.83 -8.3 1.62 Allowed 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 127.656 2.382 . . . . 0.0 115.441 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 40.4 mtt -89.82 133.37 34.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 167.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -62.27 160.41 13.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 127.883 2.473 . . . . 0.0 116.287 156.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -50.52 -43.29 55.87 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.576 -1.202 . . . . 0.0 111.237 172.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -58.88 -45.4 90.31 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 126.885 2.616 . . . . 0.0 114.281 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -67.12 -46.22 74.79 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.092 2.957 . . . . 0.0 109.998 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 34.3 mt -48.77 -56.11 9.58 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.927 1.691 . . . . 0.0 109.014 171.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 34.7 tptt -66.9 -31.74 72.53 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 115.477 1.658 . . . . 0.0 115.477 -174.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -126.21 0.73 7.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 120.919 1.69 . . . . 0.0 112.914 -167.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -124.1 -6.4 7.79 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.77 1.228 . . . . 0.0 114.143 171.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 33.1 mt -127.88 -10.98 5.46 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 129.395 3.078 . . . . 0.0 117.051 165.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 79.45 11.87 84.4 Favored Glycine 0 CA--C 1.524 0.63 0 C-N-CA 126.453 1.978 . . . . 0.0 117.383 178.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.92 114.32 28.32 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 129.956 3.302 . . . . 0.0 115.038 -164.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.54 171.56 36.57 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 127.205 2.336 . . . . 0.0 111.736 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 mt -48.98 -47.2 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 131.603 3.961 . . . . 0.0 111.856 172.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.1 -55.77 16.86 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.997 -2.314 . . . . 0.0 114.211 176.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 27.2 m -46.18 -45.44 16.79 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 118.178 2.658 . . . . 0.0 118.178 165.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 18.4 mm -67.34 -45.42 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 O-C-N 116.909 -3.62 . . . . 0.0 113.896 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 5.7 m -47.75 -40.27 20.14 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 169.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -74.39 -37.74 63.33 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.853 2.461 . . . . 0.0 113.703 -176.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -72.73 -37.31 57.57 Favored Glycine 0 N--CA 1.447 -0.587 0 O-C-N 119.01 -2.306 . . . . 0.0 116.67 165.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 37.9 m -64.4 -42.06 96.32 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 119.097 -2.413 . . . . 0.0 113.834 176.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -61.8 -37.47 84.49 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 120.757 -1.214 . . . . 0.0 112.328 168.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 37.2 m -75.69 -30.2 59.27 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.913 0.863 . . . . 0.0 113.025 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.83 -44.02 94.28 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 114.917 -2.468 . . . . 0.0 113.182 164.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 61.1 mttt -51.36 -45.62 62.46 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 127.109 2.755 . . . . 0.0 111.725 169.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.81 -30.55 65.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -176.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.76 155.06 92.39 Favored Pre-proline 0 N--CA 1.45 -0.44 0 C-N-CA 128.055 2.542 . . . . 0.0 113.221 -171.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . 0.271 23.9 Cg_exo -63.38 156.28 57.1 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 O-C-N 117.184 -2.061 . . . . 0.0 116.424 176.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -61.89 -40.83 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 O-C-N 118.41 -2.682 . . . . 0.0 113.791 170.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.325 23.0 pm0 -61.02 -26.07 67.35 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 114.08 -2.867 . . . . 0.0 114.984 170.161 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.3 tp -84.89 -44.58 13.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 122.311 2.323 . . . . 0.0 105.597 178.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 23.2 mtm-85 -64.5 -27.13 68.76 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 116.347 -3.971 . . . . 0.0 116.696 -177.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -75.2 -33.31 61.4 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.24 0.543 . . . . 0.0 111.657 178.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -69.74 -52.56 24.29 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.976 2.11 . . . . 0.0 105.886 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.3 mt -65.07 -43.68 91.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.697 0.799 . . . . 0.0 112.043 -172.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -59.86 -36.29 76.56 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.838 0.455 . . . . 0.0 110.245 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -68.83 -46.22 69.11 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 116.226 1.936 . . . . 0.0 116.226 171.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.7 t -71.16 -57.57 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 113.905 -2.95 . . . . 0.0 112.362 174.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.84 -18.81 63.46 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 126.544 2.402 . . . . 0.0 113.616 -163.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 31.4 mt -97.09 -36.27 10.54 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 116.941 -3.599 . . . . 0.0 109.236 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -88.3 19.79 3.59 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 116.37 -3.956 . . . . 0.0 109.508 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . 0.363 69.0 m -87.94 -25.62 23.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 131.289 3.836 . . . . 0.0 114.26 160.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 . . . . . 0 C--O 1.25 1.088 0 O-C-N 116.511 -3.868 . . . . 0.0 112.132 166.991 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ttt . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.12 128.22 33.01 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 126.006 2.066 . . . . 0.0 110.668 -176.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -122.76 135.73 54.65 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 126.392 2.307 . . . . 0.0 113.277 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -120.58 156.38 31.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.078 0.951 . . . . 0.0 111.466 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -129.85 165.68 31.63 Favored Pre-proline 0 N--CA 1.45 -0.438 1 C-N-CA 132.367 4.267 . . . . 0.0 113.214 169.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -81.6 -20.57 6.73 Favored 'Trans proline' 0 N--CA 1.449 -1.107 0 N-CA-C 116.175 1.567 . . . . 0.0 116.175 -179.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -138.96 160.61 39.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.891 1.994 . . . . 0.0 108.951 170.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 28.0 t -151.58 124.45 8.58 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 129.46 3.104 . . . . 0.0 110.405 176.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.68 -26.5 61.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 124.183 1.944 . . . . 0.0 113.188 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.87 -37.42 14.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 117.424 -3.298 . . . . 0.0 117.036 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 64.3 mtt -61.2 -33.85 74.14 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 126.27 2.232 . . . . 0.0 111.167 163.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.9 -42.65 99.86 Favored 'General case' 0 N--CA 1.446 -0.664 1 O-C-N 115.61 -4.431 . . . . 0.0 115.279 168.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -75.23 -25.73 58.36 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 120.283 -1.511 . . . . 0.0 113.945 175.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -62.03 -37.17 83.92 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 120.765 -1.209 . . . . 0.0 109.48 160.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -36.6 84.64 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 119.732 -1.855 . . . . 0.0 112.92 174.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -68.61 -33.31 73.83 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 124.302 2.001 . . . . 0.0 116.327 174.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -77.35 -24.12 50.77 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 129.918 3.287 . . . . 0.0 117.038 173.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -70.52 -36.56 73.81 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 125.092 2.377 . . . . 0.0 112.611 161.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 9.4 t-105 -63.45 -58.3 7.48 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 118.555 -2.59 . . . . 0.0 112.628 167.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 20.9 mt -56.63 -29.21 61.96 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 124.573 3.351 . . . . 0.0 109.772 -176.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -82.94 -23.92 33.26 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 122.007 2.185 . . . . 0.0 113.238 -177.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -62.6 -40.31 96.52 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 114.482 -2.675 . . . . 0.0 110.294 162.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.37 -49.94 67.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 116.002 -1.951 . . . . 0.0 110.202 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -60.52 -39.65 88.6 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 122.411 2.368 . . . . 0.0 115.902 176.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 63.7 tp -65.1 -41.63 94.78 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 127.291 2.236 . . . . 0.0 107.556 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 12.0 tp -74.1 -43.77 56.4 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 122.545 1.164 . . . . 0.0 111.682 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -57.09 -28.93 63.07 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 164.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . 0.277 91.7 m-20 -79.02 -24.1 43.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 129.364 3.066 . . . . 0.0 113.812 176.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.24 -6.21 54.25 Favored 'General case' 0 N--CA 1.448 -0.555 1 O-C-N 115.607 -4.433 . . . . 0.0 112.018 176.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -76.09 -21.93 56.16 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.533 171.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -65.08 -23.92 67.3 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 120.287 -1.508 . . . . 0.0 111.342 177.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -138.43 7.73 2.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 119.817 -1.802 . . . . 0.0 113.107 -163.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 50.8 28.16 3.49 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.684 2.476 . . . . 0.0 117.684 -168.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 50.1 mt -88.86 19.12 4.25 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 118.873 0.76 . . . . 0.0 110.302 164.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -64.94 -46.33 82.04 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 119.243 -2.161 . . . . 0.0 115.43 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.333 71.6 mt -68.86 -41.93 22.01 Favored Pre-proline 0 N--CA 1.452 -0.358 0 C-N-CA 127.685 2.394 . . . . 0.0 113.936 169.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_exo -58.93 -48.83 13.0 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 C-N-CA 121.668 1.579 . . . . 0.0 115.569 170.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 66.3 tp -53.86 -45.56 71.02 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 118.132 -2.855 . . . . 0.0 115.05 167.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 20.5 mt -68.24 -26.42 65.68 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 118.938 -1.105 . . . . 0.0 112.986 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -77.85 -39.13 44.48 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 127.782 2.433 . . . . 0.0 108.159 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 38.7 tp -56.71 -48.03 78.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 125.217 2.437 . . . . 0.0 111.835 167.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 7.8 mmt -84.03 -15.48 47.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 112.194 -3.765 . . . . 0.0 113.721 -167.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mp -135.34 157.53 46.66 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 126.724 2.515 . . . . 0.0 114.662 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 34.7 p -76.44 151.78 83.28 Favored Pre-proline 0 N--CA 1.448 -0.555 0 CA-C-O 114.023 -2.894 . . . . 0.0 111.32 161.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -63.46 -27.23 70.45 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 CA-C-N 123.797 2.392 . . . . 0.0 112.177 179.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.05 -44.0 74.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 115.713 -2.089 . . . . 0.0 110.922 170.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -71.13 -28.57 64.39 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 116.465 -1.731 . . . . 0.0 110.754 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 88.1 mtm-85 -71.61 -46.49 59.02 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 121.722 2.056 . . . . 0.0 109.267 176.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.15 -30.71 71.81 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.851 -1.78 . . . . 0.0 114.237 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.31 -50.4 63.75 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.786 2.434 . . . . 0.0 110.095 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 9.2 mt -65.81 -40.28 91.72 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 122.147 2.249 . . . . 0.0 108.676 -179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.9 -38.57 94.29 Favored Glycine 0 C--N 1.337 0.605 0 O-C-N 117.186 -3.446 . . . . 0.0 115.706 171.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 20.8 m -66.65 -38.69 87.39 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 114.341 -2.742 . . . . 0.0 110.59 169.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -61.71 -29.91 70.42 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 121.109 1.777 . . . . 0.0 112.642 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 91.2 t -69.5 -43.07 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 123.113 2.688 . . . . 0.0 108.812 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -70.15 -28.8 65.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 113.144 -3.312 . . . . 0.0 113.065 174.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 9.4 mt -56.31 -57.61 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 124.852 3.478 . . . . 0.0 112.168 157.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 57.5 t -57.11 -40.48 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 CA-C-O 117.17 -1.395 . . . . 0.0 111.429 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -61.4 -45.82 92.72 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.719 2.008 . . . . 0.0 106.166 178.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -68.28 -32.96 73.5 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 120.309 1.413 . . . . 0.0 111.453 -176.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 22.4 mt -76.58 -22.89 53.64 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 124.564 1.146 . . . . 0.0 109.359 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 80.7 mt -80.17 -44.18 20.28 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 117.509 -3.244 . . . . 0.0 113.713 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttm105 -57.0 -39.26 74.35 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.492 2.317 . . . . 0.0 115.664 170.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 57.77 26.83 58.26 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 126.81 2.148 . . . . 0.0 117.269 171.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -97.07 -7.37 32.96 Favored 'General case' 0 N--CA 1.449 -0.495 1 CA-C-O 111.474 -4.108 . . . . 0.0 108.569 170.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 50.6 mtt -69.55 147.68 50.45 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 125.864 3.938 . . . . 0.0 116.621 167.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 88.6 p -106.8 168.2 9.35 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.352 1.461 . . . . 0.0 107.706 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -46.53 -30.15 2.1 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 176.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 29.9 ttp-105 -59.01 -55.01 40.62 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 126.22 2.2 . . . . 0.0 113.686 176.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . 0.319 1.7 mt-10 -70.27 -40.66 74.24 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 -174.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 22.5 mt -53.43 -35.63 60.65 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 119.073 -2.267 . . . . 0.0 112.469 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -91.32 -30.68 16.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.895 2.078 . . . . 0.0 112.747 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -97.83 -59.17 1.82 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 119.514 1.052 . . . . 0.0 111.22 -171.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -70.31 -42.18 72.32 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 116.559 -2.056 . . . . 0.0 113.804 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mp -90.0 -15.42 31.93 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 127.629 2.371 . . . . 0.0 112.427 -172.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 60.93 -105.47 0.86 Allowed Glycine 0 N--CA 1.448 -0.535 0 CA-C-O 116.711 -2.161 . . . . 0.0 116.753 168.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.24 -17.44 2.68 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 129.887 3.275 . . . . 0.0 112.839 -169.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.54 -13.82 71.62 Favored Glycine 0 N--CA 1.45 -0.399 0 O-C-N 118.177 -2.827 . . . . 0.0 114.236 172.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 3.9 tt -56.48 -39.86 64.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 CA-C-N 114.765 -0.718 . . . . 0.0 109.949 174.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.1 -12.77 59.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 126.916 3.246 . . . . 0.0 112.585 -170.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 11.0 m -69.69 -46.45 66.0 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 116.927 -3.608 . . . . 0.0 107.191 166.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 46.4 mm -66.96 -40.18 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 N-CA-C 116.781 2.141 . . . . 0.0 116.781 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 40.5 p -100.69 -17.77 16.83 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -167.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 60.4 mtp85 -103.62 161.51 13.84 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 114.819 -2.515 . . . . 0.0 115.288 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.33 158.51 30.0 Favored Glycine 0 CA--C 1.524 0.618 0 O-C-N 126.053 2.095 . . . . 0.0 117.838 -177.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 88.9 p -63.85 4.83 0.26 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 118.135 2.642 . . . . 0.0 118.135 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -115.78 -5.25 12.09 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 3.2 p -68.21 177.12 2.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.287 1.835 . . . . 0.0 113.233 -154.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 15.3 tp -58.05 -26.49 62.55 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 116.272 -1.823 . . . . 0.0 111.703 -167.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -106.14 7.63 31.75 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 113.933 -2.937 . . . . 0.0 111.73 176.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -111.91 -5.74 14.32 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 129.976 3.31 . . . . 0.0 113.353 167.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.79 151.09 89.78 Favored Pre-proline 0 N--CA 1.452 -0.334 0 C-N-CA 127.076 2.15 . . . . 0.0 115.449 171.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -55.69 139.02 82.82 Favored 'Trans proline' 0 N--CA 1.448 -1.193 0 CA-C-N 120.324 1.151 . . . . 0.0 112.238 174.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 99.0 t -72.22 -30.94 37.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 124.714 1.206 . . . . 0.0 108.266 -166.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -60.75 -19.7 59.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.956 2.947 . . . . 0.0 118.956 161.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . 0.403 ' HA ' HD13 ' D' ' 34' ' ' LEU . 43.8 tp -84.02 -47.25 11.15 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.322 -0.861 . . . . 0.0 109.53 168.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 76.8 mtp180 -56.85 -49.9 74.06 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 115.894 -2.003 . . . . 0.0 109.812 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -53.09 -50.61 64.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.026 1.73 . . . . 0.0 109.294 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 61.0 t90 -75.1 -33.21 61.6 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.817 1.247 . . . . 0.0 112.271 -165.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 82.3 mt -63.49 -26.07 68.55 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 116.635 -3.791 . . . . 0.0 114.657 166.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -72.97 -27.39 61.79 Favored 'General case' 0 N--CA 1.45 -0.436 1 O-C-N 114.549 -5.094 . . . . 0.0 108.041 169.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -80.3 -24.17 40.18 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . 0.317 99.5 t -97.95 -28.18 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 124.73 3.423 . . . . 0.0 116.382 177.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 18.6 mt -110.52 -29.05 8.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.268 1.827 . . . . 0.0 112.973 -172.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 71.3 mt -121.0 30.54 6.81 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -75.49 147.52 39.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.578 1.951 . . . . 0.0 113.168 162.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 14.7 m -101.39 53.22 0.83 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 129.219 3.008 . . . . 0.0 110.306 177.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 21.8 t70 . . . . . 0 C--O 1.252 1.198 0 O-C-N 118.164 -2.835 . . . . 0.0 113.293 -171.814 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 28.2 ttp . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.11 145.93 40.53 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.606 1.963 . . . . 0.0 116.237 -177.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -142.97 146.61 34.09 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.088 1.355 . . . . 0.0 112.39 176.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -151.48 155.77 39.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.244 1.417 . . . . 0.0 111.397 -178.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 90.9 p -77.85 171.26 12.93 Favored Pre-proline 0 N--CA 1.45 -0.439 0 C-N-CA 126.028 1.731 . . . . 0.0 110.17 164.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -79.92 -44.03 0.12 Allowed 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 124.652 3.568 . . . . 0.0 112.112 155.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -152.66 140.24 19.79 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 155.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 36.0 t -67.13 121.22 15.14 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 109.805 -3.361 . . . . 0.0 110.849 -173.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . 0.263 . . -56.97 -21.26 28.98 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 117.711 -1.138 . . . . 0.0 110.659 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.5 -29.18 17.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.889 2.476 . . . . 0.0 113.556 -172.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.3 21.7 mmt -64.95 -37.48 87.79 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.888 -0.577 . . . . 0.0 112.189 158.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.81 -35.14 80.15 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 117.147 2.277 . . . . 0.0 117.147 173.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -60.73 -58.25 9.25 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.957 -2.965 . . . . 0.0 108.233 159.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -47.3 -38.38 12.52 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 117.907 -2.995 . . . . 0.0 118.815 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.39 5.8 49.23 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 131.408 3.883 . . . . 0.0 115.074 -173.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -104.93 -22.62 13.11 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 117.046 -1.454 . . . . 0.0 107.949 146.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -77.29 -34.08 55.61 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 123.23 2.741 . . . . 0.0 112.294 -176.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -66.5 -15.3 63.27 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 171.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -82.96 -37.18 24.45 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 167.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.17 -15.34 62.93 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 114.501 -2.666 . . . . 0.0 111.095 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -65.15 -49.58 69.32 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 114.012 -2.899 . . . . 0.0 105.714 164.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -70.05 -38.76 75.89 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 122.177 2.262 . . . . 0.0 111.207 -172.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 20.7 t -66.19 -34.84 72.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 C-N-CA 128.317 2.647 . . . . 0.0 111.032 171.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -75.31 -37.83 60.6 Favored 'General case' 0 N--CA 1.448 -0.539 1 O-C-N 115.302 -4.624 . . . . 0.0 115.46 167.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 tp -69.09 -33.07 72.94 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 24.8 tp -73.85 -46.07 47.24 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 121.426 -0.796 . . . . 0.0 110.066 -177.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -58.03 -46.05 85.94 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 126.222 1.809 . . . . 0.0 112.097 172.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -52.35 -30.44 28.63 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 166.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 -29.24 30.87 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.436 1.094 . . . . 0.0 113.369 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -50.54 -40.57 52.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 125.264 2.459 . . . . 0.0 111.246 167.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -75.44 -30.18 59.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 118.834 -2.416 . . . . 0.0 113.744 -158.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 53.3 p-10 -111.18 14.17 21.79 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 128.922 3.889 . . . . 0.0 118.448 168.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 52.89 54.82 9.88 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' C' ' 96' ' ' LEU . 14.9 mt -121.33 5.42 10.22 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 129.305 3.042 . . . . 0.0 110.749 171.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -61.89 2.26 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 116.428 -1.748 . . . . 0.0 112.071 174.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 4.2 mt -52.15 -45.74 93.8 Favored Pre-proline 0 N--CA 1.45 -0.445 0 CA-C-O 115.183 -2.342 . . . . 0.0 115.22 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.24 -20.55 14.39 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 114.714 -3.057 . . . . 0.0 114.159 172.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 12.0 tp -68.01 -35.73 78.78 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 124.126 3.148 . . . . 0.0 113.18 169.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 24.3 mt -71.05 -36.37 72.29 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 123.227 1.489 . . . . 0.0 107.15 -175.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 35.3 m-20 -78.58 -26.99 45.6 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.863 1.792 . . . . 0.0 112.688 -175.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -68.02 -48.45 65.65 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.143 166.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 65.1 mmm -65.47 -34.63 78.74 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 114.892 -2.48 . . . . 0.0 114.858 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -115.16 144.76 43.18 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 122.231 2.287 . . . . 0.0 116.798 -172.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 70.1 p -67.62 148.78 98.54 Favored Pre-proline 0 N--CA 1.452 -0.37 0 O-C-N 117.161 -3.462 . . . . 0.0 110.035 167.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -35.79 -54.15 0.81 Allowed 'Trans proline' 0 N--CA 1.451 -1.009 1 C-N-CA 127.072 5.181 . . . . 0.0 113.438 171.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -71.37 -9.63 58.47 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 -178.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . 0.251 38.8 mt-10 -86.43 -41.63 14.28 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 120.398 -1.439 . . . . 0.0 112.321 163.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -59.88 -36.5 77.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 125.216 2.436 . . . . 0.0 114.455 172.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -74.43 -40.19 62.12 Favored 'General case' 0 N--CA 1.451 -0.412 1 C-N-CA 134.76 5.224 . . . . 0.0 108.404 -175.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.28 -41.4 63.65 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 116.605 -3.809 . . . . 0.0 112.736 171.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 50.8 mt -59.65 -44.87 93.38 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 119.833 -1.792 . . . . 0.0 107.904 178.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.22 -33.38 85.77 Favored Glycine 0 CA--C 1.523 0.576 0 C-N-CA 118.563 -1.78 . . . . 0.0 114.884 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 97.6 m -78.96 -24.03 44.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 119.577 -2.131 . . . . 0.0 111.156 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 27.0 mtt180 -75.26 -20.67 59.05 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 117.579 -1.649 . . . . 0.0 113.105 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 99.3 t -49.56 -61.02 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 114.731 -2.556 . . . . 0.0 115.763 159.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -65.27 -26.07 67.92 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 126.187 2.179 . . . . 0.0 113.515 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 36.5 mt -67.51 -52.09 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 129.711 3.204 . . . . 0.0 107.831 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 55.0 t -54.49 -39.62 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 125.984 1.714 . . . . 0.0 115.618 165.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -58.1 -60.73 3.28 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 122.98 1.371 . . . . 0.0 114.005 176.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -57.24 -37.86 72.93 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 128.725 2.81 . . . . 0.0 110.525 176.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 7.2 mt -61.06 -41.34 96.44 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 115.857 -2.337 . . . . 0.0 114.262 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 31.5 mt -67.84 -40.62 83.68 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.521 2.328 . . . . 0.0 110.91 170.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -63.9 -42.6 97.39 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 115.214 1.561 . . . . 0.0 115.214 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 52.0 61.2 6.73 Favored Glycine 0 CA--C 1.521 0.443 0 O-C-N 116.841 -3.662 . . . . 0.0 116.019 -173.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -139.31 -37.63 0.5 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 121.005 2.402 . . . . 0.0 106.972 -174.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 49.1 mtt -93.08 52.68 1.84 Allowed 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 118.9 -2.375 . . . . 0.0 113.724 159.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 31.1 p -95.01 -174.85 3.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 121.405 3.854 . . . . 0.0 121.405 -172.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.25 4.4 tp-100 56.3 -76.24 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 129.101 2.96 . . . . 0.0 115.431 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 49.8 ttt85 -88.25 -34.95 17.56 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 121.565 1.984 . . . . 0.0 114.137 169.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -74.67 -51.84 13.27 Favored 'General case' 0 N--CA 1.446 -0.674 0 O-C-N 118.829 -2.419 . . . . 0.0 116.504 -157.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -35.66 -47.97 0.5 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.517 1.127 . . . . 0.0 112.757 161.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -68.91 -27.24 65.59 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 116.948 2.203 . . . . 0.0 116.948 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -105.32 -31.73 8.93 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 124.796 2.236 . . . . 0.0 112.823 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -87.67 -36.45 17.43 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.537 2.051 . . . . 0.0 116.537 -172.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.19 -36.31 5.86 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.714 2.006 . . . . 0.0 108.638 175.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 59.61 -113.01 4.81 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 118.885 2.314 . . . . 0.0 118.885 167.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.57 2.91 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 120.94 3.681 . . . . 0.0 120.94 -159.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -110.94 -7.2 25.56 Favored Glycine 0 CA--C 1.526 0.774 0 O-C-N 119.736 -1.852 . . . . 0.0 111.512 170.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 4.9 tt -73.91 -19.43 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 118.839 -2.566 . . . . 0.0 114.3 -166.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -97.34 -11.85 23.53 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 119.589 1.086 . . . . 0.0 109.466 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.2 m -79.54 -55.43 5.05 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 106.376 -1.712 . . . . 0.0 106.376 161.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.327 20.4 mm -58.18 -26.98 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 118.141 -2.849 . . . . 0.0 114.599 176.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 30.9 p -111.08 8.55 21.85 Favored 'General case' 0 N--CA 1.451 -0.401 1 N-CA-C 123.34 4.57 . . . . 0.0 123.34 177.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -112.03 -144.58 0.39 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 114.915 -2.469 . . . . 0.0 106.519 164.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 75.77 155.3 5.38 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-N 122.959 2.618 . . . . 0.0 109.757 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 94.1 p -71.66 -30.8 66.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 176.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -138.9 43.16 2.09 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 -167.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 96.6 p -84.14 -179.32 7.2 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 124.074 1.892 . . . . 0.0 112.053 173.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.267 1.6 mp -69.46 -9.0 51.81 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 112.665 -2.061 . . . . 0.0 114.676 175.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 22.6 tttt -71.81 -16.44 62.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 115.618 1.711 . . . . 0.0 115.618 155.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -101.08 -41.88 6.59 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 120.057 -1.652 . . . . 0.0 109.515 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . 0.502 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 59.62 91.66 0.07 OUTLIER Pre-proline 0 N--CA 1.452 -0.345 0 CA-C-N 120.695 1.589 . . . . 0.0 109.997 -174.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . 0.502 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.285 97.9 Cg_exo 37.4 35.72 0.0 OUTLIER 'Cis proline' 0 N--CA 1.448 -1.161 0 N-CA-C 116.756 1.791 . . . . 0.0 116.756 29.823 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 61.1 t -66.76 -18.22 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 C-N-CA 128.327 2.651 . . . . 0.0 111.324 -172.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.55 -28.11 9.06 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -166.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 36.9 tp -57.69 -46.06 84.81 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 120.531 -1.356 . . . . 0.0 110.884 151.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -67.5 -49.24 64.34 Favored 'General case' 0 N--CA 1.451 -0.408 1 O-C-N 116.135 -4.103 . . . . 0.0 112.184 -175.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -61.0 -2.61 0.61 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 114.383 -2.722 . . . . 0.0 111.811 172.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -103.87 -54.18 2.61 Favored 'General case' 0 N--CA 1.45 -0.438 1 CA-C-N 127.74 4.791 . . . . 0.0 110.888 171.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 92.1 mt -48.81 -42.56 36.46 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.8 1.24 . . . . 0.0 107.657 174.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -66.99 -35.54 80.17 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.574 -0.704 . . . . 0.0 112.372 -173.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -80.51 -24.35 39.46 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 120.612 1.551 . . . . 0.0 109.136 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 78.1 t -100.88 -15.2 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 123.908 3.049 . . . . 0.0 107.626 -168.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 83.9 mt -112.9 -16.22 12.74 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 121.487 1.949 . . . . 0.0 112.463 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.353 25.1 mt -98.4 16.34 21.96 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 171.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 15.6 pttp -77.77 161.52 27.62 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.741 2.016 . . . . 0.0 114.131 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 5.4 m -80.74 -9.66 59.79 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 117.893 -3.005 . . . . 0.0 117.797 -164.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-N 121.851 2.114 . . . . 0.0 112.913 -176.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.468 0.443 0 N-CA-C 111.536 0.198 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.63 -11.6 59.88 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 118.503 2.779 . . . . 0.0 118.503 -168.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -84.2 -31.13 25.25 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 118.804 -2.435 . . . . 0.0 116.435 166.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -79.46 -17.48 54.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 126.75 2.531 . . . . 0.0 113.177 178.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 59.0 p -73.75 139.75 77.51 Favored Pre-proline 0 N--CA 1.446 -0.634 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -175.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -53.18 -26.57 34.07 Favored 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 122.162 1.908 . . . . 0.0 114.558 175.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -143.78 152.42 41.21 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.587 0.708 . . . . 0.0 111.059 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.25 8.6 t -119.31 93.95 4.26 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.307 3.043 . . . . 0.0 110.831 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.51 -20.82 64.6 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 116.834 -1.555 . . . . 0.0 110.379 168.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.29 -44.47 87.87 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 129.199 3.0 . . . . 0.0 112.18 167.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 56.6 ttp -76.55 -29.84 56.85 Favored 'General case' 0 N--CA 1.448 -0.549 1 O-C-N 114.317 -5.239 . . . . 0.0 109.863 174.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.97 -49.81 76.46 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 117.08 -3.513 . . . . 0.0 114.959 168.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -54.31 -43.13 70.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 122.711 1.243 . . . . 0.0 112.452 173.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -55.42 -53.11 60.33 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 122.78 1.276 . . . . 0.0 112.313 174.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -69.94 -40.57 75.42 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 116.576 -1.678 . . . . 0.0 109.372 -175.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -47.8 -33.35 7.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 125.768 2.699 . . . . 0.0 116.067 171.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . 0.309 2.6 mp0 -73.55 -31.7 63.79 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 117.772 -3.08 . . . . 0.0 113.008 173.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -76.08 -19.8 58.26 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 119.401 -2.062 . . . . 0.0 110.014 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . 0.34 38.7 t-105 -71.18 -50.06 37.22 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.184 2.994 . . . . 0.0 114.981 166.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.54 -27.38 68.58 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.027 1.731 . . . . 0.0 114.514 173.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -75.05 -35.06 61.91 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 116.566 2.061 . . . . 0.0 116.566 165.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.38 -50.27 70.15 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 119.883 1.219 . . . . 0.0 112.806 161.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.4 t -76.96 -25.58 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 CA-C-O 115.414 -2.232 . . . . 0.0 113.811 -173.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -61.02 -55.74 29.21 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 115.405 -2.236 . . . . 0.0 114.893 155.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 48.9 tp -56.18 -37.43 69.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 121.011 1.732 . . . . 0.0 113.154 -173.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 23.4 tp -68.23 -46.84 69.43 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 110.082 -3.235 . . . . 0.0 114.411 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.472 ' HB3' ' HE2' ' A' ' 27' ' ' LYS . 20.2 ttpt -60.88 -42.47 97.99 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 118.569 -2.582 . . . . 0.0 112.023 174.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.89 -32.23 71.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 126.221 2.201 . . . . 0.0 111.996 173.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.88 -36.68 82.84 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 111.883 -3.913 . . . . 0.0 108.971 171.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -62.64 -34.05 76.26 Favored 'General case' 0 N--CA 1.448 -0.547 1 CA-C-N 130.116 5.871 . . . . 0.0 115.328 168.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.328 77.1 mt-30 -64.6 -21.2 66.65 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 116.972 2.212 . . . . 0.0 116.972 170.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -109.02 10.57 26.17 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 124.701 1.25 . . . . 0.0 108.623 173.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 52.66 27.21 5.0 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 116.737 -3.727 . . . . 0.0 118.265 -168.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.2 mt -102.54 6.69 40.03 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 117.491 -3.255 . . . . 0.0 112.004 -172.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -72.22 -30.59 65.07 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.561 1.544 . . . . 0.0 110.755 -158.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 56.4 mt -63.6 -59.23 12.28 Favored Pre-proline 0 N--CA 1.451 -0.396 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 167.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -49.96 -33.91 35.67 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 CA-C-N 124.994 2.819 . . . . 0.0 113.454 170.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.3 tp -64.44 -52.08 59.87 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 122.281 2.31 . . . . 0.0 116.097 174.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.3 mt -60.68 -35.09 75.41 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.13 1.772 . . . . 0.0 114.78 168.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 -73.87 -30.75 62.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 121.801 2.091 . . . . 0.0 108.02 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.275 19.6 tp -78.36 -36.93 45.41 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 116.78 -3.7 . . . . 0.0 111.272 176.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 62.1 mmm -70.68 -20.28 62.7 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 118.279 2.696 . . . . 0.0 118.279 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.415 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 10.5 mt -137.32 125.15 22.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 130.342 3.457 . . . . 0.0 114.278 178.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 66.8 p -67.16 152.19 96.35 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-O 114.715 -2.564 . . . . 0.0 108.855 175.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -59.32 -26.83 83.24 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 N-CA-C 119.163 2.717 . . . . 0.0 119.163 -159.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -63.59 -44.55 93.67 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 125.645 1.84 . . . . 0.0 108.143 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 21.9 mt-10 -59.13 -44.9 92.06 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 131.673 3.989 . . . . 0.0 114.353 177.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.6 mtm180 -65.48 -54.67 25.02 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.889 3.276 . . . . 0.0 113.266 172.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -47.42 -36.32 9.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 165.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.12 -38.74 79.05 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 118.595 -2.565 . . . . 0.0 114.057 169.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.9 mt -66.7 -32.49 73.84 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 116.672 -1.632 . . . . 0.0 107.076 178.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.93 -50.74 62.67 Favored Glycine 0 CA--C 1.523 0.57 0 CA-C-N 120.287 1.403 . . . . 0.0 110.986 166.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.5 m -60.74 -33.85 73.53 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 120.723 2.261 . . . . 0.0 110.804 -175.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -73.18 -25.95 60.99 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 120.926 1.694 . . . . 0.0 109.092 -170.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 85.8 t -58.49 -43.4 86.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 C-N-CA 124.695 1.198 . . . . 0.0 112.44 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 -67.16 -43.21 82.83 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 129.271 3.028 . . . . 0.0 112.227 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 81.8 mt -54.11 -54.64 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 125.114 1.509 . . . . 0.0 111.09 165.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.7 t -66.1 -26.2 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 120.729 1.604 . . . . 0.0 112.263 176.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . 0.25 11.0 tt0 -63.67 -53.39 52.07 Favored 'General case' 0 N--CA 1.446 -0.652 1 O-C-N 116.066 -4.146 . . . . 0.0 111.396 170.095 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -75.63 -23.05 56.33 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 117.17 -3.456 . . . . 0.0 113.02 -175.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 80.3 mt -76.31 -34.88 59.04 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 119.011 -2.306 . . . . 0.0 112.224 165.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 63.2 mt -73.55 -50.12 22.95 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 116.792 -3.693 . . . . 0.0 113.105 173.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.7 ttm180 -43.05 -41.54 3.54 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 116.532 -3.855 . . . . 0.0 115.424 161.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 59.11 29.71 65.91 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 120.278 2.871 . . . . 0.0 120.278 172.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -95.75 -43.13 8.02 Favored 'General case' 0 N--CA 1.444 -0.725 1 C-N-CA 131.746 4.019 . . . . 0.0 114.505 175.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 40.8 mtt -69.48 130.54 42.78 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 168.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.7 p -78.73 172.19 14.08 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.933 2.093 . . . . 0.0 113.074 158.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -50.54 -44.4 56.44 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 128.106 2.562 . . . . 0.0 113.995 171.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -61.9 -27.1 68.57 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 118.935 -2.353 . . . . 0.0 115.517 177.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -84.26 -54.64 4.66 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 126.994 2.118 . . . . 0.0 111.788 -178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.5 mt -46.74 -29.71 2.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 119.127 3.01 . . . . 0.0 119.127 164.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -72.86 -18.4 61.44 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.795 2.038 . . . . 0.0 114.53 173.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -91.99 -74.27 0.52 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.106 2.162 . . . . 0.0 110.628 160.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -66.22 -21.78 66.32 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 127.105 2.753 . . . . 0.0 112.238 -151.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 13.0 mt -120.07 -26.79 5.46 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 120.254 -1.529 . . . . 0.0 108.425 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.51 15.47 27.24 Favored Glycine 0 CA--C 1.526 0.774 0 C-N-CA 126.137 1.827 . . . . 0.0 115.993 170.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.52 126.79 35.12 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 126.248 1.793 . . . . 0.0 113.784 -164.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.21 157.16 49.63 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-O 122.079 0.821 . . . . 0.0 113.927 175.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.4 mt -57.09 -48.79 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.52 -33.42 66.04 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 117.561 -1.209 . . . . 0.0 113.562 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.6 p -67.64 -44.35 78.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 122.005 0.907 . . . . 0.0 111.091 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.3 mm -70.94 -33.79 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.276 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 15.0 m -56.14 -61.79 2.15 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 118.487 -2.633 . . . . 0.0 113.661 165.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -58.02 -36.49 72.78 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 130.673 3.589 . . . . 0.0 114.013 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.59 -36.76 32.56 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-O 115.008 -3.107 . . . . 0.0 108.172 -177.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 68.8 m -63.56 -52.97 58.76 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 119.368 1.584 . . . . 0.0 113.373 168.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -57.11 -31.52 65.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.754 -1.593 . . . . 0.0 110.285 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.7 m -77.06 -25.8 52.83 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 124.865 3.484 . . . . 0.0 113.479 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 29.3 tp -82.62 -42.43 18.24 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 119.222 3.045 . . . . 0.0 119.222 174.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -59.38 -39.88 84.73 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 125.179 1.391 . . . . 0.0 111.335 162.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.11 -35.77 78.67 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 117.283 -1.767 . . . . 0.0 113.762 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -50.47 142.59 15.04 Favored Pre-proline 0 N--CA 1.448 -0.532 0 CA-C-O 116.597 -1.668 . . . . 0.0 113.573 175.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.7 145.32 36.7 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 CA-C-N 121.472 1.561 . . . . 0.0 111.624 -168.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 m -57.26 -32.25 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -168.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -55.42 -36.03 66.03 Favored 'General case' 0 N--CA 1.445 -0.723 1 O-C-N 113.409 -5.807 . . . . 0.0 114.79 174.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 33.5 tp -67.31 -39.31 85.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 114.268 -2.777 . . . . 0.0 115.373 169.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 87.1 mtm-85 -66.82 -43.12 84.62 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 125.375 1.672 . . . . 0.0 110.467 168.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -61.63 -28.3 69.27 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 125.171 1.544 . . . . 0.0 108.7 -176.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 22.1 t90 -75.14 -61.74 1.79 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 170.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 92.1 mt -51.35 -38.47 53.35 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -58.25 -31.0 66.99 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 120.94 -1.1 . . . . 0.0 112.764 172.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -83.54 -19.28 35.95 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 120.144 -1.597 . . . . 0.0 114.743 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 21.2 t -95.81 -55.39 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 1 C-N-CA 133.105 4.562 . . . . 0.0 111.1 -176.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.6 mt -89.32 -15.56 33.15 Favored 'General case' 0 N--CA 1.448 -0.533 1 O-C-N 115.35 -4.594 . . . . 0.0 110.433 -171.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 59.4 mt -116.5 4.58 13.29 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 122.829 2.559 . . . . 0.0 113.634 -172.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mttp -115.74 11.04 15.56 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 123.874 0.734 . . . . 0.0 112.886 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.0 m -87.0 -40.55 14.64 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 127.524 2.33 . . . . 0.0 113.267 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 116.15 -1.881 . . . . 0.0 115.532 -171.138 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.2 ttt . . . . . 0 N--CA 1.47 0.528 0 CA-C-O 117.079 -1.439 . . . . 0.0 114.208 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.292 . . -65.0 -39.2 93.11 Favored 'General case' 0 N--CA 1.448 -0.543 1 N-CA-C 122.632 4.308 . . . . 0.0 122.632 -171.8 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -62.63 -33.85 75.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 121.315 1.871 . . . . 0.0 112.375 -177.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -85.83 -23.06 27.3 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 118.13 -2.856 . . . . 0.0 116.205 171.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 39.5 m -58.77 139.75 86.22 Favored Pre-proline 0 N--CA 1.449 -0.49 0 C-N-CA 130.686 3.594 . . . . 0.0 113.14 174.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.75 -27.38 18.21 Favored 'Trans proline' 0 N--CA 1.448 -1.186 0 C-N-CA 123.112 2.541 . . . . 0.0 110.138 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -124.78 150.46 46.27 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.62 2.768 . . . . 0.0 112.997 171.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 39.2 t -145.7 114.25 6.77 Favored 'General case' 0 N--CA 1.45 -0.472 1 O-C-N 114.203 -5.311 . . . . 0.0 116.271 166.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.2 -17.07 60.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 117.331 -1.319 . . . . 0.0 112.176 172.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.22 -40.63 74.4 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 125.548 1.78 . . . . 0.0 114.505 174.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 51.7 mtt -69.39 -38.52 78.02 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 116.319 -1.801 . . . . 0.0 108.776 168.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.11 -41.38 98.17 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 124.126 3.148 . . . . 0.0 109.787 -173.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -71.98 -26.18 62.15 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 119.867 -1.771 . . . . 0.0 113.96 173.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -73.94 -36.27 64.62 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 117.974 -2.954 . . . . 0.0 112.135 169.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -72.43 -34.33 67.73 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 116.433 -1.746 . . . . 0.0 112.775 177.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 69.1 t60 -62.15 -46.14 90.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 127.862 3.226 . . . . 0.0 109.512 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -64.58 -35.19 80.2 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 117.374 -3.329 . . . . 0.0 115.805 168.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -70.06 -22.54 63.06 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 119.706 -1.872 . . . . 0.0 111.887 176.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -85.16 -47.69 9.88 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 128.361 2.664 . . . . 0.0 106.936 174.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . 0.253 45.5 mt -49.98 -24.57 2.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 118.12 2.637 . . . . 0.0 118.12 174.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 50.9 ttt180 -68.19 -33.63 74.8 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.938 -2.351 . . . . 0.0 112.196 173.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -66.28 -43.47 86.3 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 127.142 2.177 . . . . 0.0 110.971 176.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 38.6 t -58.97 -38.69 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 129.988 3.315 . . . . 0.0 115.545 173.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -71.44 -41.9 68.89 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 113.249 -1.796 . . . . 0.0 113.696 166.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 48.5 tp -60.38 -36.31 77.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 173.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.328 55.2 tp -80.77 -37.15 30.86 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 115.537 -2.173 . . . . 0.0 111.229 178.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . 0.412 ' HE3' ' OD1' ' B' ' 28' ' ' ASN . 32.7 ttpt -56.91 -44.41 82.37 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 116.491 -2.084 . . . . 0.0 114.398 167.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . 0.412 ' OD1' ' HE3' ' B' ' 27' ' ' LYS . 50.6 m-20 -73.45 -26.49 60.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 120.19 1.359 . . . . 0.0 111.929 -172.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.86 -36.21 62.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.494 1.918 . . . . 0.0 114.939 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -60.79 -33.75 73.46 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 116.21 -1.853 . . . . 0.0 114.813 159.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -67.55 -29.22 68.54 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 122.529 2.422 . . . . 0.0 112.221 171.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -96.8 -0.1 48.53 Favored 'General case' 0 N--CA 1.447 -0.599 1 CA-C-O 111.465 -4.112 . . . . 0.0 110.174 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.46 0.4 OUTLIER 57.92 14.09 2.43 Favored 'General case' 0 N--CA 1.445 -0.683 1 C-N-CA 131.94 4.096 . . . . 0.0 117.163 -178.438 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 20.5 mt -88.96 22.08 2.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 129.115 2.966 . . . . 0.0 109.722 -177.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -88.39 -20.61 25.04 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 117.456 2.391 . . . . 0.0 117.456 -157.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 23.5 mt -73.2 -56.62 3.2 Favored Pre-proline 0 N--CA 1.449 -0.497 0 CA-C-N 112.089 -2.323 . . . . 0.0 111.747 170.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -62.62 -27.96 76.68 Favored 'Trans proline' 0 N--CA 1.448 -1.15 1 C-N-CA 125.698 4.265 . . . . 0.0 112.814 178.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 41.9 tp -73.35 -37.66 65.99 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.849 1.968 . . . . 0.0 106.903 -178.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 80.7 mt -70.84 -38.69 73.2 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 125.522 2.582 . . . . 0.0 112.189 175.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -57.39 -29.31 63.97 Favored 'General case' 0 N--CA 1.449 -0.5 1 O-C-N 114.531 -5.105 . . . . 0.0 113.578 165.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 45.0 tp -78.5 -48.02 16.16 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 117.283 -3.386 . . . . 0.0 111.904 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 11.4 mmt -82.89 -11.23 58.37 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -167.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 1.1 mp -140.61 128.32 21.65 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.287 1.835 . . . . 0.0 112.354 -169.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 66.8 p -80.19 160.63 67.72 Favored Pre-proline 0 N--CA 1.449 -0.48 0 CA-C-O 115.385 -2.245 . . . . 0.0 110.334 -178.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -55.16 -36.36 92.96 Favored 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 124.895 3.73 . . . . 0.0 113.784 -169.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.32 -26.28 38.87 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 124.468 1.105 . . . . 0.0 110.155 -172.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -67.49 -47.27 70.52 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 119.084 -2.26 . . . . 0.0 110.91 167.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 62.7 mtm-85 -63.58 -41.35 98.38 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 125.163 1.539 . . . . 0.0 115.064 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.57 -39.31 93.51 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 118.891 -2.38 . . . . 0.0 114.876 169.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.62 -46.96 65.03 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 18.8 mt -53.09 -34.93 58.83 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 117.04 -3.537 . . . . 0.0 116.492 169.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.96 -24.17 71.47 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 110.688 -2.96 . . . . 0.0 115.967 172.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.5 m -101.88 -22.35 14.35 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 114.926 -2.464 . . . . 0.0 110.969 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -63.32 -21.62 66.37 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 121.311 1.869 . . . . 0.0 112.643 166.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 10.5 t -54.16 -49.37 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 O-C-N 116.599 -3.813 . . . . 0.0 114.424 163.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 -74.07 -31.84 63.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 96.3 mt -70.73 -46.97 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 3.3 t -63.23 -36.2 75.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 O-C-N 116.975 -3.578 . . . . 0.0 111.634 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.16 -41.94 76.24 Favored 'General case' 0 N--CA 1.452 -0.35 1 O-C-N 115.861 -4.274 . . . . 0.0 116.396 169.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -80.08 -17.33 52.95 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 129.951 3.3 . . . . 0.0 112.468 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 54.6 mt -82.73 -9.78 59.2 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 117.183 -3.448 . . . . 0.0 111.027 168.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 89.3 mt -107.38 -31.33 8.22 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 128.413 2.685 . . . . 0.0 112.079 169.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 16.5 ttm105 -70.66 -54.46 11.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.692 1.738 . . . . 0.0 115.692 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.68 54.61 30.22 Favored Glycine 0 C--N 1.337 0.622 0 CA-C-O 115.301 -2.944 . . . . 0.0 117.111 -170.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -126.95 -17.01 4.99 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 117.152 2.278 . . . . 0.0 117.152 175.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 81.4 mtp -102.93 146.44 28.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.208 -2.183 . . . . 0.0 111.731 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -93.54 172.55 8.2 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 118.471 -2.643 . . . . 0.0 107.845 172.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -58.4 -37.41 75.25 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 175.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -55.25 -36.51 66.14 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 126.298 2.951 . . . . 0.0 118.208 172.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -85.08 -38.92 18.57 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 128.284 2.634 . . . . 0.0 106.681 -174.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 73.3 mt -58.56 -42.49 88.06 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 117.056 -3.527 . . . . 0.0 111.491 170.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 tptt -59.26 -65.92 0.59 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 127.757 2.423 . . . . 0.0 111.02 173.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -74.16 -29.75 61.93 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 114.687 -2.805 . . . . 0.0 114.147 -168.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . 0.31 39.6 mt-10 -115.91 -23.62 8.5 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 114.867 -2.492 . . . . 0.0 114.422 -162.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mt -104.85 -6.1 20.53 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 126.092 2.12 . . . . 0.0 114.389 162.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.94 16.8 70.91 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 119.672 -1.251 . . . . 0.0 113.496 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.55 134.72 34.18 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 122.833 3.316 . . . . 0.0 117.808 -179.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.17 -173.24 7.43 Favored Glycine 0 C--N 1.334 0.456 0 CA-C-O 124.527 2.181 . . . . 0.0 111.848 158.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 97.3 mt -83.13 -44.98 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 O-C-N 117.255 -3.497 . . . . 0.0 113.146 -177.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.97 -23.26 52.34 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 -169.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 17.2 m -66.04 -44.31 85.0 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.315 1.446 . . . . 0.0 113.841 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 21.1 mm -76.74 -30.14 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 C-N-CA 125.916 1.686 . . . . 0.0 107.663 173.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 6.7 m -59.4 -50.72 72.86 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 120.245 -1.534 . . . . 0.0 111.003 169.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -61.72 -42.18 98.61 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -48.55 -44.54 29.31 Favored Glycine 0 N--CA 1.446 -0.657 1 C-N-CA 131.038 4.161 . . . . 0.0 109.7 176.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 3.6 p -74.02 -35.83 64.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.361 1.465 . . . . 0.0 114.055 -178.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -69.59 -41.19 76.11 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 127.514 2.326 . . . . 0.0 107.702 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 6.0 m -72.51 -31.99 65.79 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 119.33 -2.107 . . . . 0.0 115.057 -176.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.09 -25.86 20.53 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 115.913 -1.994 . . . . 0.0 106.682 -177.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 58.1 tttm -64.4 -48.67 74.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 121.993 2.179 . . . . 0.0 105.234 172.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.18 3.94 25.29 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 117.368 -3.332 . . . . 0.0 116.671 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.7 141.71 64.91 Favored Pre-proline 0 N--CA 1.45 -0.425 0 O-C-N 117.49 -3.256 . . . . 0.0 113.157 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -49.03 124.99 12.35 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 123.192 2.595 . . . . 0.0 116.891 172.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.31 -23.56 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 1 O-C-N 115.887 -4.258 . . . . 0.0 115.571 -172.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -60.36 -30.25 69.43 Favored 'General case' 0 N--CA 1.453 -0.308 1 O-C-N 114.865 -4.897 . . . . 0.0 111.877 171.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 14.7 tp -79.35 -36.79 38.86 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 117.39 -1.291 . . . . 0.0 110.655 171.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 32.0 mtm-85 -65.78 -39.77 91.33 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.832 2.16 . . . . 0.0 116.832 171.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -58.23 -39.37 78.92 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 130.296 3.438 . . . . 0.0 112.013 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -61.44 -59.2 5.61 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 128.188 2.595 . . . . 0.0 114.347 163.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 50.5 mt -75.11 -25.4 58.45 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 122.036 2.198 . . . . 0.0 114.529 -165.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -52.53 -35.79 54.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 129.71 3.204 . . . . 0.0 110.814 170.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -95.47 -47.71 6.15 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.156 2.183 . . . . 0.0 114.021 175.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.9 t -68.16 -20.78 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 O-C-N 119.749 -1.844 . . . . 0.0 112.928 -170.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 50.9 mt -107.14 -42.99 4.72 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -176.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 11.5 mt -77.35 -5.76 50.8 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.007 -1.451 . . . . 0.0 114.066 -174.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -104.29 -2.56 25.41 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 117.268 2.322 . . . . 0.0 117.268 169.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 31.6 m -79.68 -1.13 36.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 114.338 -2.744 . . . . 0.0 114.051 164.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 . . . . . 0 C--O 1.25 1.107 0 CA-C-N 124.905 3.502 . . . . 0.0 109.523 -178.689 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 11.5 ttt . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 116.941 -1.504 . . . . 0.0 111.581 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.263 . . -57.39 141.96 45.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 129.049 2.94 . . . . 0.0 104.646 178.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -120.11 149.66 41.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 123.921 0.763 . . . . 0.0 111.301 -176.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -141.2 148.37 39.83 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 174.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 60.4 p -159.67 158.47 27.38 Favored Pre-proline 0 N--CA 1.446 -0.646 1 C-N-CA 132.77 4.428 . . . . 0.0 111.025 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -52.91 -47.82 25.45 Favored 'Trans proline' 0 N--CA 1.45 -1.076 0 C-N-CA 122.376 2.051 . . . . 0.0 113.58 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -139.88 141.52 36.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 117.308 -3.37 . . . . 0.0 110.951 -171.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 11.9 t -141.95 137.38 31.22 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 112.684 -2.053 . . . . 0.0 106.341 168.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.89 -42.76 94.51 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 117.546 2.424 . . . . 0.0 117.546 174.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.85 -33.38 23.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 168.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 47.6 mtt -83.44 -37.83 22.69 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 115.189 -2.338 . . . . 0.0 113.43 175.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.85 -37.31 71.11 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 123.224 2.738 . . . . 0.0 112.802 166.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -67.52 -38.36 84.12 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 119.389 -2.069 . . . . 0.0 114.661 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -72.22 -25.97 61.85 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.074 -1.641 . . . . 0.0 111.626 176.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -39.59 86.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 125.888 2.756 . . . . 0.0 113.237 169.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -69.54 -48.83 59.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 119.439 -2.038 . . . . 0.0 108.856 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -70.34 -24.85 63.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 115.265 -2.302 . . . . 0.0 110.552 -175.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -56.8 -48.9 76.89 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.482 2.313 . . . . 0.0 113.138 161.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 -56.29 -64.74 0.76 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 170.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -57.7 -33.08 68.01 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.901 2.08 . . . . 0.0 106.342 -175.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -66.74 -36.12 81.71 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 112.721 -3.514 . . . . 0.0 115.995 167.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -64.78 -37.57 88.05 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 122.747 2.521 . . . . 0.0 107.329 169.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.57 -23.38 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 O-C-N 116.647 -3.783 . . . . 0.0 111.521 176.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -83.6 -40.94 18.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 172.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 32.0 tp -56.13 -41.77 75.85 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 119.268 0.94 . . . . 0.0 111.674 171.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 37.3 tp -72.67 -31.58 65.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 123.962 1.839 . . . . 0.0 113.101 -177.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -83.81 -18.71 36.73 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 119.265 -2.147 . . . . 0.0 114.285 176.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -74.27 -38.87 63.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 116.665 -1.636 . . . . 0.0 112.714 160.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.3 -21.68 62.91 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.13 -5.76 37.81 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 120.34 1.427 . . . . 0.0 108.435 173.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -80.1 -38.55 31.42 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 121.936 2.153 . . . . 0.0 111.473 -176.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . 0.277 25.2 p-10 -120.5 33.11 5.71 Favored 'General case' 0 N--CA 1.451 -0.406 1 O-C-N 115.528 -4.483 . . . . 0.0 116.034 169.89 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 61.48 33.6 18.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 131.097 3.759 . . . . 0.0 117.499 171.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 42.0 mt -103.32 10.22 37.61 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.759 1.623 . . . . 0.0 109.593 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -74.04 -32.62 63.41 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 118.384 -2.698 . . . . 0.0 114.601 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 11.3 mt -78.04 -42.57 2.18 Favored Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-O 116.278 -1.82 . . . . 0.0 108.839 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -59.45 -34.64 97.23 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 CA-C-O 115.306 -2.039 . . . . 0.0 113.578 166.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 14.3 tp -61.66 -43.77 98.23 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.768 1.918 . . . . 0.0 113.654 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -67.01 -25.51 66.33 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 173.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -75.14 -19.08 60.07 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 169.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 38.2 tp -84.2 -55.17 4.33 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 126.027 2.079 . . . . 0.0 113.672 168.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 9.1 mmt -73.93 -24.41 59.66 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 119.13 -2.232 . . . . 0.0 110.973 -162.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 11.1 mp -127.25 132.6 50.33 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 129.743 3.217 . . . . 0.0 111.623 -171.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -73.06 157.23 88.81 Favored Pre-proline 0 N--CA 1.448 -0.532 0 C-N-CA 125.787 1.635 . . . . 0.0 108.622 172.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -45.94 -32.44 9.54 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 121.393 1.396 . . . . 0.0 113.451 168.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -39.88 87.35 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 122.097 0.951 . . . . 0.0 113.368 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -72.76 -47.12 49.47 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 129.797 3.239 . . . . 0.0 109.919 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 58.0 mtm-85 -56.95 -41.54 78.47 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 175.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -70.69 -33.08 70.52 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 172.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.16 -39.58 82.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 171.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 20.9 mt -61.84 -33.2 73.74 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 122.238 2.29 . . . . 0.0 113.612 167.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.42 -27.32 73.84 Favored Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.834 171.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 93.8 m -82.18 -43.61 17.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.034 -2.45 . . . . 0.0 112.131 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -57.25 -36.61 71.18 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 114.214 -2.803 . . . . 0.0 115.298 169.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 22.1 t -51.05 -44.53 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-O 113.585 -3.102 . . . . 0.0 113.926 162.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 16.0 mtp180 -62.14 -28.51 69.69 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 124.698 3.408 . . . . 0.0 112.846 171.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 67.7 mt -80.93 -32.88 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 C-N-CA 119.297 -0.961 . . . . 0.0 111.577 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . 0.408 ' HA ' HD22 ' C' ' 89' ' ' LEU . 92.4 t -66.98 -48.97 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 117.593 -1.194 . . . . 0.0 110.801 165.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -58.47 -50.77 72.55 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -177.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -66.81 -37.01 83.69 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 115.385 -2.245 . . . . 0.0 111.107 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 94.1 mt -70.0 -21.46 63.21 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 116.844 2.164 . . . . 0.0 116.844 173.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 19.7 mt -78.49 -23.69 46.27 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 169.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -71.48 -44.6 64.42 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.874 -2.391 . . . . 0.0 110.868 168.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 65.76 22.78 70.35 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-O 125.235 2.575 . . . . 0.0 116.87 174.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -99.03 -21.52 16.17 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 117.964 -3.08 . . . . 0.0 111.077 -176.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 12.0 mtt -71.89 127.19 31.76 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 120.529 -1.357 . . . . 0.0 112.223 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 60.4 p -74.64 163.01 28.2 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 126.146 2.154 . . . . 0.0 111.382 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -37.89 -41.9 0.57 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 116.191 1.923 . . . . 0.0 116.191 171.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 31.8 ttp-105 -60.75 -48.41 81.9 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 121.912 0.863 . . . . 0.0 111.687 176.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -67.47 -34.17 76.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.97 2.108 . . . . 0.0 106.565 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 68.5 mt -68.72 -30.94 69.68 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 119.069 -2.269 . . . . 0.0 111.82 172.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 39.7 tttp -73.99 -42.34 60.57 Favored 'General case' 0 N--CA 1.453 -0.283 1 O-C-N 115.093 -4.754 . . . . 0.0 116.341 170.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -76.13 -21.6 56.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.84 1.256 . . . . 0.0 109.535 -170.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -124.69 -39.71 2.27 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 117.422 -1.275 . . . . 0.0 114.238 -170.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.326 5.6 mp -102.01 -15.56 16.75 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 115.869 -2.015 . . . . 0.0 109.588 -168.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 48.2 -131.11 19.58 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 128.433 2.921 . . . . 0.0 117.328 158.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.25 -22.28 33.1 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.575 -2.133 . . . . 0.0 111.926 -174.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.23 -15.13 81.85 Favored Glycine 0 CA--C 1.523 0.588 0 C-N-CA 127.065 2.269 . . . . 0.0 112.032 -169.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 17.5 tt -58.64 -33.84 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 125.535 1.534 . . . . 0.0 110.155 -178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.6 -32.7 74.19 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 120.897 -1.127 . . . . 0.0 113.505 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 2.9 m -62.79 -44.03 97.23 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 117.462 -3.274 . . . . 0.0 109.454 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 39.0 mm -88.36 -18.26 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 129.385 3.074 . . . . 0.0 112.054 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 71.7 p -110.93 -11.05 14.37 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 120.701 3.593 . . . . 0.0 120.701 174.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 43.3 mtp85 -115.29 156.1 26.07 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.426 -3.296 . . . . 0.0 113.335 174.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.86 172.22 45.61 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 128.034 2.73 . . . . 0.0 112.783 -177.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 97.2 p -89.86 10.08 25.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 116.976 -3.661 . . . . 0.0 117.776 -176.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -104.55 0.85 29.13 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 118.002 -2.936 . . . . 0.0 114.215 161.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 99.9 p -59.23 172.83 0.55 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 126.459 3.028 . . . . 0.0 115.753 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' C' ' 58' ' ' VAL . 26.5 tp -70.72 -12.44 61.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 111.015 -2.811 . . . . 0.0 111.3 -170.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -124.02 0.98 8.58 Favored 'General case' 0 N--CA 1.451 -0.376 1 O-C-N 116.262 -4.024 . . . . 0.0 110.328 177.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -113.36 -21.33 10.96 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 121.535 3.902 . . . . 0.0 121.535 173.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.42 157.78 4.62 Favored Pre-proline 0 N--CA 1.452 -0.352 0 C-N-CA 129.499 3.12 . . . . 0.0 112.994 170.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -56.98 129.05 32.47 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 N-CA-C 114.389 0.88 . . . . 0.0 114.389 173.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 61.8 t -59.78 -30.84 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 C-N-CA 128.907 2.883 . . . . 0.0 112.0 -162.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -62.59 -24.42 67.55 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 176.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 4.6 tp -68.35 -55.77 10.87 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 115.594 -2.146 . . . . 0.0 110.136 168.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 59.6 mtp180 -48.49 -40.79 27.83 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 128.593 2.757 . . . . 0.0 108.589 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -70.89 -52.84 17.71 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.613 1.965 . . . . 0.0 112.46 -179.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 32.8 t90 -46.7 -40.71 13.79 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 116.833 -3.667 . . . . 0.0 117.829 168.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 27.9 mt -75.46 -22.02 57.64 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.237 -175.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -78.64 -34.34 46.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 117.696 -1.145 . . . . 0.0 108.658 172.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -68.94 -18.57 64.11 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 125.245 1.418 . . . . 0.0 110.869 -178.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 96.9 t -105.58 -40.77 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 C-N-CA 127.819 2.448 . . . . 0.0 115.808 -177.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -103.51 -16.37 15.58 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 128.743 2.817 . . . . 0.0 111.728 -167.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 23.9 mt -120.44 -3.47 9.91 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 121.317 1.871 . . . . 0.0 112.427 -177.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -60.6 153.59 23.31 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 118.242 -2.786 . . . . 0.0 117.754 -171.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 72.4 m -121.7 76.15 1.25 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 124.565 2.126 . . . . 0.0 106.796 178.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 27.8 t70 . . . . . 0 C--O 1.247 0.959 0 C-N-CA 129.228 3.011 . . . . 0.0 109.734 -177.506 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 64.6 ttp . . . . . 0 N--CA 1.467 0.383 0 N-CA-C 112.953 0.724 . . . . 0.0 112.953 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.62 156.97 38.76 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 119.056 2.984 . . . . 0.0 119.056 -166.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -138.08 142.24 40.25 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 130.366 3.466 . . . . 0.0 110.968 -172.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -133.0 121.13 22.3 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 123.86 1.79 . . . . 0.0 107.999 -168.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 66.9 p -72.14 150.4 92.25 Favored Pre-proline 0 N--CA 1.446 -0.625 0 CA-C-O 114.699 -2.572 . . . . 0.0 115.084 172.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -61.96 -19.55 66.39 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 CA-C-N 122.709 2.003 . . . . 0.0 117.239 172.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . 0.354 49.5 t80 -173.78 148.1 1.43 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.386 2.274 . . . . 0.0 106.804 171.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 11.9 t -62.19 128.64 37.07 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 103.236 -2.875 . . . . 0.0 103.236 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.42 -25.26 61.41 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 112.826 -1.988 . . . . 0.0 111.205 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.93 -36.4 83.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 119.072 -2.267 . . . . 0.0 114.457 165.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -66.63 -33.91 76.71 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 177.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . 0.28 . . -60.86 -35.41 76.51 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 118.257 -2.777 . . . . 0.0 109.602 175.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -70.85 -50.88 30.49 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.292 -2.13 . . . . 0.0 106.726 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -54.77 -46.23 74.37 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.28 2.232 . . . . 0.0 108.15 -170.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -31.36 71.32 Favored 'General case' 0 N--CA 1.45 -0.459 1 O-C-N 115.872 -4.268 . . . . 0.0 110.647 -168.594 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.6 t60 -76.56 -27.67 55.98 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 164.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -67.67 -33.21 74.47 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 118.017 -2.927 . . . . 0.0 116.139 169.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -74.99 -26.55 59.65 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 128.833 2.853 . . . . 0.0 115.196 167.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 5.1 t-105 -70.58 -48.26 56.13 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 116.939 -3.6 . . . . 0.0 110.371 165.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 93.6 mt -68.56 -25.22 64.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 120.52 -1.363 . . . . 0.0 110.14 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 17.4 ttt180 -62.37 -33.97 75.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 118.047 -0.978 . . . . 0.0 112.039 168.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . 0.451 88.1 t80 -70.68 -36.56 73.38 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 171.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.99 -45.47 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 O-C-N 119.144 -2.223 . . . . 0.0 110.396 172.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -74.91 -33.48 62.02 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 118.033 2.605 . . . . 0.0 118.033 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 17.3 tp -60.62 -43.05 97.92 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 124.353 2.025 . . . . 0.0 111.099 167.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 42.3 tp -60.91 -44.0 97.77 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 118.272 -2.767 . . . . 0.0 109.546 175.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -59.36 -55.62 32.46 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 120.092 1.315 . . . . 0.0 107.89 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -58.14 -30.56 66.43 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 126.483 2.364 . . . . 0.0 115.858 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.34 -24.95 62.2 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.899 0.88 . . . . 0.0 112.048 175.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -76.81 -26.16 54.1 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 119.516 1.053 . . . . 0.0 110.428 168.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -84.54 -19.06 33.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 118.185 -2.822 . . . . 0.0 113.421 -176.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 53.7 p30 -114.97 10.38 16.27 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 114.889 1.441 . . . . 0.0 114.889 172.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 49.63 42.42 23.19 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.601 1.188 . . . . 0.0 112.024 -176.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 47.1 mt -102.03 11.99 37.56 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 121.476 1.944 . . . . 0.0 112.824 167.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . 0.366 0.0 OUTLIER -49.71 -67.16 0.28 Allowed 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 119.876 3.287 . . . . 0.0 119.876 177.296 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 6.2 mt -58.2 -48.63 96.69 Favored Pre-proline 0 N--CA 1.449 -0.505 0 CA-C-O 114.745 -2.55 . . . . 0.0 110.554 -177.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.33 -25.49 71.45 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 CA-C-N 125.36 2.95 . . . . 0.0 112.912 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 14.8 tp -79.48 -40.23 30.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 125.535 3.789 . . . . 0.0 116.575 177.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 89.0 mt -68.34 -42.56 79.11 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 11.8 m-20 -71.5 -28.21 63.75 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 113.844 -2.979 . . . . 0.0 117.009 177.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 28.1 tp -57.6 -52.1 66.8 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 114.063 -2.875 . . . . 0.0 114.149 156.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 19.4 mmt -75.88 -25.66 56.32 Favored 'General case' 0 N--CA 1.448 -0.529 1 C-N-CA 131.823 4.049 . . . . 0.0 117.704 -173.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 14.6 mt -132.95 129.63 38.52 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 126.012 2.07 . . . . 0.0 110.476 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 71.6 p -77.25 167.23 38.21 Favored Pre-proline 0 N--CA 1.451 -0.412 0 CA-C-O 114.927 -2.463 . . . . 0.0 109.369 -167.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -45.23 -42.18 16.88 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 O-C-N 125.938 2.546 . . . . 0.0 116.15 -173.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -92.01 -7.65 48.28 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.765 1.626 . . . . 0.0 111.387 -169.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -88.5 -36.17 16.58 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 168.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -66.48 -38.64 87.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 127.199 2.2 . . . . 0.0 111.864 169.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -79.35 -37.39 37.55 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 119.747 -1.846 . . . . 0.0 108.955 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -49.44 -58.71 4.65 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 121.812 2.097 . . . . 0.0 108.93 163.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 49.0 mt -64.13 -44.09 93.25 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 117.786 -3.071 . . . . 0.0 111.406 -165.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -33.64 -50.3 0.57 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-O 114.48 -3.4 . . . . 0.0 121.551 149.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 28.7 m -73.57 -29.71 62.58 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 120.944 2.372 . . . . 0.0 109.262 177.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.262 96.9 mtt180 -64.42 -28.66 69.83 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 120.509 -1.369 . . . . 0.0 113.573 -176.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 10.8 t -56.62 -51.86 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 120.6 1.545 . . . . 0.0 112.037 162.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -77.08 -11.06 59.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 117.227 -1.789 . . . . 0.0 113.905 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 36.9 mt -74.91 -47.73 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 122.223 2.283 . . . . 0.0 105.804 175.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 91.3 t -65.03 -41.61 92.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 173.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -56.26 -31.18 63.34 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.684 -2.51 . . . . 0.0 115.204 173.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -84.56 -29.69 25.67 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 120.34 1.427 . . . . 0.0 114.543 -176.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 25.0 mt -67.06 -20.46 65.83 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.999 1.719 . . . . 0.0 113.628 161.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 27.6 mt -94.64 -21.22 18.94 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 120.118 -1.614 . . . . 0.0 111.559 171.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . 0.256 32.0 ttm180 -79.95 -40.46 28.03 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.898 0.856 . . . . 0.0 111.295 176.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 73.24 6.63 69.84 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 127.652 2.548 . . . . 0.0 117.98 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -93.48 -32.8 14.05 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 124.872 0.983 . . . . 0.0 113.304 -170.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 39.0 mtt -80.28 42.54 0.58 Allowed 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 127.383 3.468 . . . . 0.0 114.03 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 89.0 p -67.86 163.0 22.89 Favored 'General case' 0 N--CA 1.446 -0.669 1 O-C-N 115.664 -4.398 . . . . 0.0 113.966 -176.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 67.83 -55.21 0.49 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 114.564 -2.636 . . . . 0.0 115.917 163.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 ttt85 -125.05 -29.27 3.34 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 122.327 2.33 . . . . 0.0 116.49 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -77.16 -37.32 54.09 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 118.346 -2.721 . . . . 0.0 111.081 -173.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 11.7 mt -53.71 -30.34 43.43 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.0 1.857 . . . . 0.0 115.405 168.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -91.73 -7.24 50.3 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -136.18 -17.43 1.59 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 114.926 -2.464 . . . . 0.0 117.65 -175.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -90.59 -35.43 15.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 126.549 2.405 . . . . 0.0 112.015 163.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.307 1.4 mm? -94.61 -57.2 2.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 127.352 2.261 . . . . 0.0 116.215 172.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.65 -162.83 44.43 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 116.249 -2.417 . . . . 0.0 114.612 174.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -33.3 -32.93 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 130.159 4.094 . . . . 0.0 118.084 -157.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.01 -19.43 56.7 Favored Glycine 0 C--N 1.337 0.632 1 C-N-CA 131.316 4.294 . . . . 0.0 110.491 174.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . 0.256 0.9 OUTLIER -58.65 -29.94 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 121.655 2.728 . . . . 0.0 114.778 175.508 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.62 -12.86 60.04 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 116.591 -1.671 . . . . 0.0 111.731 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 14.4 m -71.76 -37.16 70.54 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 118.322 2.712 . . . . 0.0 118.322 158.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 25.8 mm -82.93 -27.06 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 CA-C-N 113.645 -1.616 . . . . 0.0 111.573 -173.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 71.5 p -102.31 -19.03 15.17 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 127.261 2.224 . . . . 0.0 110.625 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.322 16.3 mtp180 -119.79 154.25 34.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.297 -2.752 . . . . 0.0 113.531 178.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 109.38 146.41 11.49 Favored Glycine 0 C--N 1.338 0.692 0 C-N-CA 119.922 -1.132 . . . . 0.0 111.355 -159.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 84.5 p -72.68 -21.62 61.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 129.606 3.163 . . . . 0.0 112.907 -160.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -130.09 38.78 3.75 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 128.344 3.527 . . . . 0.0 113.397 175.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 29.1 p -57.46 169.59 0.63 Allowed 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 127.365 2.916 . . . . 0.0 117.374 173.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.373 0.7 OUTLIER -65.77 -3.48 5.0 Favored 'General case' 0 C--O 1.223 -0.297 1 O-C-N 115.59 -4.444 . . . . 0.0 119.443 159.122 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 66.2 tttt -76.68 -22.83 53.45 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 126.957 2.661 . . . . 0.0 114.625 162.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -105.21 -39.89 6.04 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 131.638 3.975 . . . . 0.0 115.448 -152.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . 0.523 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 55.33 85.49 0.19 Allowed Pre-proline 0 N--CA 1.448 -0.569 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 167.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . 0.523 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.357 0.0 OUTLIER 33.95 33.11 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.21 0 C-N-CA 119.468 -3.138 . . . . 0.0 118.857 40.047 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 91.8 t -65.32 -28.81 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 O-C-N 125.837 1.961 . . . . 0.0 107.215 -170.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.263 0.1 OUTLIER -81.82 -42.78 19.18 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 130.066 3.346 . . . . 0.0 109.979 -170.131 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 9.0 tp -63.26 -40.99 98.97 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 118.501 0.591 . . . . 0.0 111.95 165.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 -55.53 -53.59 54.46 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 116.823 -1.56 . . . . 0.0 115.193 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -57.65 -34.63 69.56 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 126.192 2.183 . . . . 0.0 114.41 177.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 59.5 t90 -75.74 -45.51 36.09 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 117.932 -2.98 . . . . 0.0 111.74 175.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 94.1 mt -55.99 -37.13 68.7 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 118.597 -2.564 . . . . 0.0 114.541 174.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -70.8 -21.24 62.5 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 -174.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -89.37 -48.99 6.97 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 123.674 1.702 . . . . 0.0 111.398 171.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 89.7 t -63.17 -38.78 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 O-C-N 118.261 -2.774 . . . . 0.0 113.136 178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 75.6 mt -84.94 -20.74 30.19 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 115.716 -2.394 . . . . 0.0 114.561 -174.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 55.0 mt -93.86 5.38 51.84 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 124.943 2.306 . . . . 0.0 116.078 177.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 19.1 pttp -60.93 147.28 43.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.657 1.983 . . . . 0.0 107.481 -172.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 34.3 m -65.88 -29.0 69.37 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 119.505 3.15 . . . . 0.0 119.505 -171.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 . . . . . 0 C--O 1.252 1.226 0 O-C-N 118.701 -2.5 . . . . 0.0 113.838 166.541 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.24 -14.32 60.91 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -172.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -84.52 4.35 32.31 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 172.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -125.63 -39.26 2.17 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 124.877 1.271 . . . . 0.0 111.872 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 54.2 p -46.96 140.54 6.22 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 127.939 2.496 . . . . 0.0 112.143 175.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.93 -15.77 23.44 Favored 'Trans proline' 0 N--CA 1.448 -1.163 1 C-N-CA 125.438 4.092 . . . . 0.0 106.738 175.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -121.81 151.39 40.66 Favored 'General case' 0 N--CA 1.446 -0.655 1 O-C-N 115.777 -4.327 . . . . 0.0 107.857 176.272 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.6 t -117.51 118.45 32.21 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 115.912 1.819 . . . . 0.0 115.912 166.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.19 -36.33 81.58 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 125.445 1.716 . . . . 0.0 111.887 178.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.3 -41.1 96.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 111.574 -2.557 . . . . 0.0 110.488 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.8 ttp -78.74 -36.79 42.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 117.31 2.337 . . . . 0.0 117.31 176.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.04 -40.52 73.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 173.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -77.67 -39.8 43.73 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -42.23 -40.72 2.5 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 128.313 2.645 . . . . 0.0 113.048 168.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 67.0 mmt-85 -79.87 -25.71 40.58 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 125.401 1.688 . . . . 0.0 114.716 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 29.8 t60 -70.58 -39.16 74.04 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 121.63 2.014 . . . . 0.0 111.295 171.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -55.41 -43.13 74.99 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.108 1.363 . . . . 0.0 110.119 172.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -65.1 -37.47 87.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 118.362 2.727 . . . . 0.0 118.362 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 41.9 t-105 -65.94 -47.88 73.21 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.606 169.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 69.6 mt -57.68 -38.33 74.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 120.56 1.527 . . . . 0.0 109.693 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 43.5 ttt180 -62.75 -36.46 83.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 121.221 1.828 . . . . 0.0 114.658 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -61.76 -41.79 98.14 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 121.195 1.816 . . . . 0.0 108.8 173.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.5 t -67.42 -49.77 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 121.477 1.944 . . . . 0.0 105.912 -173.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -71.15 -32.27 68.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 118.997 -2.314 . . . . 0.0 113.899 -177.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 19.4 tp -55.68 -49.49 72.81 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.524 -2.61 . . . . 0.0 109.169 167.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.09 -31.3 72.44 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 118.649 -2.532 . . . . 0.0 114.331 176.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -57.96 -51.82 68.06 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.801 1.778 . . . . 0.0 115.801 169.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -60.8 -39.43 88.91 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 126.156 1.782 . . . . 0.0 112.93 173.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.72 -48.85 76.84 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 115.054 -2.403 . . . . 0.0 114.845 163.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -55.89 -43.42 77.23 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 124.338 3.244 . . . . 0.0 113.85 172.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -70.55 -21.23 62.73 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 125.071 1.482 . . . . 0.0 114.613 -177.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -95.7 5.87 50.32 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 118.95 2.945 . . . . 0.0 118.95 165.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.398 6.0 m-20 71.59 35.59 1.42 Allowed 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 118.467 -2.646 . . . . 0.0 113.769 -172.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.268 49.1 mt -125.61 14.26 8.13 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 119.975 -1.703 . . . . 0.0 112.86 -167.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -73.97 -41.73 61.53 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 118.715 -2.49 . . . . 0.0 114.81 -172.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.5 mt -64.58 -52.77 49.82 Favored Pre-proline 0 N--CA 1.448 -0.554 0 O-C-N 125.571 1.794 . . . . 0.0 110.386 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -71.67 -20.28 26.81 Favored 'Trans proline' 0 N--CA 1.448 -1.19 0 CA-C-N 121.132 1.44 . . . . 0.0 111.287 -170.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.6 tp -71.22 -56.62 5.68 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 129.132 2.973 . . . . 0.0 109.278 173.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.3 mt -61.3 -30.68 70.63 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 120.074 -1.641 . . . . 0.0 110.04 176.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -67.32 -10.87 55.19 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 117.055 -3.528 . . . . 0.0 113.977 176.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.4 tt -102.96 -36.94 8.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.448 1.499 . . . . 0.0 113.442 173.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 79.9 mmm -78.87 -33.16 46.04 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 127.733 2.413 . . . . 0.0 117.293 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.8 mt -119.03 143.05 47.3 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.948 2.899 . . . . 0.0 112.148 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.7 p -82.91 167.13 31.63 Favored Pre-proline 0 N--CA 1.45 -0.444 0 CA-C-O 115.748 -2.073 . . . . 0.0 114.44 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . 0.443 65.4 Cg_exo -47.24 -60.58 0.83 Allowed 'Trans proline' 0 N--CA 1.45 -1.083 0 N-CA-C 119.935 3.014 . . . . 0.0 119.935 -172.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.428 ' HA ' ' HB3' ' A' ' 49' ' ' GLU . 3.3 p30 -67.55 -6.15 18.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 119.585 3.18 . . . . 0.0 119.585 168.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -84.21 -49.28 8.96 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.061 2.209 . . . . 0.0 108.017 170.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.4 mtm-85 -46.34 -45.86 17.85 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.022 2.129 . . . . 0.0 112.861 163.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.428 ' HB3' ' HA ' ' A' ' 46' ' ' ASP . 30.2 tt0 -66.24 -46.18 78.04 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.953 1.408 . . . . 0.0 112.279 179.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.88 -41.43 87.1 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 130.321 3.448 . . . . 0.0 109.071 170.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.1 mt -54.76 -34.42 62.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 124.552 3.342 . . . . 0.0 112.88 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.05 -49.26 76.85 Favored Glycine 0 N--CA 1.446 -0.66 1 C-N-CA 131.72 4.486 . . . . 0.0 113.282 168.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.9 m -70.87 -34.37 71.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.692 1.197 . . . . 0.0 109.551 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -61.38 -37.18 82.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 117.178 2.288 . . . . 0.0 117.178 177.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.5 t -59.29 -38.9 77.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 125.33 1.452 . . . . 0.0 109.188 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.2 mtp180 -66.34 -31.91 72.98 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 128.389 2.675 . . . . 0.0 111.921 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 85.8 mt -77.29 -35.67 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 125.865 1.666 . . . . 0.0 110.49 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.8 t -67.02 -46.16 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-O 117.144 -1.408 . . . . 0.0 107.768 170.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -64.9 -36.53 84.68 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 121.219 1.827 . . . . 0.0 108.422 -170.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -84.59 -29.82 25.51 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.862 -2.399 . . . . 0.0 111.843 -175.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.277 50.0 mt -69.56 -31.53 69.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 118.432 -2.667 . . . . 0.0 113.046 164.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tt -77.54 -37.27 51.19 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 117.033 -1.867 . . . . 0.0 112.152 172.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -69.06 -31.16 69.72 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 128.261 2.624 . . . . 0.0 115.733 176.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.63 -23.73 8.42 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 121.203 3.241 . . . . 0.0 121.203 164.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -64.89 -51.29 62.77 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 176.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 37.8 ttm -90.94 135.9 33.43 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 -155.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 83.8 p -107.94 170.53 7.94 Favored 'General case' 0 CA--C 1.52 -0.191 0 O-C-N 119.499 -2.001 . . . . 0.0 113.627 -166.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -35.17 -61.55 0.42 Allowed 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 124.879 2.276 . . . . 0.0 110.582 -176.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.0 tpt85 -67.14 -14.98 63.43 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.57 3.148 . . . . 0.0 115.455 -174.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -97.93 -46.89 5.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 128.003 3.314 . . . . 0.0 109.608 175.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.2 mt -50.25 -40.17 47.05 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.3 tptp -46.68 -50.61 17.55 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 111.901 -2.409 . . . . 0.0 114.686 164.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -78.95 -24.89 43.64 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.839 2.056 . . . . 0.0 111.646 -177.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -103.01 -26.71 12.98 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 -171.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 37.1 mt -130.35 0.21 4.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.305 -2.747 . . . . 0.0 113.859 -173.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.57 4.2 17.6 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-N 111.936 -2.393 . . . . 0.0 113.868 -164.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.13 123.16 26.55 Favored 'General case' 0 N--CA 1.449 -0.517 1 O-C-N 115.895 -4.297 . . . . 0.0 110.487 -168.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.78 166.79 45.41 Favored Glycine 0 CA--C 1.524 0.595 1 CA-C-O 128.388 4.327 . . . . 0.0 113.392 173.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 60.3 mt -65.48 -27.44 41.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 110.73 -2.735 . . . . 0.0 109.805 -172.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.73 -37.59 73.5 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 120.414 1.461 . . . . 0.0 111.744 -175.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.6 p -86.94 -16.56 35.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.267 40.8 mm -71.07 -56.5 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 C-N-CA 129.939 3.296 . . . . 0.0 108.978 162.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.4 m -53.71 -44.47 69.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 121.573 1.988 . . . . 0.0 116.219 175.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.5 ttt180 -70.85 -54.59 10.98 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 123.142 1.449 . . . . 0.0 108.928 174.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -51.75 -25.74 15.87 Favored Glycine 0 C--N 1.337 0.608 0 O-C-N 118.647 -2.533 . . . . 0.0 116.797 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.3 m -75.59 -48.28 22.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.805 2.842 . . . . 0.0 110.717 171.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -76.73 -25.04 53.08 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 124.142 0.901 . . . . 0.0 112.079 -176.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 74.8 m -70.19 -35.76 74.16 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 126.22 1.808 . . . . 0.0 115.201 163.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 tp -68.49 -33.38 74.04 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 116.277 -4.014 . . . . 0.0 113.839 167.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -70.37 -43.01 71.03 Favored 'General case' 0 N--CA 1.45 -0.463 1 O-C-N 115.944 -4.223 . . . . 0.0 111.388 175.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.01 -11.22 27.03 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 174.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.86 157.12 42.16 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -61.2 153.23 66.43 Favored 'Trans proline' 0 N--CA 1.449 -1.09 1 C-N-CA 128.6 6.2 . . . . 0.0 115.27 160.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 31.2 m -78.7 -29.92 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 117.399 -1.72 . . . . 0.0 115.63 -165.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -61.38 -28.02 68.94 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.975 3.31 . . . . 0.0 112.651 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.61 -48.72 71.31 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.921 2.088 . . . . 0.0 111.106 178.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 80.0 mtm-85 -74.98 -35.98 62.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.117 -2.864 . . . . 0.0 113.946 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -70.04 -17.8 63.27 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 119.079 -2.263 . . . . 0.0 110.519 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 43.8 t90 -91.09 -44.86 9.02 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 85.2 mt -57.88 -38.16 75.27 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -41.55 -41.46 2.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 119.297 3.073 . . . . 0.0 119.297 159.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -96.84 -26.71 15.01 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 123.018 1.39 . . . . 0.0 109.85 -162.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.5 t -86.35 -44.07 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 128.902 2.881 . . . . 0.0 111.531 174.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.6 mt -89.37 -45.1 9.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.766 -1.834 . . . . 0.0 114.611 -171.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.1 mt -103.2 -26.4 13.0 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -167.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -73.78 -6.31 46.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.688 -1.883 . . . . 0.0 111.911 177.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 38.9 m -69.32 -39.94 77.93 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 118.494 -2.629 . . . . 0.0 112.745 164.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 C--O 1.254 1.303 0 O-C-N 118.674 -2.516 . . . . 0.0 115.102 -171.771 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.433 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -51.17 -43.22 61.25 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 119.823 3.268 . . . . 0.0 119.823 -157.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -53.88 -24.82 17.22 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 119.644 3.202 . . . . 0.0 119.644 167.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 23.8 tp60 -85.56 -33.84 21.62 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 124.429 1.091 . . . . 0.0 109.497 -172.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . 0.282 65.9 m -76.74 146.72 76.85 Favored Pre-proline 0 N--CA 1.45 -0.46 1 O-C-N 114.899 -4.876 . . . . 0.0 109.367 -178.038 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -60.54 -45.21 22.73 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 125.206 3.938 . . . . 0.0 110.681 169.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . 0.417 ' CG ' ' N ' ' B' ' 8' ' ' SER . 63.5 t80 -110.51 154.75 23.24 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 122.147 2.249 . . . . 0.0 112.663 176.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' SER . . . . . 0.417 ' N ' ' CG ' ' B' ' 7' ' ' TYR . 43.6 t -153.91 128.91 9.56 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 118.78 0.718 . . . . 0.0 112.752 166.288 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.47 -34.86 47.31 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 127.191 2.196 . . . . 0.0 111.545 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.05 -38.45 90.86 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 115.068 -2.396 . . . . 0.0 113.649 174.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 19.4 mtt -69.07 -35.24 76.31 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 126.983 2.677 . . . . 0.0 111.79 168.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.9 -32.25 69.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 122.565 2.438 . . . . 0.0 109.174 -175.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -73.51 -30.84 63.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 116.056 -1.926 . . . . 0.0 108.09 174.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -76.92 -31.47 56.69 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.794 1.179 . . . . 0.0 109.007 -175.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -71.0 -31.05 67.47 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 127.71 2.404 . . . . 0.0 113.517 173.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 45.3 t60 -66.61 -36.09 81.76 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.933 1.693 . . . . 0.0 112.186 164.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -83.63 -10.54 58.15 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 118.8 -2.437 . . . . 0.0 113.678 174.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -90.36 -23.31 21.13 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 118.3 -2.75 . . . . 0.0 110.12 171.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 1.8 t-105 -76.52 -34.96 58.55 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 120.097 1.317 . . . . 0.0 112.378 167.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 19.5 mt -70.11 -9.98 57.28 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 119.06 -1.056 . . . . 0.0 112.631 175.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -79.38 -32.28 43.07 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 129.024 2.93 . . . . 0.0 115.944 162.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -68.16 -29.84 68.81 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 115.066 -2.654 . . . . 0.0 112.939 163.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 98.1 t -73.37 -43.75 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 120.897 -1.127 . . . . 0.0 113.812 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -60.31 -52.72 64.05 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 171.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 14.4 tp -58.24 -34.87 70.92 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 114.737 -2.554 . . . . 0.0 110.994 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 55.5 tp -64.2 -57.07 10.57 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 128.762 2.825 . . . . 0.0 108.396 176.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -47.04 -53.24 13.04 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 119.102 -2.249 . . . . 0.0 115.396 167.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -56.09 -40.82 74.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 117.7 -1.6 . . . . 0.0 110.507 177.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.28 -35.05 76.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.368 1.08 . . . . 0.0 113.471 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -60.61 -47.27 86.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 127.249 2.219 . . . . 0.0 111.963 173.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -56.87 -24.5 52.14 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 170.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -108.73 -3.45 17.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 131.264 3.825 . . . . 0.0 112.933 -171.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 61.17 35.67 18.4 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 126.463 2.352 . . . . 0.0 117.29 -174.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.8 mt -123.35 12.82 9.48 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 127.645 2.378 . . . . 0.0 116.219 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -59.9 -38.2 81.59 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 119.39 3.107 . . . . 0.0 119.39 175.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 2.0 mt -71.96 -48.15 11.11 Favored Pre-proline 0 N--CA 1.451 -0.414 0 O-C-N 124.728 1.268 . . . . 0.0 114.421 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -63.21 -27.83 72.73 Favored 'Trans proline' 0 N--CA 1.447 -1.218 0 C-N-CA 123.971 3.114 . . . . 0.0 112.528 172.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.6 tp -67.26 -47.26 71.25 Favored 'General case' 0 N--CA 1.449 -0.522 1 O-C-N 115.007 -4.808 . . . . 0.0 112.883 167.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 89.2 mt -65.43 -16.9 64.11 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.505 1.522 . . . . 0.0 115.066 170.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -81.92 -28.97 32.53 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 130.458 3.503 . . . . 0.0 110.332 166.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 60.5 tp -89.52 -26.24 20.99 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 118.776 -1.17 . . . . 0.0 112.956 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . 0.259 15.4 mmt -95.97 -16.37 21.74 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 119.408 3.114 . . . . 0.0 119.408 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 31.9 mt -123.68 143.94 49.95 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.232 2.613 . . . . 0.0 109.797 174.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 40.0 p -93.95 174.88 3.39 Favored Pre-proline 0 N--CA 1.452 -0.353 0 O-C-N 126.754 2.534 . . . . 0.0 112.134 177.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -62.61 -46.42 11.6 Favored 'Trans proline' 0 N--CA 1.449 -1.1 0 CA-C-O 123.9 1.542 . . . . 0.0 112.714 -170.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -53.46 -40.6 65.4 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 116.108 -1.901 . . . . 0.0 115.329 172.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -75.36 -35.37 61.13 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 127.503 3.002 . . . . 0.0 117.305 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 43.9 mtm-85 -65.73 -47.93 73.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.245 2.218 . . . . 0.0 109.444 173.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -63.95 -35.86 82.08 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 176.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.98 -50.9 71.94 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.011 1.724 . . . . 0.0 113.629 160.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 30.6 mt -56.62 -45.59 81.43 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 116.396 -1.764 . . . . 0.0 107.531 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.51 -39.8 75.49 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-O 126.104 3.058 . . . . 0.0 119.717 174.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.5 m -74.61 -35.48 62.94 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 110.565 -2.817 . . . . 0.0 111.749 173.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . 0.305 96.6 mtt180 -56.58 -32.08 64.87 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 123.611 2.914 . . . . 0.0 112.971 170.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . 0.415 13.6 t -51.2 -51.46 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 120.619 1.554 . . . . 0.0 109.712 166.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -76.1 -33.09 59.49 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 117.308 2.336 . . . . 0.0 117.308 -174.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 42.1 mt -68.26 -39.62 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 CA-C-O 114.376 -2.726 . . . . 0.0 104.82 173.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.279 53.4 t -77.5 -35.44 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 1 CA-C-N 127.647 4.748 . . . . 0.0 112.08 -179.66 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -60.44 -34.0 73.35 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 125.736 2.684 . . . . 0.0 117.946 165.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -83.73 -33.73 25.02 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 114.185 -2.816 . . . . 0.0 107.84 -176.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 27.2 mt -43.15 -46.44 5.91 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 124.424 3.283 . . . . 0.0 114.43 157.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 17.1 mt -83.01 -21.09 33.97 Favored 'General case' 0 N--CA 1.451 -0.424 1 N-CA-C 122.756 4.354 . . . . 0.0 122.756 172.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 32.2 ttm105 -69.23 -49.22 58.4 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.83 47.36 8.68 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 118.417 2.127 . . . . 0.0 118.417 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . 0.284 66.4 mm-40 -117.66 -37.1 3.52 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 116.937 -1.506 . . . . 0.0 108.485 -171.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' MET . . . . . 0.461 ' HE2' ' HB3' ' B' ' 70' ' ' GLU . 90.8 mtp -100.12 123.3 44.2 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 123.623 2.92 . . . . 0.0 113.736 -162.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 97.4 p -64.18 162.66 14.07 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 125.077 1.486 . . . . 0.0 113.669 173.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -45.08 -33.66 2.25 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.659 1.984 . . . . 0.0 115.147 165.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -67.73 -52.01 42.55 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 127.062 3.315 . . . . 0.0 108.884 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . 0.461 ' HB3' ' HE2' ' B' ' 66' ' ' MET . 24.8 mt-10 -53.5 -48.12 69.25 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 118.073 -2.892 . . . . 0.0 116.237 173.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 59.8 mt -57.18 -39.22 74.91 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 123.316 1.532 . . . . 0.0 111.548 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 32.3 tptt -77.25 -51.79 10.32 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 112.036 -2.347 . . . . 0.0 109.724 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -82.54 -4.03 56.92 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 117.002 2.223 . . . . 0.0 117.002 -169.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -137.03 -12.02 1.69 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 113.241 -1.8 . . . . 0.0 111.442 -169.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 26.8 mt -134.53 7.73 3.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 113.388 -3.196 . . . . 0.0 111.74 177.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 60.65 16.66 46.07 Favored Glycine 0 CA--C 1.522 0.488 0 C-N-CA 129.742 3.544 . . . . 0.0 112.013 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.07 108.92 18.38 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 121.731 3.975 . . . . 0.0 121.731 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.0 175.54 53.07 Favored Glycine 0 CA--C 1.523 0.577 0 O-C-N 119.317 -2.114 . . . . 0.0 113.857 -174.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 6.4 mt -50.34 -43.16 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 O-C-N 120.061 -1.847 . . . . 0.0 115.361 176.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.76 -38.87 90.24 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.467 -2.645 . . . . 0.0 111.955 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 37.8 m -67.69 -52.04 42.56 Favored 'General case' 0 N--CA 1.444 -0.744 0 O-C-N 126.268 2.23 . . . . 0.0 109.223 -176.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 37.5 mm -65.91 -41.52 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-O 115.472 -2.204 . . . . 0.0 110.51 176.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 98.3 m -54.71 -65.63 0.54 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 124.034 3.107 . . . . 0.0 109.344 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -49.85 -42.03 46.57 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 117.215 2.302 . . . . 0.0 117.215 167.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -39.09 -60.86 1.51 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 118.634 2.214 . . . . 0.0 118.634 162.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 91.6 p -75.46 -21.06 58.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 128.902 2.881 . . . . 0.0 110.806 -175.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -71.54 -33.86 69.51 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 117.206 2.298 . . . . 0.0 117.206 163.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 2.4 m -72.7 -30.82 64.53 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 116.519 -1.705 . . . . 0.0 109.998 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 11.6 mt -59.59 -52.64 64.69 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 124.391 3.269 . . . . 0.0 116.473 166.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 50.5 tttm -63.81 -19.81 65.3 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -176.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.46 -22.1 32.68 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 114.842 -2.504 . . . . 0.0 116.892 167.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.99 151.01 97.58 Favored Pre-proline 0 N--CA 1.451 -0.394 0 CA-C-N 121.868 2.122 . . . . 0.0 114.629 -169.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . 0.274 52.4 Cg_exo -49.85 133.98 34.33 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 124.844 3.696 . . . . 0.0 114.154 163.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 22.4 m -73.41 -25.61 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -158.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 12.9 pm0 -62.09 -31.48 71.93 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 118.018 -0.992 . . . . 0.0 109.55 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 33.7 tp -74.27 -46.31 42.14 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 120.09 1.314 . . . . 0.0 107.472 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.3 mtm-85 -59.26 -34.06 71.8 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 176.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -71.41 -27.28 63.19 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 30.3 t90 -81.78 -50.1 9.63 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 131.454 3.902 . . . . 0.0 111.978 173.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 40.0 mt -69.29 -19.71 63.9 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 116.518 -1.706 . . . . 0.0 115.55 -170.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -60.29 -36.6 78.25 Favored 'General case' 0 N--CA 1.452 -0.355 1 CA-C-O 111.663 -4.018 . . . . 0.0 114.91 174.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -86.17 -36.88 19.24 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 123.574 2.897 . . . . 0.0 112.422 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 37.5 t -49.97 -61.74 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 126.292 1.837 . . . . 0.0 108.566 169.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 80.4 mt -78.16 -48.62 15.52 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 118.168 -1.413 . . . . 0.0 111.13 -165.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 57.4 mt -88.86 27.86 1.26 Allowed 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.886 -2.384 . . . . 0.0 110.642 -164.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -130.01 7.42 5.1 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 128.244 2.618 . . . . 0.0 111.983 171.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 71.2 m -87.73 -9.4 54.14 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.347 2.659 . . . . 0.0 115.098 163.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.683 2.793 . . . . 0.0 109.596 168.636 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 44.4 ttm . . . . . 0 N--CA 1.474 0.732 0 CA-C-O 117.787 -1.102 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.38 136.77 57.44 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.421 1.488 . . . . 0.0 110.296 175.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -104.27 163.15 12.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.969 2.508 . . . . 0.0 112.951 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -158.72 146.08 17.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 116.914 -3.616 . . . . 0.0 108.896 -169.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 59.0 p -154.66 173.81 4.44 Favored Pre-proline 0 N--CA 1.452 -0.326 0 C-N-CA 127.796 2.439 . . . . 0.0 117.512 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -69.62 -29.6 24.27 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 120.926 1.084 . . . . 0.0 113.412 171.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -150.1 145.99 26.66 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.696 2.398 . . . . 0.0 111.763 -171.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t -153.44 129.25 10.16 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 170.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.41 -24.98 67.7 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 114.783 -2.532 . . . . 0.0 112.138 176.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.27 -21.72 66.29 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 116.521 -1.704 . . . . 0.0 114.867 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 58.9 mtt -85.77 -34.35 21.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 127.179 2.799 . . . . 0.0 109.386 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.09 -33.06 75.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 123.347 1.546 . . . . 0.0 110.565 173.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -78.22 -23.75 47.32 Favored 'General case' 0 N--CA 1.449 -0.495 1 O-C-N 115.375 -4.578 . . . . 0.0 114.294 178.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -84.2 -38.11 20.99 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.685 -1.15 . . . . 0.0 111.797 175.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -37.78 82.42 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 118.603 0.638 . . . . 0.0 112.174 169.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -59.58 -35.68 74.76 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 116.637 -2.025 . . . . 0.0 113.762 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -75.04 -35.93 61.88 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 130.002 3.321 . . . . 0.0 110.056 -176.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -67.9 -50.53 55.68 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.559 1.144 . . . . 0.0 111.796 173.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 17.5 t-105 -58.39 -46.09 87.05 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 117.673 2.471 . . . . 0.0 117.673 167.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -66.11 -21.94 66.38 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 113.607 -3.092 . . . . 0.0 114.279 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -60.67 -44.76 96.1 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 122.148 2.249 . . . . 0.0 112.947 165.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -57.0 -44.03 82.33 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 128.108 2.563 . . . . 0.0 105.321 -176.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 34.2 t -67.2 -34.24 68.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 116.828 -1.558 . . . . 0.0 113.682 -177.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -84.19 -43.53 14.85 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 125.859 1.974 . . . . 0.0 109.139 -172.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 21.1 tp -56.97 -37.47 71.62 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 117.159 -1.4 . . . . 0.0 109.779 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 17.1 tp -76.83 -31.84 57.16 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 120.014 1.279 . . . . 0.0 109.529 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -59.2 -46.14 89.2 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 126.725 2.01 . . . . 0.0 114.989 169.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -60.96 -36.86 80.51 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 129.768 3.227 . . . . 0.0 113.644 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.28 -25.42 62.44 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 128.253 2.621 . . . . 0.0 114.271 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -61.52 -25.65 67.42 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.896 2.078 . . . . 0.0 112.754 169.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -93.44 -0.92 56.28 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 118.44 -2.663 . . . . 0.0 113.097 -174.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -134.97 18.42 3.47 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 120.759 1.618 . . . . 0.0 114.139 165.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 67.02 20.12 10.46 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.865 1.266 . . . . 0.0 113.885 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 94.2 mt -85.35 10.5 12.49 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 174.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -74.68 -40.11 61.59 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 118.243 -2.785 . . . . 0.0 112.872 -171.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.285 26.0 mt -62.61 -52.94 61.35 Favored Pre-proline 0 N--CA 1.446 -0.644 0 C-N-CA 129.405 3.082 . . . . 0.0 113.692 167.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -55.28 -41.93 73.51 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 N-CA-C 117.563 2.101 . . . . 0.0 117.563 170.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 64.0 tp -56.48 -37.85 70.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.132 1.373 . . . . 0.0 112.935 171.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 32.7 mt -92.08 -5.87 51.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -84.03 -21.51 31.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.463 1.905 . . . . 0.0 110.017 163.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 27.4 tp -83.26 -45.02 14.31 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 126.696 3.141 . . . . 0.0 116.524 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 3.9 mmt -87.2 -7.52 57.85 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 111.616 -2.538 . . . . 0.0 114.899 -162.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 10.0 mp -137.28 161.09 37.18 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 127.247 2.219 . . . . 0.0 109.28 -175.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 23.3 p -100.38 164.97 15.29 Favored Pre-proline 0 N--CA 1.449 -0.495 0 O-C-N 119.231 -2.168 . . . . 0.0 110.465 172.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -41.28 -46.55 5.57 Favored 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 123.352 2.701 . . . . 0.0 115.036 171.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.75 -13.54 58.89 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 127.162 2.789 . . . . 0.0 115.286 -174.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -87.78 -30.22 20.42 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 131.229 3.812 . . . . 0.0 112.132 174.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 87.5 mtm-85 -71.33 -43.03 67.79 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 116.762 -1.589 . . . . 0.0 113.738 163.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -64.21 -23.69 67.4 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 125.083 1.489 . . . . 0.0 111.759 172.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.45 -50.36 70.07 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 127.652 2.381 . . . . 0.0 109.838 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 17.0 mt -77.57 -32.44 53.78 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 118.174 -2.828 . . . . 0.0 114.364 176.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.58 -44.73 85.93 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 118.677 -1.725 . . . . 0.0 115.157 164.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 26.9 m -73.15 -30.73 63.79 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 113.932 -2.937 . . . . 0.0 114.421 169.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 23.0 mtt180 -68.71 -36.14 78.06 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 125.891 3.95 . . . . 0.0 115.288 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 14.3 t -57.24 -36.54 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 129.253 3.021 . . . . 0.0 108.786 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 24.1 mtp180 -78.7 -24.07 45.22 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 121.49 0.662 . . . . 0.0 110.545 -176.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 61.8 mt -65.95 -49.4 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 O-C-N 117.691 -3.13 . . . . 0.0 108.174 174.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 96.6 t -53.57 -53.25 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 C-N-CA 128.512 2.725 . . . . 0.0 112.637 173.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -58.56 -39.3 79.9 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.433 1.493 . . . . 0.0 112.333 174.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -80.11 -37.33 33.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 120.927 1.694 . . . . 0.0 111.918 -177.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 80.8 mt -59.43 -36.8 76.58 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 169.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 70.8 mt -84.47 -36.2 22.46 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 125.05 1.469 . . . . 0.0 111.378 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 34.1 ttm180 -52.69 -60.76 2.87 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 117.579 -3.201 . . . . 0.0 110.357 173.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.7 49.29 6.19 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 130.65 3.976 . . . . 0.0 114.594 174.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -123.95 18.85 9.3 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 126.132 2.873 . . . . 0.0 113.372 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 14.5 mtt -116.45 131.91 56.82 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 117.07 -3.519 . . . . 0.0 110.015 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 54.2 p -95.37 162.78 13.52 Favored 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 132.424 4.29 . . . . 0.0 110.935 175.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -50.03 -33.28 17.63 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 116.65 2.093 . . . . 0.0 116.65 -169.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -72.59 -40.03 66.89 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.032 0.933 . . . . 0.0 111.336 177.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -68.08 -36.95 80.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 172.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 48.3 mt -55.67 -37.73 68.68 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.072 1.749 . . . . 0.0 112.066 164.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . 0.363 83.7 tttt -66.75 -63.33 1.09 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.114 0.566 . . . . 0.0 112.45 170.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -70.14 -42.56 72.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 115.284 -2.293 . . . . 0.0 111.154 -169.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -86.41 -48.81 8.11 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 122.391 2.359 . . . . 0.0 116.025 176.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.413 5.3 mp -74.28 -46.4 41.53 Favored 'General case' 0 N--CA 1.451 -0.377 1 CA-C-N 126.611 4.278 . . . . 0.0 113.62 -173.09 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.23 -160.74 52.55 Favored Glycine 0 C--N 1.338 0.639 0 C-N-CA 129.574 3.464 . . . . 0.0 113.12 -175.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -52.77 -27.77 19.42 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 116.352 1.982 . . . . 0.0 116.352 171.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.58 -19.19 26.21 Favored Glycine 0 C--N 1.338 0.661 1 CA-C-O 110.691 -5.505 . . . . 0.0 115.127 175.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 6.3 tt -55.36 -33.66 32.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 1 O-C-N 130.606 4.357 . . . . 0.0 110.683 176.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.54 -40.62 61.59 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.901 -2.999 . . . . 0.0 113.195 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 22.0 m -47.52 -30.53 3.58 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 116.907 2.188 . . . . 0.0 116.907 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 30.8 mm -109.32 -6.63 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 128.318 2.647 . . . . 0.0 115.481 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.9 p -118.94 -17.58 9.03 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 118.483 2.771 . . . . 0.0 118.483 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -105.4 134.51 48.4 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.441 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 108.08 171.55 21.63 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 125.895 1.712 . . . . 0.0 114.584 168.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 89.3 p -65.94 -21.76 66.45 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.163 2.481 . . . . 0.0 116.868 -171.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 57.1 m-80 -95.45 13.44 25.92 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 127.136 2.772 . . . . 0.0 115.754 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 48.7 p -77.73 172.22 13.75 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 128.459 3.981 . . . . 0.0 113.607 -173.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 40.9 tp -59.91 -28.94 68.02 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 117.621 -3.174 . . . . 0.0 113.737 -165.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -108.2 13.04 26.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.214 -2.179 . . . . 0.0 111.4 -177.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -132.09 -33.86 1.3 Allowed 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -27.92 149.14 0.03 OUTLIER Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 127.514 2.326 . . . . 0.0 115.199 147.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -62.27 153.81 67.58 Favored 'Trans proline' 0 N--CA 1.45 -1.077 0 CA-C-O 125.577 2.241 . . . . 0.0 110.722 -175.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 47.8 t -69.08 -50.53 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 C-N-CA 129.91 3.284 . . . . 0.0 106.762 -172.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -46.19 -36.96 6.49 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 123.301 1.524 . . . . 0.0 113.277 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 23.1 tp -76.07 -43.26 44.49 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 117.443 -3.286 . . . . 0.0 108.474 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -66.1 -37.85 86.79 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 115.042 -2.409 . . . . 0.0 106.428 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -66.05 -55.81 14.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 128.707 2.803 . . . . 0.0 110.003 178.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -52.64 -47.36 67.11 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 128.193 3.433 . . . . 0.0 112.362 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 45.3 mt -61.31 -35.76 78.23 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 129.212 3.005 . . . . 0.0 111.913 173.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -72.21 -42.52 65.67 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 116.781 -3.699 . . . . 0.0 112.64 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -56.48 -47.23 79.69 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 129.52 3.128 . . . . 0.0 106.368 176.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 96.4 t -82.2 -62.12 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 124.631 2.158 . . . . 0.0 113.602 -173.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 69.0 mt -71.42 -14.64 62.22 Favored 'General case' 0 N--CA 1.443 -0.775 0 O-C-N 117.318 -3.364 . . . . 0.0 118.214 -172.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 70.6 mt -129.73 39.83 3.66 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 115.375 1.621 . . . . 0.0 115.375 -177.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 46.6 pttt -84.85 170.14 13.44 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 120.966 -1.084 . . . . 0.0 113.766 -173.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 59.4 m -134.3 62.83 1.64 Allowed 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 129.164 2.986 . . . . 0.0 112.682 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 57.6 t0 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 113.483 -3.151 . . . . 0.0 109.371 -176.981 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 48.0 ttp . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 101.184 -3.636 . . . . 0.0 101.184 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.4 159.05 44.62 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 123.691 0.796 . . . . 0.0 112.225 -143.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -142.08 132.81 25.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 125.355 1.659 . . . . 0.0 110.269 -176.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.97 132.96 35.65 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 111.532 -2.576 . . . . 0.0 113.085 175.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 61.2 p -77.8 128.99 77.77 Favored Pre-proline 0 N--CA 1.447 -0.624 0 CA-C-O 114.026 -2.892 . . . . 0.0 110.019 169.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -74.67 -54.97 0.08 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.039 0 CA-C-N 124.473 2.633 . . . . 0.0 108.127 -172.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -125.33 146.56 49.52 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-O 116.674 -1.632 . . . . 0.0 111.403 147.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 38.4 t -76.49 133.45 39.79 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 115.778 -2.058 . . . . 0.0 109.778 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.24 -15.3 0.89 Allowed 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 117.904 2.557 . . . . 0.0 117.904 162.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . 0.262 . . -81.95 -35.81 28.65 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 128.257 3.885 . . . . 0.0 113.727 177.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 2.0 mmm -79.59 -31.07 41.74 Favored 'General case' 0 N--CA 1.452 -0.34 1 O-C-N 116.177 -4.077 . . . . 0.0 113.182 167.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.45 94.94 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 118.205 -2.809 . . . . 0.0 112.793 173.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -46.3 -54.66 8.51 Favored 'General case' 0 N--CA 1.45 -0.425 1 CA-C-O 130.069 4.747 . . . . 0.0 115.953 165.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -64.67 -39.94 94.56 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 109.563 -3.471 . . . . 0.0 113.362 -169.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -16.23 63.08 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 176.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -85.0 -35.86 21.68 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -94.43 -29.36 15.01 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.603 1.961 . . . . 0.0 113.517 -166.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -69.02 -10.15 56.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 113.91 -2.948 . . . . 0.0 110.442 156.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . 0.35 2.7 t-105 -82.8 -38.04 23.67 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 124.4 3.273 . . . . 0.0 110.501 173.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 41.7 mt -71.14 -20.01 62.36 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 113.306 -1.77 . . . . 0.0 111.379 174.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 36.2 ttt180 -64.11 -35.34 80.45 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 121.356 1.889 . . . . 0.0 112.855 167.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -72.85 -47.2 48.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.591 1.957 . . . . 0.0 111.455 168.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . 0.439 18.4 t -58.25 -41.48 81.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 O-C-N 117.447 -3.283 . . . . 0.0 107.782 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -71.7 -31.66 66.99 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 176.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 22.6 tp -70.94 -36.59 72.66 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 123.587 1.661 . . . . 0.0 113.553 171.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 25.1 tp -68.51 -38.72 81.18 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 119.535 -1.978 . . . . 0.0 112.302 172.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 ttpp -58.75 -50.89 72.23 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.749 -3.095 . . . . 0.0 111.009 174.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -60.17 -21.08 61.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.181 -2.199 . . . . 0.0 115.677 175.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.64 -46.47 17.13 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 127.004 2.122 . . . . 0.0 110.012 174.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -58.29 -21.8 50.29 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 121.706 2.048 . . . . 0.0 112.943 173.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -85.46 -14.68 45.35 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.156 1.382 . . . . 0.0 114.587 -171.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -128.3 10.12 6.23 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 120.163 -1.585 . . . . 0.0 113.915 173.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 52.45 38.14 24.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 -172.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 21.1 mt -99.2 16.9 21.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 119.175 3.028 . . . . 0.0 119.175 159.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -67.58 -60.88 2.2 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.319 3.448 . . . . 0.0 108.839 -171.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.98 -29.6 3.17 Favored Pre-proline 0 N--CA 1.449 -0.511 0 CA-C-O 116.372 -1.775 . . . . 0.0 114.104 -174.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.286 53.9 Cg_exo -68.13 -29.89 32.48 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 N-CA-C 116.044 1.517 . . . . 0.0 116.044 164.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 18.7 tp -71.77 -46.87 57.0 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 115.445 -2.217 . . . . 0.0 112.49 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 20.4 mt -55.28 -44.03 75.28 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 126.144 2.153 . . . . 0.0 116.577 170.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -77.32 -27.65 52.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.833 3.208 . . . . 0.0 112.153 -176.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 23.9 tp -54.39 -50.3 67.86 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 117.209 -3.432 . . . . 0.0 111.76 162.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 16.9 mmt -73.19 -39.42 65.61 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 119.604 3.187 . . . . 0.0 119.604 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 21.5 mt -114.52 129.73 56.69 Favored 'General case' 0 N--CA 1.447 -0.587 1 O-C-N 116.056 -4.153 . . . . 0.0 109.695 -167.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 70.8 p -77.38 159.44 77.5 Favored Pre-proline 0 N--CA 1.449 -0.518 0 C-N-CA 126.526 1.93 . . . . 0.0 109.545 176.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -46.37 -38.38 20.56 Favored 'Trans proline' 0 N--CA 1.449 -1.11 1 C-N-CA 125.982 4.455 . . . . 0.0 116.557 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -76.2 -29.09 57.49 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 117.58 -3.2 . . . . 0.0 110.953 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -70.94 -43.85 67.32 Favored 'General case' 0 N--CA 1.446 -0.665 1 O-C-N 116.091 -4.13 . . . . 0.0 104.376 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 13.4 mtm-85 -61.69 -37.64 84.86 Favored 'General case' 0 N--CA 1.448 -0.54 1 O-C-N 114.985 -4.822 . . . . 0.0 114.012 169.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -69.88 -38.35 76.35 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.11 -28.32 66.37 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 116.604 -1.665 . . . . 0.0 111.019 165.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . 0.271 21.3 mt -74.26 -39.46 62.99 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 123.921 3.055 . . . . 0.0 113.699 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -56.0 -39.51 79.51 Favored Glycine 0 C--N 1.333 0.385 0 CA-C-O 122.445 1.025 . . . . 0.0 113.885 167.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 73.7 m -80.17 -28.02 38.86 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.574 -0.813 . . . . 0.0 110.813 -174.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -71.04 -20.87 62.33 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 116.99 -3.569 . . . . 0.0 112.074 175.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.95 -45.52 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 166.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.579 2.7 ptm180 -68.74 -37.34 79.35 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 128.05 2.54 . . . . 0.0 115.698 173.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 27.8 mt -60.1 -46.21 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 119.945 -1.722 . . . . 0.0 108.3 172.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 47.0 t -66.0 -38.54 82.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 CA-C-N 122.669 2.486 . . . . 0.0 113.387 178.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -62.65 -40.9 98.49 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.343 -1.313 . . . . 0.0 109.179 -177.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -82.31 -22.92 35.41 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 115.189 -2.339 . . . . 0.0 108.32 -176.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 25.9 mt -62.65 -37.6 87.03 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 120.774 1.624 . . . . 0.0 111.219 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 32.1 mt -70.3 -43.63 69.99 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 125.653 1.846 . . . . 0.0 114.3 172.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . 0.37 32.0 ttm180 -74.1 -37.9 64.01 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 128.437 2.695 . . . . 0.0 111.744 -172.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 48.31 46.04 28.32 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 122.593 3.797 . . . . 0.0 122.593 170.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -126.94 -35.99 2.23 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 127.485 2.314 . . . . 0.0 110.032 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 20.5 mtt -74.7 51.1 0.46 Allowed 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 147.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 49.6 p -76.13 -172.88 2.18 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -173.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.333 35.5 tp60 68.23 -78.33 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 115.545 -2.169 . . . . 0.0 114.73 159.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 20.1 ttt85 -106.09 -35.76 7.14 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 128.918 2.887 . . . . 0.0 111.668 176.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -76.64 -18.4 58.61 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -168.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -38.61 65.34 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 124.591 1.182 . . . . 0.0 109.217 176.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -78.25 -21.79 49.35 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 118.181 -2.824 . . . . 0.0 115.941 172.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -121.8 -7.31 9.03 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 126.905 2.628 . . . . 0.0 113.503 -156.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -119.0 -41.02 2.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 128.489 2.716 . . . . 0.0 109.607 168.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.08 -29.1 27.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 119.246 0.93 . . . . 0.0 109.344 177.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 76.76 179.53 48.04 Favored Glycine 0 CA--C 1.523 0.545 0 O-C-N 118.899 -2.376 . . . . 0.0 114.296 157.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.06 -8.49 30.78 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.546 -2.738 . . . . 0.0 116.229 -148.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.75 -19.19 73.02 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-O 117.22 -1.878 . . . . 0.0 108.793 173.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 11.5 tt -47.95 -18.44 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 121.15 2.475 . . . . 0.0 114.715 167.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.2 -25.19 12.56 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 118.777 -2.452 . . . . 0.0 109.061 -168.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 7.6 m -64.6 -35.9 82.49 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 116.995 -3.566 . . . . 0.0 113.767 150.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 19.0 mm -82.64 -14.63 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 118.266 -2.771 . . . . 0.0 112.867 -171.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 77.6 p -120.68 -16.86 8.16 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.621 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -99.46 173.53 6.71 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 123.241 2.746 . . . . 0.0 106.811 169.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.01 151.67 26.9 Favored Glycine 0 C--N 1.337 0.612 0 O-C-N 119.979 -1.701 . . . . 0.0 113.566 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 5.7 p -69.46 -11.37 60.77 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 118.976 -2.485 . . . . 0.0 115.437 -151.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -150.27 42.46 0.84 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 127.164 3.364 . . . . 0.0 112.427 -176.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 1.4 p -64.2 168.82 5.07 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 127.42 2.288 . . . . 0.0 115.057 166.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.316 7.0 tt -64.16 -30.51 71.57 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 120.11 -1.619 . . . . 0.0 112.933 171.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 62.5 tttt -62.32 -38.46 89.54 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 127.581 2.352 . . . . 0.0 108.977 169.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -85.28 -27.27 26.09 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 120.477 -1.389 . . . . 0.0 111.383 -163.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . 0.285 . . 62.67 77.79 0.32 Allowed Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 127.075 2.15 . . . . 0.0 108.453 163.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_exo 21.62 29.29 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.18 0 N-CA-C 122.223 3.893 . . . . 0.0 122.223 46.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -57.09 -36.42 51.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 C-N-CA 130.717 3.607 . . . . 0.0 110.546 -171.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.61 -40.28 49.87 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 113.217 -1.81 . . . . 0.0 114.225 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 48.3 tp -52.19 -53.15 46.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 130.667 3.587 . . . . 0.0 106.857 165.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -50.42 -45.63 55.86 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 174.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -63.35 -32.31 73.7 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 128.373 2.669 . . . . 0.0 114.126 -176.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 77.2 t90 -80.85 -44.08 18.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 125.69 2.662 . . . . 0.0 114.47 -178.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 70.1 mt -61.94 -32.19 72.58 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 117.236 -3.415 . . . . 0.0 111.324 165.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -69.59 -19.58 63.66 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 118.902 2.927 . . . . 0.0 118.902 178.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -90.02 -44.93 9.51 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 119.164 -2.21 . . . . 0.0 108.856 171.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 37.6 t -84.42 -34.33 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 O-C-N 119.517 -1.99 . . . . 0.0 110.682 -168.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 64.2 mt -90.34 -34.41 15.7 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 117.848 -3.033 . . . . 0.0 110.225 -172.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 22.5 mt -91.2 15.58 11.57 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 128.494 2.717 . . . . 0.0 111.328 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 7.4 pttp -55.32 158.88 2.92 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 130.6 3.56 . . . . 0.0 108.294 154.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 75.1 m -116.4 23.26 12.22 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 116.854 -1.546 . . . . 0.0 109.812 -164.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 C--O 1.25 1.097 0 C-N-CA 129.409 3.084 . . . . 0.0 115.232 153.98 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 tmm? . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 116.194 1.924 . . . . 0.0 116.194 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -56.19 -32.11 64.05 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 -171.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -62.46 -28.7 70.0 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 170.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -91.15 -5.53 54.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.599 -2.563 . . . . 0.0 116.27 175.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 p -88.36 166.0 25.6 Favored Pre-proline 0 N--CA 1.448 -0.573 0 CA-C-N 113.881 -1.509 . . . . 0.0 108.881 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -81.36 7.74 4.8 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 CA-C-N 121.502 1.572 . . . . 0.0 114.552 -175.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -142.72 164.1 31.01 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 113.853 -2.975 . . . . 0.0 110.569 -170.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.1 t -153.02 124.22 7.54 Favored 'General case' 0 N--CA 1.453 -0.324 1 O-C-N 129.162 4.039 . . . . 0.0 110.008 169.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.41 -20.05 59.15 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 116.709 2.114 . . . . 0.0 116.709 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.03 -54.67 22.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 129.882 3.273 . . . . 0.0 107.287 168.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 41.2 ttp -71.89 -40.2 69.06 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 113.949 -2.929 . . . . 0.0 111.915 -176.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -50.56 -48.36 57.44 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 121.731 2.06 . . . . 0.0 112.554 169.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -67.86 -39.41 83.79 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 126.157 2.884 . . . . 0.0 113.471 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -62.72 -42.96 99.91 Favored 'General case' 0 N--CA 1.449 -0.491 1 O-C-N 116.196 -4.065 . . . . 0.0 112.239 -178.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.3 22.6 mmt180 -74.38 -38.14 63.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 125.597 1.811 . . . . 0.0 111.723 -171.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -53.76 -40.52 66.27 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 161.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -40.98 96.47 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 117.422 -3.299 . . . . 0.0 111.998 177.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -60.73 -27.37 67.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.835 1.654 . . . . 0.0 112.395 177.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 8.6 t-105 -83.84 -49.52 8.97 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.777 1.631 . . . . 0.0 111.77 171.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.9 mt -58.17 -24.73 60.0 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.946 -1.721 . . . . 0.0 113.447 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -63.74 -45.16 91.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 114.527 -1.215 . . . . 0.0 112.013 173.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.432 ' CE2' ' HE2' ' A' ' 42' ' ' MET . 10.0 t80 -61.26 -45.04 96.18 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 124.649 1.218 . . . . 0.0 109.52 172.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.5 t -60.55 -32.0 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 125.23 1.581 . . . . 0.0 111.58 -176.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.91 -38.01 69.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 118.841 2.904 . . . . 0.0 118.841 160.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 28.1 tp -57.54 -49.69 75.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.359 1.063 . . . . 0.0 110.263 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 54.0 tp -70.22 -31.45 68.88 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 113.645 -3.074 . . . . 0.0 113.998 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -61.58 -44.43 97.03 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 128.165 3.416 . . . . 0.0 111.527 168.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -71.33 -26.82 62.99 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 114.022 -1.444 . . . . 0.0 113.05 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.1 -40.56 78.31 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 118.887 -2.383 . . . . 0.0 112.215 167.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.429 ' CE1' ' CD2' ' A' ' 35' ' ' HIS . 53.8 m-85 -55.58 -40.53 72.1 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 116.454 -3.904 . . . . 0.0 113.999 159.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -64.0 -32.97 74.7 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.71 2.05 . . . . 0.0 112.359 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -109.09 10.68 25.99 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 128.376 2.671 . . . . 0.0 114.64 -172.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 63.65 25.26 14.22 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 124.191 1.948 . . . . 0.0 114.911 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.9 mt -107.14 20.98 18.24 Favored 'General case' 0 N--CA 1.449 -0.488 1 O-C-N 116.13 -4.106 . . . . 0.0 115.866 164.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.429 ' CD2' ' CE1' ' A' ' 30' ' ' TYR . 46.7 p-80 -67.62 -32.63 73.47 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.824 -3.048 . . . . 0.0 113.483 175.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.286 14.4 mt -73.0 -43.63 7.87 Favored Pre-proline 0 N--CA 1.448 -0.553 0 CA-C-O 114.636 -2.602 . . . . 0.0 110.588 176.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -59.19 -37.84 89.46 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 CA-C-N 123.195 2.177 . . . . 0.0 111.993 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.0 tp -64.34 -40.54 96.09 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 116.241 -1.837 . . . . 0.0 112.631 175.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.8 mt -77.5 -17.09 58.31 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 121.573 1.988 . . . . 0.0 114.661 -171.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -74.96 -29.89 61.05 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 169.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tt -88.44 -42.87 11.87 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.933 -2.461 . . . . 0.0 106.747 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.432 ' HE2' ' CE2' ' A' ' 22' ' ' PHE . 90.4 mmm -67.55 -25.01 65.6 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 113.474 -3.155 . . . . 0.0 118.433 176.082 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.2 mt -129.25 140.62 51.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 126.279 2.237 . . . . 0.0 109.435 177.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.2 p -72.44 157.35 89.24 Favored Pre-proline 0 N--CA 1.452 -0.369 0 C-N-CA 127.103 2.161 . . . . 0.0 111.608 175.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -51.18 -42.85 51.87 Favored 'Trans proline' 0 N--CA 1.447 -1.253 1 C-N-CA 127.51 5.473 . . . . 0.0 117.746 172.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -70.73 -39.81 73.15 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 116.49 -1.719 . . . . 0.0 115.543 169.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . 0.299 71.9 mt-10 -50.52 -54.26 23.72 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 168.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.7 mtm-85 -61.67 -41.91 98.2 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 117.584 -3.197 . . . . 0.0 112.352 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -73.3 -10.12 59.42 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 120.473 1.488 . . . . 0.0 108.607 -176.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.43 -35.15 12.46 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 119.469 -2.02 . . . . 0.0 113.425 170.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.14 -24.63 62.3 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 178.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.03 -40.62 99.16 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 118.133 -1.984 . . . . 0.0 115.862 157.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 74.8 m -74.18 -29.55 61.81 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 118.634 1.217 . . . . 0.0 111.421 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -59.75 -29.18 67.98 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 116.513 -3.867 . . . . 0.0 112.213 171.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.8 t -75.74 -36.93 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-N 119.87 1.214 . . . . 0.0 109.512 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.2 mtp180 -59.1 -40.94 86.88 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 118.886 -2.384 . . . . 0.0 109.752 168.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.271 74.9 mt -65.18 -50.07 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 C-N-CA 126.163 1.785 . . . . 0.0 110.485 -177.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.1 -39.64 86.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 120.399 -1.438 . . . . 0.0 109.747 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -52.93 -55.37 23.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 121.51 1.959 . . . . 0.0 111.209 173.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -67.95 -22.72 65.03 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 117.159 -3.463 . . . . 0.0 110.638 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.8 mt -87.75 -24.4 23.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 177.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.311 29.3 tp -81.25 -22.94 38.35 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.999 2.12 . . . . 0.0 115.062 163.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . 0.292 45.7 ttm180 -77.57 -55.16 5.6 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.687 -2.508 . . . . 0.0 112.615 175.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.92 10.17 84.39 Favored Glycine 0 CA--C 1.521 0.432 1 N-CA-C 123.72 4.248 . . . . 0.0 123.72 -175.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.306 74.6 mm-40 -106.48 -24.4 12.22 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -172.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.7 ttm -78.27 126.43 30.78 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 126.418 2.324 . . . . 0.0 111.158 155.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.3 p -81.01 162.66 23.72 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 119.389 -2.069 . . . . 0.0 115.667 177.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -55.21 -35.29 64.71 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 120.67 1.577 . . . . 0.0 111.078 172.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.7 tpt85 -72.99 -21.75 60.79 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 119.122 -2.236 . . . . 0.0 110.318 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -86.79 -33.11 20.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 122.028 2.194 . . . . 0.0 110.428 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.3 mt -63.27 -30.88 71.94 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 118.62 -2.55 . . . . 0.0 109.45 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -62.65 -31.15 71.97 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 128.594 2.758 . . . . 0.0 111.133 176.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -101.22 -37.58 8.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 121.72 2.054 . . . . 0.0 112.563 175.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -98.03 -20.53 17.33 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 119.149 -2.219 . . . . 0.0 110.412 -157.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.6 mt -114.27 -8.92 12.88 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 127.72 2.408 . . . . 0.0 110.018 162.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 86.73 10.56 72.57 Favored Glycine 0 CA--C 1.523 0.539 1 O-C-N 114.822 -4.924 . . . . 0.0 115.676 170.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -96.17 121.32 37.82 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 130.401 3.48 . . . . 0.0 115.894 -162.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.16 153.33 51.87 Favored Glycine 0 C--N 1.339 0.713 0 N-CA-C 118.79 2.276 . . . . 0.0 118.79 -176.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 14.5 mt -58.5 -34.92 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 O-C-N 117.036 -3.626 . . . . 0.0 114.202 -164.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.04 -34.06 50.73 Favored 'General case' 0 N--CA 1.452 -0.363 1 O-C-N 115.944 -4.223 . . . . 0.0 116.085 -168.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 48.3 p -78.14 -30.69 49.43 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 119.713 -1.867 . . . . 0.0 108.548 173.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.286 14.5 mm -65.18 -48.17 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 O-C-N 126.04 2.088 . . . . 0.0 110.224 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 45.7 m -58.51 -43.73 89.21 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.047 -0.977 . . . . 0.0 112.824 170.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -61.14 -50.47 73.05 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 -176.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -59.96 -35.94 88.65 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-N 122.336 2.335 . . . . 0.0 113.097 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 71.0 m -60.93 -45.67 93.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -58.22 -43.4 87.68 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 117.139 -3.475 . . . . 0.0 114.784 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.0 m -63.85 -26.44 68.61 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.888 1.675 . . . . 0.0 111.421 176.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.3 tp -83.28 -35.33 25.38 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 113.114 -3.327 . . . . 0.0 109.015 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -70.34 -29.26 65.91 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 127.894 3.247 . . . . 0.0 112.662 170.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.74 3.01 56.41 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.667 1.187 . . . . 0.0 110.71 173.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.99 145.4 77.39 Favored Pre-proline 0 N--CA 1.447 -0.578 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.65 152.37 78.09 Favored 'Trans proline' 0 N--CA 1.451 -0.99 0 C-N-CA 117.17 -1.42 . . . . 0.0 114.628 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -57.76 -42.04 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-O 115.665 -2.112 . . . . 0.0 114.212 -174.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -48.11 -40.98 25.16 Favored 'General case' 0 N--CA 1.453 -0.289 1 O-C-N 130.585 4.928 . . . . 0.0 115.794 173.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 39.3 tp -75.71 -50.01 16.62 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.974 1.368 . . . . 0.0 111.248 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -57.02 -46.76 82.1 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 117.971 -2.956 . . . . 0.0 111.317 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -66.09 -34.51 78.22 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 120.467 -1.395 . . . . 0.0 111.128 -174.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 60.2 t90 -77.34 -34.69 55.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.425 -2.672 . . . . 0.0 109.336 -178.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.7 mt -78.66 -22.98 46.0 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 117.951 -2.968 . . . . 0.0 104.856 -174.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -63.59 -32.61 74.13 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 128.74 2.816 . . . . 0.0 111.733 170.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -87.78 -19.21 27.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 129.098 2.959 . . . . 0.0 112.431 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.8 t -101.37 -61.83 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 80.3 mt -87.4 -19.93 27.39 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 118.006 -2.934 . . . . 0.0 115.331 -162.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.2 mt -106.67 0.51 24.38 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 118.707 -2.496 . . . . 0.0 114.809 178.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.0 tttp -89.16 -3.27 58.66 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 117.669 2.47 . . . . 0.0 117.669 -176.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 4.8 m -111.33 -19.29 12.68 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 116.956 -3.59 . . . . 0.0 115.873 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 128.096 2.559 . . . . 0.0 112.537 -167.082 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? . . . . . 0 N--CA 1.472 0.656 0 CA-C-O 115.772 -2.061 . . . . 0.0 112.332 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.69 -4.77 50.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 125.6 3.818 . . . . 0.0 117.398 -160.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -81.59 -15.25 55.31 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 118.77 -2.456 . . . . 0.0 113.158 174.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 9.2 tp60 -93.75 -30.43 14.88 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 113.838 -1.528 . . . . 0.0 113.528 174.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.37 146.98 48.83 Favored Pre-proline 0 N--CA 1.447 -0.578 0 C-N-CA 117.933 -1.507 . . . . 0.0 112.617 -169.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.78 -12.51 26.5 Favored 'Trans proline' 0 N--CA 1.448 -1.179 1 C-N-CA 125.375 4.05 . . . . 0.0 113.06 -173.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -140.16 152.93 46.44 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 119.265 -2.147 . . . . 0.0 111.718 160.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 29.8 t -147.86 105.54 3.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 124.535 2.112 . . . . 0.0 111.319 177.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.44 -28.2 68.1 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 125.272 2.463 . . . . 0.0 114.577 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.87 -35.96 72.59 Favored 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 118.483 -2.636 . . . . 0.0 113.913 172.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 38.6 mtt -69.06 -35.32 76.43 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 121.681 2.037 . . . . 0.0 110.245 168.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.22 -35.87 80.23 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.048 0.928 . . . . 0.0 111.681 178.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -64.6 -52.99 54.64 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 115.715 -2.088 . . . . 0.0 112.632 164.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 42.6 tp60 -60.53 -28.09 68.14 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 123.598 2.908 . . . . 0.0 117.192 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -77.22 -38.3 51.59 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 126.333 2.968 . . . . 0.0 117.096 172.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -52.24 -51.72 56.71 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.007 -2.933 . . . . 0.0 107.812 169.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -53.79 -36.14 62.11 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 126.468 2.355 . . . . 0.0 115.301 166.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -76.92 -35.25 57.46 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 117.191 -3.443 . . . . 0.0 114.534 -175.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . 0.253 47.9 t-105 -57.68 -50.74 72.19 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.334 -1.479 . . . . 0.0 113.375 158.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 70.8 mt -68.41 -12.16 60.73 Favored 'General case' 0 N--CA 1.452 -0.375 0 O-C-N 116.841 -3.662 . . . . 0.0 110.219 -176.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -83.12 -26.42 31.03 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 122.477 2.399 . . . . 0.0 111.53 169.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -71.25 -42.17 69.18 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.021 160.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 53.6 t -69.02 -43.24 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 1 O-C-N 115.917 -4.239 . . . . 0.0 113.582 -178.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -63.87 -47.51 80.4 Favored 'General case' 0 N--CA 1.454 -0.265 1 C-N-CA 131.997 4.119 . . . . 0.0 111.643 169.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.76 -40.86 85.16 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 120.606 1.548 . . . . 0.0 111.211 176.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 67.8 tp -72.27 -36.69 69.06 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 119.316 -2.115 . . . . 0.0 105.5 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -58.83 -47.8 83.56 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 116.27 -1.824 . . . . 0.0 108.176 175.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -76.97 -30.35 55.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 122.707 2.503 . . . . 0.0 114.314 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.8 -45.86 88.93 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 170.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . 0.264 41.0 m-85 -47.8 -39.39 18.07 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 119.73 3.233 . . . . 0.0 119.73 166.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -66.93 -35.59 80.33 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.724 1.21 . . . . 0.0 109.211 177.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -94.35 -0.7 54.74 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 123.24 1.495 . . . . 0.0 113.127 -173.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.334 8.3 m-20 56.6 36.52 27.75 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 127.726 2.411 . . . . 0.0 116.482 -166.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 61.8 mt -100.26 4.86 44.47 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 29.1 p-80 -61.48 -38.74 88.39 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 128.714 2.806 . . . . 0.0 116.232 -173.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 14.7 mt -70.04 -49.37 19.05 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-O 114.492 -2.671 . . . . 0.0 110.477 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -58.01 -33.32 97.09 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 O-C-N 125.758 2.452 . . . . 0.0 117.228 174.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 37.8 tp -74.62 -45.82 42.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 113.433 -3.175 . . . . 0.0 114.814 173.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 56.8 mt -54.24 -42.3 69.73 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 126.387 2.304 . . . . 0.0 115.927 168.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -62.45 -41.25 98.61 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 31.5 tp -72.47 -36.19 68.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 115.392 -2.242 . . . . 0.0 111.928 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 22.3 mmt -88.78 -19.46 25.99 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 115.656 -2.116 . . . . 0.0 112.52 -170.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 17.1 mt -134.99 146.11 48.75 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 126.761 2.538 . . . . 0.0 111.236 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 30.0 p -88.18 158.1 49.95 Favored Pre-proline 0 N--CA 1.449 -0.482 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -176.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -36.58 -47.46 1.31 Allowed 'Trans proline' 0 N--CA 1.447 -1.207 1 C-N-CA 127.046 5.164 . . . . 0.0 115.823 173.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.89 -29.74 63.4 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 173.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -70.13 -42.49 72.52 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 126.903 3.24 . . . . 0.0 110.911 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -66.13 -51.37 58.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.452 -2.655 . . . . 0.0 112.967 178.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -55.45 -41.2 72.55 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.796 2.438 . . . . 0.0 114.457 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.0 -28.88 60.71 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.5 mt -67.11 -44.14 80.7 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 116.162 1.912 . . . . 0.0 116.162 169.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.86 -46.01 69.12 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.584 166.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 17.9 m -63.6 -51.96 62.98 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 113.834 -2.984 . . . . 0.0 107.627 -175.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -40.9 -33.82 0.34 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.585 2.754 . . . . 0.0 112.424 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 40.7 t -65.1 -42.17 93.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-O 116.27 -1.824 . . . . 0.0 107.302 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 38.4 mtp180 -72.31 -33.06 67.09 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 120.172 1.351 . . . . 0.0 111.334 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 59.5 mt -54.17 -62.62 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 123.449 2.84 . . . . 0.0 112.007 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.338 77.1 t -66.7 -33.07 61.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 C-N-CA 126.212 1.805 . . . . 0.0 110.77 -170.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.93 -28.49 68.97 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 115.223 -2.322 . . . . 0.0 116.928 165.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . 0.291 20.7 tp10 -90.07 -27.36 19.73 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 127.929 3.268 . . . . 0.0 113.157 -179.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 56.9 mt -65.87 -30.41 71.01 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 114.989 -1.005 . . . . 0.0 112.153 166.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 24.0 mt -77.85 -41.74 35.92 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.126 1.371 . . . . 0.0 113.66 170.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 28.5 ttm105 -77.13 -64.07 1.22 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 115.144 -2.36 . . . . 0.0 113.612 -174.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.66 93.25 0.04 OUTLIER Glycine 0 CA--C 1.521 0.45 0 C-N-CA 129.847 3.594 . . . . 0.0 114.172 -165.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -134.48 -60.04 0.8 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 130.762 3.625 . . . . 0.0 114.505 168.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 38.6 mtt -64.08 139.27 58.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 115.875 1.805 . . . . 0.0 115.875 -164.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 82.9 p -72.45 161.5 30.73 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 118.124 2.639 . . . . 0.0 118.124 156.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -54.16 -32.5 55.53 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 117.677 2.473 . . . . 0.0 117.677 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -65.39 -46.77 78.75 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 114.614 -2.612 . . . . 0.0 111.046 173.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -62.48 -43.92 97.65 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 127.063 2.727 . . . . 0.0 116.795 172.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 70.3 mt -56.27 -39.67 73.01 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 117.765 -1.112 . . . . 0.0 112.092 174.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -83.84 -20.91 32.33 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 121.417 1.917 . . . . 0.0 112.648 -171.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -111.67 -34.98 5.89 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 115.57 -2.157 . . . . 0.0 109.113 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -91.29 -24.63 19.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 18.6 mt -112.35 -7.84 13.95 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 130.616 3.566 . . . . 0.0 111.375 169.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.59 18.67 72.19 Favored Glycine 0 C--N 1.336 0.564 0 CA-C-N 121.815 2.098 . . . . 0.0 114.556 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.03 130.1 46.99 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -165.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.85 165.91 44.34 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 128.265 2.84 . . . . 0.0 115.276 169.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 43.1 mt -61.43 -50.7 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-O 118.483 -0.77 . . . . 0.0 112.459 -170.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.13 73.65 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.004 1.483 . . . . 0.0 115.004 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 16.1 m -62.41 -44.37 96.59 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 116.244 -1.836 . . . . 0.0 111.03 174.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 36.2 mm -73.15 -38.97 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 CA-C-N 121.911 2.141 . . . . 0.0 112.449 -178.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 30.2 m -62.38 -45.52 92.76 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 125.199 1.4 . . . . 0.0 111.878 178.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -53.77 -26.05 21.79 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 130.502 3.521 . . . . 0.0 109.751 171.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.14 -43.96 62.13 Favored Glycine 0 C--N 1.337 0.617 0 CA-C-O 124.817 2.343 . . . . 0.0 116.392 177.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . 0.381 7.1 p -61.26 -39.88 91.99 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 117.81 2.522 . . . . 0.0 117.81 175.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -67.79 -25.89 65.82 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.191 2.182 . . . . 0.0 112.899 168.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 44.9 m -78.64 -41.34 31.68 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 103.792 -2.67 . . . . 0.0 103.792 -174.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 mt -68.84 -27.2 65.62 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 117.123 -3.486 . . . . 0.0 108.901 178.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -65.1 -46.22 81.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 124.334 3.243 . . . . 0.0 115.976 174.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.33 -4.28 50.15 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 108.678 -3.874 . . . . 0.0 114.85 174.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.23 156.39 81.42 Favored Pre-proline 0 N--CA 1.449 -0.479 0 CA-C-N 122.66 2.482 . . . . 0.0 114.512 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -59.99 129.88 32.25 Favored 'Trans proline' 0 N--CA 1.45 -1.045 1 C-N-CA 126.345 4.697 . . . . 0.0 110.353 164.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.253 2.7 m -72.29 -17.09 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 116.174 -1.869 . . . . 0.0 114.314 -171.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 13.8 pm0 -74.15 -21.86 59.68 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 125.445 1.715 . . . . 0.0 113.583 171.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.6 tp -70.32 -42.0 72.52 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 118.276 -1.37 . . . . 0.0 112.624 173.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -52.47 -51.64 58.32 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 128.113 2.565 . . . . 0.0 109.371 177.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -56.27 -41.93 76.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.056 -1.429 . . . . 0.0 112.385 172.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 17.1 t90 -70.59 -42.66 70.73 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 118.32 -2.738 . . . . 0.0 112.933 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . 0.417 HD22 ' HA ' ' B' ' 100' ' ' LEU . 17.4 mt -78.03 -25.42 47.86 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -168.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -49.6 -34.93 19.22 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.674 1.99 . . . . 0.0 113.296 158.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -100.4 -32.11 10.98 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 118.853 0.751 . . . . 0.0 112.643 -175.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 56.7 t -91.87 -8.91 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -177.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 40.4 mt -103.58 -43.39 5.39 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 120.293 -1.504 . . . . 0.0 114.302 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 57.5 mt -90.07 -24.7 21.08 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.848 -154.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.46 -11.79 60.58 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 113.574 -3.107 . . . . 0.0 111.356 168.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 51.2 m -76.08 5.58 6.52 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 123.533 2.879 . . . . 0.0 115.027 169.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 . . . . . 0 C--O 1.249 1.05 0 N-CA-C 121.58 3.919 . . . . 0.0 121.58 174.992 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 53.2 ttm . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 125.853 2.74 . . . . 0.0 108.229 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -53.87 139.8 32.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 -159.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -100.95 126.17 47.58 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 116.955 -3.59 . . . . 0.0 116.413 -158.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -130.24 122.27 27.74 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 129.574 3.15 . . . . 0.0 111.589 -168.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 80.7 p -151.5 146.2 18.66 Favored Pre-proline 0 N--CA 1.45 -0.429 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -171.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.45 -30.58 72.11 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 122.751 2.3 . . . . 0.0 112.987 175.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -139.49 156.56 46.85 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 117.797 -3.064 . . . . 0.0 111.316 171.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 10.7 t -148.11 132.19 17.28 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.23 -1.804 . . . . 0.0 110.674 171.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.26 -28.06 59.68 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.846 -1.549 . . . . 0.0 112.164 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.23 -38.86 88.92 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.437 1.926 . . . . 0.0 112.757 172.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 57.3 mtt -70.27 -40.07 74.56 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.158 0.983 . . . . 0.0 108.796 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.45 -24.1 60.18 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 119.998 3.333 . . . . 0.0 119.998 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -71.56 -45.79 61.27 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.131 0.972 . . . . 0.0 110.605 163.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -59.16 -32.68 70.11 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 123.888 1.804 . . . . 0.0 111.817 174.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -38.94 65.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 117.466 -3.271 . . . . 0.0 113.782 169.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -54.16 -43.15 70.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 118.44 2.755 . . . . 0.0 118.44 164.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -69.21 -39.12 78.78 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 116.102 -1.904 . . . . 0.0 112.444 172.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -60.39 -43.03 97.02 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.172 -1.871 . . . . 0.0 110.152 174.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . 0.466 ' CZ2' ' HD2' ' D' ' 48' ' ' ARG . 19.9 t-105 -69.3 -40.89 77.4 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 122.179 2.263 . . . . 0.0 111.661 176.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.62 -17.01 64.03 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 119.255 -2.153 . . . . 0.0 114.728 173.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -65.7 -34.68 78.76 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 118.552 2.797 . . . . 0.0 118.552 159.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -59.24 -43.72 92.38 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 121.762 2.074 . . . . 0.0 115.583 176.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 11.7 t -56.9 -53.59 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 O-C-N 124.41 1.069 . . . . 0.0 112.606 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -75.1 -30.93 61.04 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 126.894 2.621 . . . . 0.0 110.747 -171.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 43.3 tp -67.94 -36.09 79.52 Favored 'General case' 0 N--CA 1.453 -0.321 1 O-C-N 116.061 -4.149 . . . . 0.0 112.531 170.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . 0.284 53.4 tp -74.62 -28.57 60.94 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 130.573 3.549 . . . . 0.0 108.339 174.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -60.58 -34.33 74.03 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 124.858 3.481 . . . . 0.0 110.844 168.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -73.24 -36.88 66.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 125.787 2.708 . . . . 0.0 112.434 176.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.68 -24.4 58.78 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 112.852 -1.976 . . . . 0.0 113.331 -169.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -65.09 -21.42 66.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 119.442 -2.036 . . . . 0.0 111.797 171.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -71.78 -33.74 68.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 119.955 1.252 . . . . 0.0 113.065 -178.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -123.98 33.45 5.29 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 124.557 2.123 . . . . 0.0 115.379 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.34 0.5 OUTLIER 59.76 13.38 3.47 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 118.704 2.853 . . . . 0.0 118.704 178.01 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 18.0 mt -87.59 6.58 33.78 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 123.804 0.69 . . . . 0.0 110.399 -177.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -67.71 -32.17 72.63 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.081 0.952 . . . . 0.0 110.239 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 mt -80.18 -50.44 1.16 Allowed Pre-proline 0 N--CA 1.453 -0.298 0 O-C-N 117.346 -3.346 . . . . 0.0 111.627 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -50.23 -44.32 39.01 Favored 'Trans proline' 0 N--CA 1.446 -1.273 1 C-N-CA 126.6 4.867 . . . . 0.0 112.629 171.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 33.2 tp -63.72 -51.31 65.53 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 121.562 -0.711 . . . . 0.0 112.448 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 75.7 mt -49.05 -34.76 14.2 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 121.377 3.843 . . . . 0.0 121.377 160.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -71.22 -25.52 62.53 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 121.036 1.744 . . . . 0.0 114.704 167.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 33.3 tp -76.19 -55.5 5.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 21.1 mmt -68.86 -35.17 76.6 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 123.752 1.739 . . . . 0.0 114.696 -165.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 3.8 mp -113.33 130.53 56.25 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 119.411 -2.055 . . . . 0.0 107.113 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 49.8 p -54.83 155.9 7.42 Favored Pre-proline 0 N--CA 1.448 -0.538 0 O-C-N 128.551 3.657 . . . . 0.0 111.931 164.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . 0.305 2.1 Cg_endo -54.86 -26.92 50.68 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 124.347 3.365 . . . . 0.0 116.466 168.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -61.65 -57.06 13.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 124.321 1.013 . . . . 0.0 111.148 166.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -65.39 -27.44 68.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 -178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 69.8 mtm-85 -77.08 -47.3 20.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 123.133 1.444 . . . . 0.0 107.188 174.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -55.55 -36.72 67.1 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.586 -3.196 . . . . 0.0 113.61 171.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.16 -45.09 86.35 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 119.852 -1.78 . . . . 0.0 112.679 176.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 32.5 mt -65.12 -31.05 72.06 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 121.995 2.179 . . . . 0.0 111.918 175.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.71 -17.31 66.92 Favored Glycine 0 N--CA 1.444 -0.809 0 O-C-N 117.77 -3.081 . . . . 0.0 119.459 163.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 6.6 m -89.54 -43.53 10.74 Favored 'General case' 0 N--CA 1.45 -0.425 0 O-C-N 127.147 2.322 . . . . 0.0 109.069 178.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -67.44 -26.96 66.66 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 115.578 1.695 . . . . 0.0 115.578 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 4.6 t -62.75 -24.39 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 120.415 1.461 . . . . 0.0 111.066 168.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -97.81 -27.83 14.13 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 117.657 -3.152 . . . . 0.0 109.148 -175.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . 0.294 9.9 mt -49.23 -51.04 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 C-N-CA 127.045 2.138 . . . . 0.0 114.419 159.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 82.6 t -59.79 -64.12 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-N 113.482 -1.69 . . . . 0.0 109.839 170.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -43.87 -50.21 8.05 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 114.907 -2.473 . . . . 0.0 117.07 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -73.8 -19.24 60.81 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 112.798 -3.477 . . . . 0.0 115.712 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 16.4 mt -73.88 -36.15 64.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 128.333 2.653 . . . . 0.0 114.269 162.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 94.8 mt -73.02 -39.36 66.06 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.897 2.079 . . . . 0.0 111.318 169.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 38.0 ttm105 -70.31 -44.21 68.76 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 116.082 -1.913 . . . . 0.0 112.477 171.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.44 15.73 68.55 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 126.101 1.81 . . . . 0.0 116.425 171.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -85.26 42.45 0.95 Allowed 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 116.716 -3.814 . . . . 0.0 113.016 -177.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 46.6 mtt -125.36 143.69 50.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 117.509 2.411 . . . . 0.0 117.509 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 7.3 p -72.89 175.54 6.48 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 119.716 -1.865 . . . . 0.0 108.828 171.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -65.3 -34.9 79.44 Favored 'General case' 0 N--CA 1.45 -0.449 1 O-C-N 116.177 -4.077 . . . . 0.0 111.116 172.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 20.6 ttp-105 -55.98 -60.63 3.2 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 130.704 3.602 . . . . 0.0 110.525 172.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -60.25 -35.54 75.72 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 125.726 1.61 . . . . 0.0 115.291 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 48.5 mt -56.09 -51.84 66.46 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 125.705 1.878 . . . . 0.0 112.579 167.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -67.11 -33.12 74.78 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 118.132 -2.855 . . . . 0.0 113.356 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -95.61 14.34 23.26 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.973 -171.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -150.6 -40.06 0.13 Allowed 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 116.39 -3.944 . . . . 0.0 111.688 -165.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mp -84.29 -33.23 24.02 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.909 -1.12 . . . . 0.0 113.105 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 52.97 -159.29 3.54 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 115.34 -2.922 . . . . 0.0 117.832 -173.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.57 -18.61 62.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 120.483 3.512 . . . . 0.0 120.483 -174.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.7 -20.84 62.25 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 129.542 3.448 . . . . 0.0 114.039 172.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 19.3 tt -46.73 -29.88 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 126.656 2.033 . . . . 0.0 116.4 171.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -85.24 -8.47 58.53 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.563 3.145 . . . . 0.0 108.339 -173.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 70.0 m -76.46 -43.64 39.08 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.564 -3.21 . . . . 0.0 112.469 172.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 31.4 mm -81.99 -39.61 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 112.508 -2.133 . . . . 0.0 115.11 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . 0.292 13.9 p -95.72 -11.8 26.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 120.774 3.62 . . . . 0.0 120.774 -175.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -114.09 146.26 40.49 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 117.526 -3.234 . . . . 0.0 109.988 175.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 99.48 -175.91 28.42 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 129.724 3.535 . . . . 0.0 117.276 169.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 3.6 m -68.78 -21.21 64.36 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 126.57 1.948 . . . . 0.0 116.243 -168.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -101.81 -3.0 28.76 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 25.5 p -67.39 162.19 23.54 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 124.04 1.876 . . . . 0.0 112.167 -163.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 7.8 tp -52.82 -39.38 62.38 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 120.365 3.468 . . . . 0.0 120.365 -164.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.353 90.5 mttt -69.97 -28.9 65.92 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 118.693 -2.505 . . . . 0.0 116.551 168.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.49 -24.94 17.08 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -166.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.23 163.2 19.12 Favored Pre-proline 0 N--CA 1.447 -0.594 0 C-N-CA 128.148 2.579 . . . . 0.0 113.44 -159.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.62 134.46 46.73 Favored 'Trans proline' 0 N--CA 1.445 -1.377 0 CA-C-N 126.066 3.202 . . . . 0.0 112.069 176.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 18.1 t -53.17 -37.9 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 130.495 3.518 . . . . 0.0 109.384 -177.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pm0 -79.01 -14.09 59.4 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 128.809 2.844 . . . . 0.0 113.353 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 37.2 tp -86.99 -47.51 8.89 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 118.971 -2.33 . . . . 0.0 111.76 166.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 34.4 mtp-105 -56.93 -43.41 81.46 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 113.03 -1.896 . . . . 0.0 114.2 171.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . 0.28 90.4 mt-30 -59.1 -26.56 64.77 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 117.135 -3.478 . . . . 0.0 117.543 168.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -86.17 -47.89 9.07 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 116.3 -4.0 . . . . 0.0 110.936 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 32.4 mt -53.07 -31.93 44.32 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 116.818 -3.676 . . . . 0.0 114.235 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -75.64 -31.25 59.75 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 122.47 2.396 . . . . 0.0 112.349 172.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -75.42 -22.18 57.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 125.178 2.418 . . . . 0.0 115.165 178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 39.2 t -98.34 -49.95 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 O-C-N 117.295 -3.378 . . . . 0.0 114.927 172.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 60.6 mt -82.42 -19.29 39.32 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 116.075 -1.917 . . . . 0.0 113.97 -171.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 88.0 mt -127.97 18.32 6.65 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 125.639 1.837 . . . . 0.0 109.456 -174.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -47.23 155.4 0.31 Allowed 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 119.712 3.227 . . . . 0.0 119.712 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 15.0 m -109.46 22.91 15.17 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 119.661 1.118 . . . . 0.0 111.1 161.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 3.3 t0 . . . . . 0 C--O 1.248 1.003 0 O-C-N 117.192 -3.442 . . . . 0.0 109.84 174.389 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ttt . . . . . 0 N--CA 1.47 0.538 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -132.23 146.07 51.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 118.397 0.544 . . . . 0.0 112.158 -173.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -100.97 148.27 25.21 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.518 1.527 . . . . 0.0 110.191 170.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 41.7 tt0 -109.28 156.44 19.94 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.088 -177.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 54.0 p -148.12 168.91 10.14 Favored Pre-proline 0 N--CA 1.453 -0.283 0 CA-C-O 115.213 -2.327 . . . . 0.0 113.602 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -82.07 -37.74 0.23 Allowed 'Trans proline' 0 N--CA 1.448 -1.185 0 C-N-CA 124.326 3.351 . . . . 0.0 114.42 -177.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -143.68 139.37 29.51 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 114.656 -2.592 . . . . 0.0 114.192 -172.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 14.5 t -59.24 123.95 18.38 Favored 'General case' 0 N--CA 1.451 -0.396 1 CA-C-N 126.513 4.233 . . . . 0.0 114.359 171.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.32 -28.85 69.6 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 128.313 2.645 . . . . 0.0 109.749 173.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.8 -50.33 51.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 130.889 3.676 . . . . 0.0 105.587 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 11.1 mmt -61.45 -37.4 83.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.7 -42.43 83.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 117.999 -1.0 . . . . 0.0 113.468 174.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -65.24 -62.47 1.52 Allowed 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 168.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -44.71 -30.83 1.01 Allowed 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 120.511 1.505 . . . . 0.0 114.841 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.385 0.0 OUTLIER -83.72 -14.74 50.93 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 118.789 -2.444 . . . . 0.0 116.569 -174.401 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -82.76 -32.8 27.63 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 127.249 2.22 . . . . 0.0 111.869 157.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -74.82 -40.46 61.07 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 126.044 2.09 . . . . 0.0 111.023 -175.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -69.9 -6.99 36.65 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 125.92 2.013 . . . . 0.0 115.678 169.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -85.27 -52.7 5.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 128.735 2.814 . . . . 0.0 110.715 170.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 65.6 mt -57.07 -18.5 14.65 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 118.996 2.962 . . . . 0.0 118.996 168.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 59.5 ttt180 -66.94 -31.2 71.63 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 127.531 2.332 . . . . 0.0 109.197 169.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -87.59 -30.03 20.8 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 126.715 2.51 . . . . 0.0 108.89 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 81.5 t -65.78 -33.72 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 118.144 -2.848 . . . . 0.0 110.948 169.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -73.16 -46.07 52.95 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 127.918 2.487 . . . . 0.0 112.343 169.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 15.5 tp -56.74 -40.77 76.35 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 120.653 1.57 . . . . 0.0 113.626 175.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 tp -77.95 -39.54 42.29 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 115.744 -2.074 . . . . 0.0 114.849 175.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp -53.12 -57.24 11.12 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 122.362 2.346 . . . . 0.0 117.249 165.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -57.95 -32.81 68.19 Favored 'General case' 0 N--CA 1.446 -0.634 1 O-C-N 129.913 4.508 . . . . 0.0 111.456 173.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.48 -23.8 50.3 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 121.285 1.857 . . . . 0.0 113.525 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -64.34 -34.15 77.49 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 124.08 3.127 . . . . 0.0 110.72 162.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -89.23 3.5 51.79 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 129.677 3.191 . . . . 0.0 114.279 -173.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 57.3 p30 -135.28 13.68 3.53 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 119.331 0.968 . . . . 0.0 112.945 155.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.262 0.6 OUTLIER 54.24 38.6 29.62 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 117.114 -1.422 . . . . 0.0 111.471 -178.704 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 92.6 mt -86.0 13.68 7.27 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.404 2.366 . . . . 0.0 116.778 155.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.21 -47.7 55.86 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 125.395 1.478 . . . . 0.0 112.086 -164.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 3.6 mt -64.14 -52.32 56.12 Favored Pre-proline 0 N--CA 1.448 -0.53 0 CA-C-O 114.733 -2.556 . . . . 0.0 111.283 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.61 -34.21 14.74 Favored 'Trans proline' 0 N--CA 1.447 -1.233 0 C-N-CA 124.487 3.458 . . . . 0.0 116.642 166.247 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 51.9 tp -85.8 -34.04 21.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.863 2.172 . . . . 0.0 116.863 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 19.9 mt -71.34 -34.31 70.41 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 126.436 3.017 . . . . 0.0 111.676 169.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 19.5 m-20 -72.68 -35.31 67.64 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 117.626 -3.171 . . . . 0.0 111.913 174.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 14.6 tp -68.2 -38.72 82.27 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 123.746 1.736 . . . . 0.0 109.584 169.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.2 mmt -79.03 -38.15 37.26 Favored 'General case' 0 N--CA 1.452 -0.371 1 O-C-N 116.171 -4.081 . . . . 0.0 115.198 -176.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 17.2 mt -109.94 140.22 44.17 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.251 1.42 . . . . 0.0 112.839 -179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 64.0 p -68.51 168.12 15.73 Favored Pre-proline 0 N--CA 1.453 -0.282 0 C-N-CA 128.1 2.56 . . . . 0.0 112.451 167.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -57.8 -42.24 61.33 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.552 3.501 . . . . 0.0 115.831 177.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -81.99 -18.27 43.98 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 126.2 2.187 . . . . 0.0 114.791 -175.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -71.12 -44.21 66.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 170.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . 0.466 ' HD2' ' CZ2' ' C' ' 19' ' ' TRP . 41.1 mtm-85 -68.36 -40.42 81.47 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 171.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.06 -38.28 79.04 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 116.377 1.991 . . . . 0.0 116.377 167.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.329 . . -61.51 -43.23 99.24 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.956 -1.715 . . . . 0.0 113.135 168.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.27 -45.77 92.15 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.773 -1.829 . . . . 0.0 115.282 175.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.26 -40.12 91.28 Favored Glycine 0 CA--C 1.525 0.658 0 O-C-N 126.762 2.539 . . . . 0.0 114.279 169.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 8.1 m -61.7 -43.53 98.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.286 1.835 . . . . 0.0 114.661 166.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.274 96.7 mtt180 -59.69 -41.98 91.93 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 175.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 9.1 t -41.28 -59.87 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 O-C-N 120.316 -1.49 . . . . 0.0 113.851 164.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -72.32 -24.11 61.26 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 55.9 mt -71.0 -46.22 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 C-N-CA 127.338 2.255 . . . . 0.0 107.545 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . 0.322 18.7 t -62.68 -39.19 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 174.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -66.91 -52.1 47.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 119.666 -1.896 . . . . 0.0 111.57 170.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -62.38 -31.18 71.8 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 33.1 mt -61.28 -40.45 94.18 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 118.126 2.639 . . . . 0.0 118.126 167.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 42.1 mt -69.84 -34.47 73.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 116.953 -3.592 . . . . 0.0 111.241 167.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -64.96 -47.56 77.18 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 117.351 -3.343 . . . . 0.0 114.945 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 44.93 62.57 2.93 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-O 124.512 2.173 . . . . 0.0 116.884 -174.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -124.63 -35.37 2.74 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.0 -3.059 . . . . 0.0 112.888 170.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 28.6 mtt -75.97 58.75 1.21 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 124.284 3.22 . . . . 0.0 106.797 155.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 88.5 p -82.3 168.1 17.92 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 119.542 -1.974 . . . . 0.0 113.785 -175.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.298 8.0 tp60 69.54 -53.62 0.6 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 120.842 3.645 . . . . 0.0 120.842 167.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . 0.285 74.1 ttt180 -120.92 -33.12 3.82 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.396 2.279 . . . . 0.0 112.567 171.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.77 -26.73 40.58 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 122.675 2.489 . . . . 0.0 112.557 -167.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mt -63.23 -52.78 60.82 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.949 0.9 . . . . 0.0 111.39 174.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -68.19 -26.55 65.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 116.604 -3.81 . . . . 0.0 115.156 173.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -109.86 -26.1 9.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 124.977 3.535 . . . . 0.0 118.502 -173.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -104.52 -44.9 4.78 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 116.422 -1.751 . . . . 0.0 115.599 176.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.77 -41.09 88.27 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 124.29 0.994 . . . . 0.0 110.666 158.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 93.6 -171.05 31.56 Favored Glycine 0 C--N 1.337 0.597 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 155.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -40.13 -32.39 0.17 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 129.281 3.032 . . . . 0.0 117.357 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.73 -23.13 49.29 Favored Glycine 0 C--N 1.338 0.676 0 CA-C-O 116.52 -2.267 . . . . 0.0 118.334 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 6.5 tt -50.01 -16.25 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 131.163 3.785 . . . . 0.0 117.611 170.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . 0.276 . . -84.75 -42.46 15.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 116.546 -3.846 . . . . 0.0 114.052 174.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 96.8 m -59.17 -27.55 65.78 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 125.348 2.499 . . . . 0.0 111.754 171.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 39.0 mm -100.12 -25.32 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 O-C-N 120.204 -1.56 . . . . 0.0 112.262 -170.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 44.9 p -109.54 5.19 22.94 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 173.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 41.4 mtp85 -125.05 159.96 30.13 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.664 0.745 . . . . 0.0 109.844 172.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 87.98 151.66 22.58 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-O 125.247 2.582 . . . . 0.0 113.236 -170.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 35.7 p -84.68 2.47 41.63 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 109.58 -3.31 . . . . 0.0 116.971 -153.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -123.41 29.5 6.62 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.268 1.027 . . . . 0.0 112.888 159.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 2.1 p -63.16 173.86 1.34 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 117.198 -1.801 . . . . 0.0 114.571 169.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.6 -21.82 54.39 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 119.846 3.276 . . . . 0.0 119.846 163.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -78.49 -12.41 60.01 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 122.78 1.276 . . . . 0.0 113.328 169.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -123.75 1.07 8.76 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 113.331 -1.759 . . . . 0.0 112.536 -169.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . 0.435 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 39.55 95.86 0.04 OUTLIER Pre-proline 0 N--CA 1.451 -0.392 0 C-N-CA 127.727 2.411 . . . . 0.0 108.76 144.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . 0.435 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 84.9 Cg_exo 32.15 35.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.257 0 N-CA-C 119.587 2.88 . . . . 0.0 119.587 32.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 39.8 t -60.32 -25.9 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-O 117.263 -1.351 . . . . 0.0 107.665 -176.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -84.9 -25.21 28.08 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 126.252 2.22 . . . . 0.0 110.886 -171.94 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 29.4 tp -72.42 -35.75 68.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 124.038 0.836 . . . . 0.0 113.092 162.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -62.61 -53.15 58.93 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 123.205 1.478 . . . . 0.0 113.789 176.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -51.88 -39.94 59.83 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 118.776 -2.453 . . . . 0.0 111.031 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -73.4 -33.39 64.97 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 120.44 -1.412 . . . . 0.0 108.298 -166.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 61.2 mt -81.11 -31.98 34.05 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -174.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.19 -31.12 72.18 Favored 'General case' 0 N--CA 1.447 -0.577 1 CA-C-O 111.471 -4.109 . . . . 0.0 109.828 175.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -89.76 -36.71 15.0 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 126.727 2.517 . . . . 0.0 111.12 -177.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.377 41.8 t -78.8 -36.0 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 C-N-CA 128.508 2.723 . . . . 0.0 113.509 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 60.5 mt -96.15 -39.09 9.87 Favored 'General case' 0 N--CA 1.447 -0.61 1 CA-C-O 111.285 -4.198 . . . . 0.0 108.109 -175.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 17.6 mt -90.93 14.74 12.96 Favored 'General case' 0 N--CA 1.452 -0.347 1 CA-C-N 127.333 4.606 . . . . 0.0 113.453 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -44.46 156.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 162.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -7.76 52.48 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 127.917 3.722 . . . . 0.0 117.148 -160.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 129.555 3.142 . . . . 0.0 109.434 -179.772 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 118.317 -0.849 . . . . 0.0 109.139 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -58.73 -60.65 3.49 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 116.333 -1.794 . . . . 0.0 114.051 -168.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -76.21 -11.83 59.99 Favored 'General case' 0 N--CA 1.451 -0.414 1 CA-C-N 126.722 4.328 . . . . 0.0 112.492 -174.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -82.43 -37.75 25.0 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 169.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 96.6 p -61.82 146.04 91.49 Favored Pre-proline 0 N--CA 1.45 -0.457 0 CA-C-O 113.813 -2.994 . . . . 0.0 115.224 172.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -80.68 -0.62 10.75 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 N-CA-C 119.704 2.925 . . . . 0.0 119.704 -170.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -144.17 143.07 30.92 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 129.616 3.166 . . . . 0.0 110.819 -171.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.9 t -113.76 120.0 39.29 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 113.419 -1.719 . . . . 0.0 114.426 162.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.63 -28.13 40.91 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 119.472 -2.017 . . . . 0.0 113.607 167.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.7 -53.56 45.85 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 116.856 -3.653 . . . . 0.0 114.108 166.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.6 ttp -61.97 -40.85 97.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.789 1.236 . . . . 0.0 111.216 -178.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.58 -54.44 45.9 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -51.15 -44.04 61.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.229 2.611 . . . . 0.0 114.054 166.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -66.7 -41.02 88.7 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 113.317 -3.23 . . . . 0.0 111.951 173.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -67.47 -23.27 65.48 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 122.756 2.525 . . . . 0.0 112.647 168.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 25.1 t60 -71.82 -44.38 64.0 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 119.06 2.985 . . . . 0.0 119.06 177.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -56.15 -26.64 51.16 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 166.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -70.85 -36.9 73.07 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 123.308 2.776 . . . . 0.0 111.302 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -58.92 -42.6 90.09 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 125.944 1.698 . . . . 0.0 114.845 166.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.8 mt -70.3 -8.69 52.34 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 -71.45 -36.74 71.35 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.784 1.633 . . . . 0.0 107.996 177.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.66 -51.24 58.39 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.977 1.711 . . . . 0.0 111.886 174.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 t -57.39 -41.07 77.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 117.952 2.575 . . . . 0.0 117.952 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -61.19 -50.45 73.1 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 118.29 2.7 . . . . 0.0 118.29 161.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.9 tp -58.28 -36.55 73.45 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.115 -1.857 . . . . 0.0 109.589 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 54.2 tp -72.98 -43.93 61.66 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 116.345 -1.788 . . . . 0.0 108.846 -177.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -44.62 -60.8 1.82 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.854 1.262 . . . . 0.0 109.42 167.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -71.32 -19.2 62.34 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -171.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.54 -33.06 62.66 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 117.708 -3.12 . . . . 0.0 111.861 173.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -63.43 -26.07 68.56 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 116.762 -1.59 . . . . 0.0 112.823 170.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -91.38 12.95 18.87 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.128 1.786 . . . . 0.0 111.48 -176.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -137.9 3.16 2.44 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 130.14 3.376 . . . . 0.0 112.695 173.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 61.77 32.12 18.29 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 120.564 -1.335 . . . . 0.0 111.765 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.274 28.6 mt -105.54 -0.78 25.51 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 126.045 1.738 . . . . 0.0 114.306 172.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -58.35 -42.01 85.92 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 114.941 -2.457 . . . . 0.0 116.212 -176.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.292 6.5 mt -66.54 -47.89 56.45 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-N 123.281 2.764 . . . . 0.0 111.618 172.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -49.2 -46.63 25.05 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 122.496 2.13 . . . . 0.0 115.616 163.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . 0.265 26.4 tp -68.63 -41.23 79.74 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.986 1.374 . . . . 0.0 110.741 -177.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.8 mt -74.8 -14.36 60.68 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 117.975 -2.953 . . . . 0.0 116.862 175.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . 0.351 3.9 m-80 -72.44 -23.99 61.15 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 117.503 -3.248 . . . . 0.0 112.727 163.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.0 tt -85.7 -52.49 5.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 128.863 2.865 . . . . 0.0 112.808 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.323 83.4 mmm -68.42 -42.84 78.37 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 109.891 -3.322 . . . . 0.0 112.46 -168.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.9 mt -110.4 142.51 42.01 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.939 1.296 . . . . 0.0 109.406 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 p -84.75 151.64 58.48 Favored Pre-proline 0 N--CA 1.447 -0.579 0 C-N-CA 127.888 2.475 . . . . 0.0 113.787 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -58.34 -40.71 73.07 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 CA-C-N 126.351 3.304 . . . . 0.0 116.756 -157.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -65.34 -16.31 63.46 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 116.901 -3.624 . . . . 0.0 113.483 172.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -87.64 -28.66 21.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 119.796 1.18 . . . . 0.0 112.711 169.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 38.0 mtm-85 -75.18 -44.93 43.83 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 124.523 1.139 . . . . 0.0 108.225 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.72 -38.48 69.79 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 116.341 1.978 . . . . 0.0 116.341 167.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.64 -37.95 62.63 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.465 HD21 ' CE2' ' B' ' 22' ' ' PHE . 73.5 mt -62.3 -32.98 73.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 114.796 -2.526 . . . . 0.0 115.058 166.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.72 -32.0 68.74 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 123.065 2.666 . . . . 0.0 109.614 168.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.1 m -89.62 -28.42 19.53 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 115.578 -2.449 . . . . 0.0 110.149 -164.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -62.48 -21.23 65.31 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 126.152 2.158 . . . . 0.0 111.244 174.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.81 -49.39 82.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 115.178 -2.344 . . . . 0.0 109.76 169.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -68.33 -24.66 64.86 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 126.272 2.233 . . . . 0.0 116.711 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 55.8 mt -73.26 -47.57 46.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 116.539 -1.696 . . . . 0.0 109.267 168.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 17.1 t -65.12 -20.52 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 122.784 2.538 . . . . 0.0 110.958 171.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -74.73 -49.84 19.62 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 117.982 -2.949 . . . . 0.0 109.64 167.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -79.39 -25.67 42.08 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 120.375 1.443 . . . . 0.0 111.168 -169.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.31 -43.1 98.78 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.081 1.352 . . . . 0.0 111.266 161.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 51.7 tp -76.29 -38.69 55.78 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 123.083 2.674 . . . . 0.0 109.037 -172.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.1 ttm105 -60.34 -31.68 70.54 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 117.254 2.316 . . . . 0.0 117.254 165.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.27 2.36 4.03 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 120.877 3.111 . . . . 0.0 120.877 177.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -85.48 -47.78 9.59 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 129.927 3.291 . . . . 0.0 110.695 -166.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 36.3 ttm -73.65 142.29 46.47 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 126.509 2.38 . . . . 0.0 110.484 167.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.2 p -102.27 170.1 8.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 119.581 3.178 . . . . 0.0 119.581 175.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -58.12 -38.14 75.94 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 113.707 1.002 . . . . 0.0 113.707 -174.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -63.48 -39.84 95.51 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 116.879 2.177 . . . . 0.0 116.879 175.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -70.73 -35.14 72.55 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 127.495 2.318 . . . . 0.0 113.493 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . 0.285 56.0 mt -63.15 -40.94 99.04 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 123.284 1.516 . . . . 0.0 111.795 175.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -63.5 -17.72 63.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 114.049 -2.881 . . . . 0.0 111.251 -175.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -89.63 -64.34 1.15 Allowed 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 120.54 1.518 . . . . 0.0 109.5 158.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -65.98 -21.0 66.38 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 118.472 2.768 . . . . 0.0 118.472 -159.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.5 mt -130.49 7.33 4.89 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.875 1.27 . . . . 0.0 110.77 168.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.33 31.73 80.32 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-O 114.852 -3.193 . . . . 0.0 113.132 173.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -94.21 118.48 31.64 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.084 2.554 . . . . 0.0 110.18 -168.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.09 125.78 38.48 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 128.655 3.026 . . . . 0.0 108.477 172.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 92.3 mt -54.84 -47.08 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 120.3 2.05 . . . . 0.0 112.055 -163.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -50.73 -41.0 55.9 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 122.197 2.271 . . . . 0.0 114.564 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 19.1 p -69.83 -25.89 63.97 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 127.61 2.364 . . . . 0.0 113.719 -174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 25.7 mm -76.5 -40.16 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 165.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.6 m -62.66 -31.36 72.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.695 -2.503 . . . . 0.0 109.21 -173.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -78.81 -40.05 33.97 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 124.878 2.275 . . . . 0.0 111.962 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.61 -26.14 72.87 Favored Glycine 0 N--CA 1.449 -0.491 0 O-C-N 119.653 -1.904 . . . . 0.0 114.393 175.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.5 m -64.45 -48.33 75.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.496 2.318 . . . . 0.0 112.807 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.401 ' HA ' ' HB2' ' A' ' 90' ' ' LYS . 75.2 m-20 -75.49 -21.08 58.35 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 114.711 -2.796 . . . . 0.0 114.514 173.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.3 m -73.69 -28.93 61.99 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 117.601 -3.187 . . . . 0.0 114.571 168.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.3 tp -77.52 -27.38 51.72 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 117.631 -3.168 . . . . 0.0 109.138 172.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 41.3 mttm -69.05 -20.43 64.11 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 112.138 -3.792 . . . . 0.0 108.398 166.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -99.37 -26.9 13.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 125.579 3.809 . . . . 0.0 119.27 177.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.27 140.81 97.75 Favored Pre-proline 0 N--CA 1.449 -0.481 0 O-C-N 125.685 1.866 . . . . 0.0 108.56 168.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -83.83 158.42 13.89 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 121.537 1.491 . . . . 0.0 111.974 -165.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.6 m -61.11 -35.08 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 114.572 -2.632 . . . . 0.0 112.887 178.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.446 24.2 pm0 -53.05 -33.7 53.12 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 122.409 2.368 . . . . 0.0 116.378 163.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 15.6 tp -81.69 -51.12 8.52 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.908 -2.995 . . . . 0.0 108.453 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.3 mtm180 -60.35 -49.67 76.67 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.385 1.564 . . . . 0.0 112.933 -173.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.03 -17.8 64.93 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 126.288 2.947 . . . . 0.0 114.05 -177.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -91.44 -27.64 18.16 Favored 'General case' 0 N--CA 1.447 -0.602 1 O-C-N 114.885 -4.884 . . . . 0.0 110.366 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.5 mt -68.65 -18.01 64.21 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 118.11 2.633 . . . . 0.0 118.11 161.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -67.06 -28.04 67.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 120.36 1.437 . . . . 0.0 111.676 176.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -82.82 -4.51 58.13 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 118.757 -1.177 . . . . 0.0 113.99 -176.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 42.5 t -114.0 -47.71 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 124.443 1.097 . . . . 0.0 113.25 -173.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.5 mt -97.42 -23.67 15.97 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.319 1.048 . . . . 0.0 111.611 -172.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 14.5 mt -112.59 -25.57 9.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.1 tttp -65.12 -24.79 67.52 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 122.245 2.293 . . . . 0.0 114.435 -165.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 71.2 p -110.31 6.76 22.69 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 119.893 3.294 . . . . 0.0 119.893 -160.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 . . . . . 0 C--O 1.253 1.252 0 CA-C-N 112.341 -2.209 . . . . 0.0 114.354 -167.937 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 116.914 -1.517 . . . . 0.0 113.031 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.04 -25.86 68.3 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 122.501 2.41 . . . . 0.0 112.604 -162.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -84.1 -29.47 26.76 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.051 0.841 . . . . 0.0 111.188 -172.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -78.68 -31.75 46.77 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 116.064 1.875 . . . . 0.0 116.064 170.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 19.8 m -81.59 143.57 51.27 Favored Pre-proline 0 N--CA 1.449 -0.513 0 C-N-CA 125.967 1.707 . . . . 0.0 112.06 -170.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -62.3 -32.81 81.82 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.711 2.274 . . . . 0.0 112.353 172.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -134.33 151.73 51.4 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 125.923 2.773 . . . . 0.0 118.174 173.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 20.4 t -143.1 121.47 12.34 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 118.34 -2.725 . . . . 0.0 109.054 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.77 -14.15 60.67 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.052 -1.655 . . . . 0.0 110.445 174.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.8 -36.36 25.67 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 116.767 2.136 . . . . 0.0 116.767 176.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 27.4 mtt -67.99 -36.1 79.43 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 122.228 2.285 . . . . 0.0 114.216 165.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.08 -49.37 60.8 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 118.216 2.673 . . . . 0.0 118.216 167.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 tp10 -57.48 -42.18 82.13 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 112.719 -2.037 . . . . 0.0 113.968 168.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -63.39 -42.49 98.8 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 112.657 -3.544 . . . . 0.0 112.028 176.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -69.88 -34.76 73.99 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.673 2.483 . . . . 0.0 114.405 174.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -60.61 -36.61 79.0 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.039 1.745 . . . . 0.0 110.998 170.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -83.85 -31.16 25.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 126.2 1.8 . . . . 0.0 109.635 -174.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -72.92 -34.22 66.46 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 115.491 -2.195 . . . . 0.0 107.902 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -67.34 -25.81 66.18 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 122.329 2.331 . . . . 0.0 112.975 167.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 49.7 mt -65.18 -23.04 66.99 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 123.212 2.733 . . . . 0.0 115.095 176.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -72.49 -20.86 61.3 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.119 1.767 . . . . 0.0 113.208 174.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . 0.465 ' CE2' HD21 ' A' ' 51' ' ' LEU . 84.7 t80 -71.61 -47.87 51.76 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 117.571 -1.205 . . . . 0.0 112.11 168.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 33.8 t -61.96 -41.57 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 C-N-CA 126.439 1.896 . . . . 0.0 113.908 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -68.28 -45.18 73.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 173.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 37.2 tp -61.88 -42.28 98.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 -174.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 25.9 tp -76.21 -31.4 58.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.749 2.02 . . . . 0.0 108.628 -177.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -50.41 -42.72 54.22 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 123.406 2.821 . . . . 0.0 112.767 168.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -89.38 -9.42 50.4 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 127.452 2.97 . . . . 0.0 115.102 -177.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.59 -42.85 21.54 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.826 2.05 . . . . 0.0 110.261 178.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -63.36 -34.94 78.8 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 118.041 -2.912 . . . . 0.0 107.262 170.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -75.77 4.36 8.09 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 118.846 -2.409 . . . . 0.0 116.305 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -128.91 -1.03 5.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 113.889 -1.505 . . . . 0.0 110.235 168.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.417 46.5 m-20 64.7 23.04 12.71 Favored 'General case' 0 N--CA 1.447 -0.582 2 O-C-N 115.117 -4.739 . . . . 0.0 116.749 -168.33 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.278 83.4 mt -99.02 5.48 47.08 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.063 1.745 . . . . 0.0 111.793 174.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 14.3 p-80 -58.14 -54.31 48.36 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.797 1.239 . . . . 0.0 113.435 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 28.0 mt -62.88 -47.82 86.29 Favored Pre-proline 0 N--CA 1.448 -0.526 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.67 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -60.02 -24.03 75.17 Favored 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 124.497 3.465 . . . . 0.0 116.057 171.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . 0.329 43.2 tp -76.03 -52.07 10.97 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 125.594 1.809 . . . . 0.0 114.779 169.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . 0.307 17.3 mt -53.28 -49.69 66.42 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 124.925 1.391 . . . . 0.0 110.833 174.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -64.64 -17.77 64.34 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 119.898 -1.751 . . . . 0.0 112.831 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 12.0 tp -93.67 -30.28 15.0 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 9.0 mmt -84.05 -26.13 29.31 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 5.0 mt -126.75 134.38 50.65 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 126.288 1.835 . . . . 0.0 111.688 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 81.5 p -85.17 160.3 54.99 Favored Pre-proline 0 N--CA 1.45 -0.434 0 C-N-CA 126.006 1.723 . . . . 0.0 107.758 176.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -52.11 -30.66 41.78 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 N-CA-C 121.111 3.466 . . . . 0.0 121.111 -172.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.62 -32.66 64.17 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 124.579 1.174 . . . . 0.0 110.788 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.33 -32.7 62.92 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.567 1.947 . . . . 0.0 109.339 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 -70.6 -45.04 66.03 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 127.663 2.385 . . . . 0.0 110.102 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -63.98 -38.36 90.79 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.6 1.56 . . . . 0.0 114.014 168.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.31 -53.56 56.9 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 120.632 1.56 . . . . 0.0 112.879 167.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 27.4 mt -52.22 -38.87 59.24 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 114.631 -2.604 . . . . 0.0 117.33 175.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.75 -56.65 24.11 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 127.679 2.561 . . . . 0.0 111.768 166.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 13.6 m -74.67 -22.82 58.68 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 124.419 2.057 . . . . 0.0 113.927 -169.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 58.8 mtt180 -58.38 -37.14 74.64 Favored 'General case' 0 N--CA 1.449 -0.486 1 O-C-N 114.887 -4.883 . . . . 0.0 113.352 169.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 97.9 t -68.91 -36.81 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 124.057 0.943 . . . . 0.0 109.757 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -75.72 -33.3 60.29 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.038 -1.039 . . . . 0.0 110.304 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 54.0 mt -69.62 -47.14 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 120.401 1.455 . . . . 0.0 110.611 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.258 59.5 t -74.86 -21.01 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 O-C-N 124.479 1.112 . . . . 0.0 113.527 177.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -72.44 -38.53 68.29 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 119.286 -2.134 . . . . 0.0 113.01 175.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -61.71 -30.62 70.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.562 1.145 . . . . 0.0 109.127 171.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 1.1 mt -78.49 -26.19 45.93 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 117.893 -3.004 . . . . 0.0 111.153 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 89.4 mt -83.93 -19.92 33.86 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 119.606 3.188 . . . . 0.0 119.606 166.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 23.5 ttm105 -89.53 -71.75 0.59 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 115.976 -1.964 . . . . 0.0 111.022 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.59 75.11 1.22 Allowed Glycine 0 C--N 1.335 0.478 0 C-N-CA 125.928 1.728 . . . . 0.0 109.68 -171.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -140.5 9.62 2.24 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 121.04 2.42 . . . . 0.0 112.338 173.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 22.1 mtt -119.02 143.77 46.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 116.368 -3.957 . . . . 0.0 114.266 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 26.7 p -77.61 162.25 27.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 130.71 3.604 . . . . 0.0 112.739 164.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . 0.258 45.4 mt-30 -67.08 -33.5 75.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 -171.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -58.86 -45.31 90.45 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 160.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -59.71 -36.9 77.46 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 121.075 1.761 . . . . 0.0 112.53 171.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 90.9 mt -63.49 -33.04 74.7 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.458 175.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -84.72 -31.5 24.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.91 2.084 . . . . 0.0 112.956 -177.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -130.54 -19.69 3.01 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 117.61 -3.181 . . . . 0.0 114.422 -167.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -87.17 -13.37 44.2 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 160.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 96.6 mt -132.56 -43.74 0.91 Allowed 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.671 -3.143 . . . . 0.0 114.848 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 98.69 4.04 57.09 Favored Glycine 0 CA--C 1.522 0.476 0 CA-C-O 124.136 1.964 . . . . 0.0 110.257 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.72 80.02 6.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 117.218 -3.519 . . . . 0.0 113.066 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.42 -179.33 5.22 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-O 126.593 3.33 . . . . 0.0 110.97 159.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 45.5 mt -61.68 -40.5 86.98 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 O-C-N 117.354 -3.439 . . . . 0.0 112.407 -168.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.26 87.77 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 120.667 -1.271 . . . . 0.0 114.208 171.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 21.6 m -66.43 -34.83 78.83 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.927 1.291 . . . . 0.0 114.121 -178.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mm -81.36 -41.01 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 115.278 -2.296 . . . . 0.0 106.731 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 4.7 m -64.25 -47.54 79.24 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 131.256 3.823 . . . . 0.0 113.055 174.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 19.4 ttt180 -57.59 -51.09 70.89 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 117.237 -1.785 . . . . 0.0 114.691 167.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -45.63 -44.87 12.33 Favored Glycine 0 C--N 1.334 0.471 0 CA-C-O 115.508 -2.829 . . . . 0.0 114.94 173.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 4.3 p -77.86 -36.93 49.3 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 126.542 1.966 . . . . 0.0 112.37 -176.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -62.63 -37.57 86.83 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 106.552 -1.648 . . . . 0.0 106.552 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 68.5 m -67.31 -29.03 68.5 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 126.934 3.254 . . . . 0.0 114.712 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 70.6 mt -77.7 -38.44 47.38 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 117.706 -3.121 . . . . 0.0 116.377 173.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 52.6 tttm -64.48 -41.76 96.28 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.309 1.444 . . . . 0.0 108.801 168.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.15 -23.08 62.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 118.591 -2.568 . . . . 0.0 113.474 177.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.41 147.56 98.56 Favored Pre-proline 0 N--CA 1.448 -0.575 0 CA-C-N 121.6 2.0 . . . . 0.0 113.474 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -72.03 162.11 42.79 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 123.989 3.126 . . . . 0.0 113.315 167.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 28.0 m -82.86 -16.31 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 1 O-C-N 115.586 -4.446 . . . . 0.0 117.274 -170.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -65.24 -8.15 16.28 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.779 1.632 . . . . 0.0 114.23 163.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 31.7 tp -112.66 -52.14 2.8 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 104.457 -2.423 . . . . 0.0 104.457 -177.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . 0.275 17.8 mtp180 -58.16 -37.29 74.41 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 124.437 1.086 . . . . 0.0 112.42 -175.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -79.41 -33.91 42.24 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 127.281 2.233 . . . . 0.0 112.822 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 81.3 t90 -71.59 -39.39 70.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 121.284 -0.885 . . . . 0.0 112.359 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 86.8 mt -63.3 -30.34 71.49 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.659 170.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -54.73 -40.75 69.59 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 119.192 3.034 . . . . 0.0 119.192 169.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -97.09 -1.61 44.91 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.521 1.528 . . . . 0.0 113.797 -170.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 25.8 t -113.59 -36.9 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 O-C-N 118.226 -2.797 . . . . 0.0 109.174 176.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 55.7 mt -84.26 -75.71 0.33 Allowed 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 119.979 -1.701 . . . . 0.0 107.18 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 20.9 mt -47.73 -41.1 22.17 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 -165.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.01 3.32 4.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 115.048 -2.406 . . . . 0.0 113.674 178.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 56.4 m -94.92 9.12 40.5 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 115.213 1.561 . . . . 0.0 115.213 166.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 . . . . . 0 C--O 1.251 1.146 0 O-C-N 117.709 -3.12 . . . . 0.0 115.433 164.584 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 22.6 ttt . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.66 172.58 10.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 118.097 2.629 . . . . 0.0 118.097 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -89.67 152.27 21.45 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 66.3 tt0 -130.66 141.13 50.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 120.623 1.556 . . . . 0.0 113.464 155.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 7.9 p -124.74 148.73 60.23 Favored Pre-proline 0 N--CA 1.448 -0.53 0 O-C-N 120.076 -1.64 . . . . 0.0 114.567 -173.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -67.18 -19.8 50.35 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.259 1.973 . . . . 0.0 115.848 169.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -156.02 148.48 23.72 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 128.546 2.738 . . . . 0.0 111.36 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.8 t -147.81 127.72 13.56 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 125.301 1.626 . . . . 0.0 113.021 174.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.78 62.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 126.953 2.658 . . . . 0.0 110.807 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.53 -22.48 63.57 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 129.368 3.067 . . . . 0.0 114.034 167.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 23.0 mtt -81.57 -44.3 17.48 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 118.123 -2.861 . . . . 0.0 113.202 164.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.55 69.18 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 118.998 2.962 . . . . 0.0 118.998 177.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -76.62 -38.67 54.33 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 113.808 -1.542 . . . . 0.0 113.213 168.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -56.54 -43.41 79.86 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.909 -2.369 . . . . 0.0 113.9 170.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -47.74 83.86 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 130.107 3.363 . . . . 0.0 113.538 168.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -45.78 -49.36 15.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 162.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -69.9 -33.98 72.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 176.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.22 -27.7 67.45 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 115.955 -2.298 . . . . 0.0 113.462 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -73.13 -52.75 13.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 126.671 1.988 . . . . 0.0 112.869 169.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . 0.272 1.0 OUTLIER -62.03 -18.91 62.11 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 115.551 -2.166 . . . . 0.0 110.085 178.598 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -81.55 -44.23 17.61 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 114.935 -2.46 . . . . 0.0 112.644 176.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -48.89 -38.84 23.78 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 118.629 2.826 . . . . 0.0 118.629 171.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 43.7 t -75.04 -34.65 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 C-N-CA 127.526 2.33 . . . . 0.0 113.673 177.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -74.86 -39.54 61.5 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 122.662 2.483 . . . . 0.0 115.908 172.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 37.4 tp -55.59 -34.18 64.61 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 117.631 -3.168 . . . . 0.0 114.661 169.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . 0.283 30.5 tp -71.72 -32.52 67.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.52 1.928 . . . . 0.0 113.166 170.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -69.15 -34.3 74.76 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 125.603 1.814 . . . . 0.0 111.911 172.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 30.1 m-20 -73.17 -38.17 66.27 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 116.448 -3.907 . . . . 0.0 109.627 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.4 -32.64 65.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.723 2.809 . . . . 0.0 118.171 176.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -68.11 -18.25 64.59 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.642 1.977 . . . . 0.0 115.341 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -76.08 -23.32 55.0 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -174.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 19.5 p-10 -141.06 39.08 1.78 Allowed 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 127.417 2.287 . . . . 0.0 112.432 -166.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.345 0.8 OUTLIER 31.86 46.86 0.06 Allowed 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 118.405 2.743 . . . . 0.0 118.405 -176.073 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 27.3 mt -99.3 -2.49 36.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.619 2.081 . . . . 0.0 116.619 163.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 -58.28 -49.73 76.11 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 126.726 3.155 . . . . 0.0 110.875 -174.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 18.6 mt -74.03 -41.1 5.16 Favored Pre-proline 0 N--CA 1.447 -0.604 0 O-C-N 116.325 -3.985 . . . . 0.0 110.633 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -56.93 -39.87 88.25 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 124.26 3.306 . . . . 0.0 108.536 170.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 54.7 tp -77.96 -29.14 49.68 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 117.554 2.428 . . . . 0.0 117.554 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . 0.406 HD13 ' CH2' ' D' ' 19' ' ' TRP . 51.5 mt -67.03 -23.31 65.89 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 117.254 -1.355 . . . . 0.0 113.758 161.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -91.31 -25.12 19.59 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 118.773 -1.171 . . . . 0.0 111.605 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.32 -54.34 46.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 119.029 -2.294 . . . . 0.0 112.038 159.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 21.5 mmt -72.05 -36.92 69.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 119.169 3.025 . . . . 0.0 119.169 -171.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.2 mp -105.66 144.21 32.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 117.837 2.532 . . . . 0.0 117.837 -175.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 67.0 p -78.38 161.7 69.02 Favored Pre-proline 0 N--CA 1.448 -0.527 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 166.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -47.8 -43.31 29.39 Favored 'Trans proline' 0 N--CA 1.447 -1.255 0 C-N-CA 124.81 3.673 . . . . 0.0 112.725 166.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -58.0 -42.49 85.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 172.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -68.6 -35.43 77.33 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 127.296 3.427 . . . . 0.0 114.239 -174.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 39.5 mtm-85 -73.52 -37.64 65.58 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 118.901 -2.374 . . . . 0.0 111.735 172.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -66.04 -36.59 83.64 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 125.444 1.715 . . . . 0.0 114.818 170.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.08 96.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 128.998 2.919 . . . . 0.0 107.975 177.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 57.4 mt -84.86 -31.73 23.61 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 117.19 -3.444 . . . . 0.0 111.969 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.52 -37.85 50.38 Favored Glycine 0 CA--C 1.526 0.725 0 O-C-N 126.768 2.542 . . . . 0.0 115.049 158.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 25.8 m -77.49 -40.11 44.08 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 33.5 mtt180 -72.99 -24.95 60.83 Favored 'General case' 0 N--CA 1.448 -0.525 1 CA-C-O 110.55 -4.548 . . . . 0.0 113.405 -173.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 80.3 t -62.54 -41.93 93.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 122.623 2.465 . . . . 0.0 111.991 163.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -76.06 -29.58 58.05 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 118.574 2.805 . . . . 0.0 118.574 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 63.5 mt -59.14 -42.1 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 O-C-N 118.805 -2.434 . . . . 0.0 111.942 166.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 66.8 t -59.41 -49.26 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 C-N-CA 126.176 1.791 . . . . 0.0 111.591 174.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -64.51 -38.5 91.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 113.172 -1.831 . . . . 0.0 110.585 -172.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -73.08 -33.7 65.77 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 117.391 -3.318 . . . . 0.0 114.93 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 87.1 mt -76.36 -13.57 60.13 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 169.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 55.7 mt -93.07 -15.92 25.56 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 120.738 1.608 . . . . 0.0 108.759 170.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -94.41 -34.91 12.57 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 120.51 1.505 . . . . 0.0 113.121 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.71 3.9 74.48 Favored Glycine 0 C--N 1.339 0.739 1 CA-C-O 110.552 -5.582 . . . . 0.0 113.827 165.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -93.24 58.36 2.85 Favored 'General case' 0 N--CA 1.444 -0.758 1 CA-C-N 124.327 4.064 . . . . 0.0 112.365 -154.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 20.3 mtt -147.16 144.4 28.95 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 125.073 1.483 . . . . 0.0 111.62 -167.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . 0.275 83.0 p -64.83 162.2 16.69 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 158.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -52.21 -41.74 62.95 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 129.44 3.096 . . . . 0.0 112.952 166.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 34.0 ttp-105 -53.2 -62.98 1.3 Allowed 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 128.644 3.715 . . . . 0.0 110.022 170.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -51.84 -51.82 53.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 123.931 0.77 . . . . 0.0 113.034 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 53.7 mt -50.94 -48.46 60.86 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 121.417 1.917 . . . . 0.0 114.278 174.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 54.5 tttt -62.31 -46.78 87.2 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 121.465 1.939 . . . . 0.0 106.536 -171.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -77.18 -35.45 55.82 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 115.784 -2.055 . . . . 0.0 116.535 -177.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -79.67 -36.95 36.91 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 118.155 2.65 . . . . 0.0 118.155 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.252 7.3 mp -94.39 -27.81 15.86 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 126.011 2.07 . . . . 0.0 110.728 -176.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.18 -149.33 49.94 Favored Glycine 0 CA--C 1.523 0.581 0 O-C-N 119.946 -1.721 . . . . 0.0 113.134 -175.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -52.82 -23.06 6.19 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 116.062 1.875 . . . . 0.0 116.062 163.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.28 -7.61 84.96 Favored Glycine 0 C--N 1.337 0.595 0 CA-C-O 114.855 -3.192 . . . . 0.0 112.794 -169.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 7.4 tt -59.05 -44.15 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 1 CA-C-O 111.512 -4.089 . . . . 0.0 113.155 167.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.53 -22.66 60.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 124.682 3.401 . . . . 0.0 113.871 172.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 8.5 m -64.66 -39.14 93.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.882 1.273 . . . . 0.0 107.665 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 36.8 mm -83.11 -33.73 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 119.327 -2.108 . . . . 0.0 114.384 170.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.6 p -105.06 9.56 34.31 Favored 'General case' 0 N--CA 1.449 -0.482 1 N-CA-C 122.846 4.387 . . . . 0.0 122.846 -164.152 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 20.7 mtp85 -128.14 145.56 50.98 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 118.032 -2.917 . . . . 0.0 113.086 -178.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 96.01 166.95 34.46 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 67.3 m -65.29 -30.97 71.88 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -171.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -98.79 6.48 46.87 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -173.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 51.6 p -55.86 158.67 3.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 130.946 3.699 . . . . 0.0 114.627 165.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 48.9 tp -61.81 -32.57 72.89 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 129.664 3.186 . . . . 0.0 111.066 -151.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.25 87.1 mttt -98.59 12.39 35.43 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 120.006 3.336 . . . . 0.0 120.006 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -136.19 -11.45 1.93 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 130.457 3.503 . . . . 0.0 115.217 -179.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.5 161.38 0.33 Allowed Pre-proline 0 N--CA 1.45 -0.47 0 C-N-CA 129.815 3.246 . . . . 0.0 113.14 166.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -49.66 138.61 32.4 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 123.745 2.964 . . . . 0.0 113.46 162.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 87.5 t -61.89 -31.7 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 128.841 2.856 . . . . 0.0 110.021 -177.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 12.7 pm0 -67.44 -34.6 77.54 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 116.853 -3.654 . . . . 0.0 114.288 -176.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 9.2 tp -73.0 -42.91 62.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.689 1.996 . . . . 0.0 110.1 174.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 70.0 mtp180 -61.53 -49.43 76.72 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 125.654 1.846 . . . . 0.0 112.082 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -73.51 -37.69 65.6 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 127.406 2.282 . . . . 0.0 109.289 -176.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.1 t90 -51.6 -56.9 10.93 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 163.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 55.6 mt -65.75 -17.51 64.67 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 120.107 -1.621 . . . . 0.0 111.975 -174.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -88.98 -25.95 21.75 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 122.819 2.554 . . . . 0.0 114.954 166.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.46 -12.89 61.28 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 169.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.16 -48.7 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 C-N-CA 127.005 2.122 . . . . 0.0 113.659 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 96.1 mt -85.12 -31.02 23.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 121.888 2.131 . . . . 0.0 112.635 -169.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.1 27.74 8.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 121.034 1.743 . . . . 0.0 113.695 -168.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . 0.426 ' HG3' ' H ' ' C' ' 108' ' ' ASP . 14.8 pttp -83.57 160.45 21.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.214 -1.374 . . . . 0.0 113.049 -169.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 66.9 m -111.75 47.73 1.01 Allowed 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.697 170.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . 0.426 ' H ' ' HG3' ' C' ' 106' ' ' LYS . 18.3 t0 . . . . . 0 C--O 1.249 1.036 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 170.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 11.4 ttt . . . . . 0 N--CA 1.473 0.683 0 CA-C-O 116.032 -1.937 . . . . 0.0 111.955 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.82 127.37 4.07 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 -173.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -85.37 150.05 25.01 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -168.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -124.27 144.45 49.97 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 112.771 -2.013 . . . . 0.0 110.167 176.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 53.6 p -129.97 149.43 73.1 Favored Pre-proline 0 N--CA 1.445 -0.697 0 CA-C-O 117.718 -1.134 . . . . 0.0 110.767 175.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . 0.275 15.7 Cg_exo -68.01 -24.25 39.46 Favored 'Trans proline' 0 N--CA 1.451 -0.992 1 C-N-CA 125.851 4.367 . . . . 0.0 114.147 177.171 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -149.75 145.32 26.58 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-O 113.449 -3.167 . . . . 0.0 109.362 169.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 1.9 t -79.8 130.39 35.28 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 127.424 2.952 . . . . 0.0 108.112 173.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.37 -40.58 59.5 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 128.011 3.319 . . . . 0.0 110.905 162.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.03 -36.06 77.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 115.938 1.829 . . . . 0.0 115.938 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.269 14.0 mmt -62.05 -39.79 93.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.718 -1.134 . . . . 0.0 109.746 165.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.21 -20.46 62.81 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 122.371 2.35 . . . . 0.0 116.504 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -88.6 -44.6 10.52 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 119.152 -2.218 . . . . 0.0 107.381 171.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -62.0 -44.0 97.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.045 -1.659 . . . . 0.0 110.703 -172.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -27.97 69.78 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.27 1.952 . . . . 0.0 116.27 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -74.65 -34.21 62.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.107 1.763 . . . . 0.0 109.2 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -81.73 -23.11 36.91 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 118.003 -2.936 . . . . 0.0 112.123 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . 0.253 59.4 mt-10 -70.39 -26.03 63.52 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 117.836 -3.04 . . . . 0.0 111.848 161.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . 0.406 ' CH2' HD13 ' C' ' 39' ' ' LEU . 5.9 t-105 -82.04 -35.89 28.31 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 117.019 -1.467 . . . . 0.0 113.44 174.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.49 -25.99 68.51 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 117.0 -1.476 . . . . 0.0 110.336 173.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -73.55 -20.77 60.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 130.58 3.552 . . . . 0.0 107.949 177.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -97.52 -24.66 15.47 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 120.965 1.711 . . . . 0.0 113.014 167.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 79.6 t -65.14 -41.65 92.3 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 O-C-N 117.936 -2.977 . . . . 0.0 110.252 169.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -65.95 -40.62 91.51 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 121.945 2.157 . . . . 0.0 115.351 171.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 16.3 tp -57.76 -43.84 85.74 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 120.095 -1.628 . . . . 0.0 111.274 174.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 23.8 tp -60.02 -45.75 91.76 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 ttpp -56.05 -45.0 79.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 126.564 3.078 . . . . 0.0 110.809 176.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -69.9 -15.67 63.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 112.139 -2.3 . . . . 0.0 114.574 174.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.03 -34.87 26.17 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 127.911 2.484 . . . . 0.0 117.404 167.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -62.84 -33.45 75.28 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 121.049 -1.032 . . . . 0.0 111.416 170.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -73.8 -25.98 60.4 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 129.595 3.158 . . . . 0.0 115.489 -171.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.9 p30 -116.79 1.35 12.73 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.907 1.379 . . . . 0.0 112.788 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 70.01 29.01 4.0 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 129.825 3.25 . . . . 0.0 115.019 -178.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 61.3 mt -99.29 10.31 41.66 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 119.979 -1.701 . . . . 0.0 109.896 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.91 -57.95 9.55 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 3.1 mt -64.95 -36.93 17.93 Favored Pre-proline 0 N--CA 1.449 -0.509 0 O-C-N 121.221 -0.925 . . . . 0.0 110.786 -172.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.81 -40.25 65.18 Favored 'Trans proline' 0 N--CA 1.447 -1.221 0 N-CA-C 119.207 2.734 . . . . 0.0 119.207 162.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 16.5 tp -68.41 -43.07 78.02 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 117.073 -3.517 . . . . 0.0 112.096 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 77.1 mt -57.52 -48.38 79.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 126.515 2.384 . . . . 0.0 110.137 171.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -78.96 -29.24 43.8 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 117.439 -3.288 . . . . 0.0 108.734 -166.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.38 -54.8 41.24 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.181 0.992 . . . . 0.0 109.348 161.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 5.1 mmt -57.53 -49.16 77.24 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 114.424 -2.703 . . . . 0.0 114.624 -177.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 23.0 mt -111.09 133.03 53.78 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.464 1.906 . . . . 0.0 114.212 -164.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 76.5 p -68.1 151.0 97.53 Favored Pre-proline 0 N--CA 1.448 -0.543 0 O-C-N 126.061 2.101 . . . . 0.0 112.016 173.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -46.46 -43.82 21.64 Favored 'Trans proline' 0 N--CA 1.447 -1.215 1 C-N-CA 129.252 6.634 . . . . 0.0 114.904 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.89 -24.07 62.42 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 174.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -73.46 -25.3 60.43 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 114.187 -2.816 . . . . 0.0 112.986 166.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 26.0 mtm180 -89.31 -26.58 21.04 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 125.072 3.578 . . . . 0.0 111.743 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -51.78 -48.89 63.58 Favored 'General case' 0 N--CA 1.45 -0.455 1 C-N-CA 132.703 4.401 . . . . 0.0 111.761 159.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.3 -38.39 35.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 126.552 2.407 . . . . 0.0 115.272 -179.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.18 -34.74 78.29 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 118.214 2.672 . . . . 0.0 118.214 165.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.34 -41.62 99.74 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-O 117.665 -1.631 . . . . 0.0 115.86 166.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 52.1 m -59.58 -46.8 87.86 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 123.658 1.694 . . . . 0.0 110.016 168.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -59.16 -31.94 69.44 Favored 'General case' 0 N--CA 1.45 -0.453 2 O-C-N 114.297 -5.252 . . . . 0.0 111.011 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 99.0 t -57.37 -57.5 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 CA-C-N 122.116 2.234 . . . . 0.0 110.38 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -68.94 -27.24 65.56 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 115.63 -2.128 . . . . 0.0 114.451 176.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 79.6 mt -54.26 -66.14 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-N 121.27 1.85 . . . . 0.0 106.803 167.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 61.2 t -42.87 -51.01 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 O-C-N 120.818 -1.176 . . . . 0.0 113.765 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.36 -48.75 76.19 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -68.35 -22.51 64.67 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 117.474 -1.251 . . . . 0.0 113.505 177.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 31.8 mt -77.33 -3.13 38.41 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 125.397 2.522 . . . . 0.0 116.96 174.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 77.6 mt -104.01 -28.63 11.42 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.573 1.949 . . . . 0.0 111.946 168.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 39.4 ttm105 -77.49 -51.11 11.29 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.882 -3.011 . . . . 0.0 113.313 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.37 41.51 91.0 Favored Glycine 0 C--N 1.337 0.637 0 CA-C-O 116.173 -2.46 . . . . 0.0 111.362 163.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -115.95 -42.07 3.12 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 121.342 2.571 . . . . 0.0 108.212 -174.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 15.0 mmt -77.73 61.37 2.4 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 113.584 -1.644 . . . . 0.0 111.67 159.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 75.2 p -93.42 -176.49 4.13 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.192 1.397 . . . . 0.0 114.032 -173.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.371 2.8 tp-100 69.22 -109.0 0.08 Allowed 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 119.193 -2.192 . . . . 0.0 114.903 165.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -73.88 -37.29 64.78 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 116.545 -1.693 . . . . 0.0 110.477 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -69.84 -45.1 68.54 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 130.477 3.511 . . . . 0.0 113.631 -169.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.03 -18.03 59.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 113.824 -2.989 . . . . 0.0 111.377 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -106.25 -12.27 15.77 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 123.07 2.668 . . . . 0.0 116.318 174.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -119.76 -15.62 8.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 118.885 2.92 . . . . 0.0 118.885 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -124.59 -17.9 5.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 123.123 2.692 . . . . 0.0 112.204 172.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.99 -52.9 5.65 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.604 -1.665 . . . . 0.0 111.652 161.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 109.19 -167.14 12.81 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 119.257 -1.449 . . . . 0.0 112.206 146.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.09 -34.79 63.94 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -173.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -38.16 -24.14 0.02 OUTLIER Glycine 0 CA--C 1.523 0.548 0 CA-C-O 117.023 -1.987 . . . . 0.0 114.966 165.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 19.8 tt -60.64 -25.77 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 120.373 2.086 . . . . 0.0 112.847 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.85 -33.54 34.43 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 117.293 -1.337 . . . . 0.0 109.03 -176.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 33.9 m -70.57 -20.24 62.8 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 122.159 2.254 . . . . 0.0 109.929 170.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 25.1 mm -95.49 -30.64 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -173.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 7.1 p -105.19 -26.01 12.23 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 114.495 -2.669 . . . . 0.0 113.883 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.275 22.9 mtp85 -82.6 168.77 16.99 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 125.376 3.716 . . . . 0.0 112.493 167.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.92 154.24 29.37 Favored Glycine 0 C--N 1.337 0.618 0 CA-C-O 122.952 1.306 . . . . 0.0 114.617 177.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 92.5 p -74.17 -16.66 60.98 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.974 -1.113 . . . . 0.0 111.448 -147.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -135.3 64.48 1.58 Allowed 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 125.612 2.625 . . . . 0.0 107.735 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 24.8 p -97.62 -169.4 1.83 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 127.106 2.163 . . . . 0.0 112.389 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.21 -21.39 56.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 119.25 -2.156 . . . . 0.0 111.479 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 19.6 tttt -84.96 0.07 52.55 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.953 2.901 . . . . 0.0 109.748 174.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.45 -34.43 6.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 120.28 -1.513 . . . . 0.0 110.854 175.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 53.1 76.52 0.52 Allowed Pre-proline 0 N--CA 1.449 -0.519 0 CA-C-N 122.794 2.543 . . . . 0.0 111.389 164.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.283 98.5 Cg_exo 17.2 40.53 0.0 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.002 0 N-CA-C 116.941 1.862 . . . . 0.0 116.941 53.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 72.8 t -43.61 -26.33 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 128.564 2.746 . . . . 0.0 115.897 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.49 -30.29 8.01 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.695 1.998 . . . . 0.0 110.337 -160.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 24.2 tp -57.5 -46.4 83.81 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.744 -2.472 . . . . 0.0 111.223 147.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -60.38 -43.82 96.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 115.742 1.756 . . . . 0.0 115.742 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -62.62 -36.58 83.22 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.116 2.167 . . . . 0.0 113.616 166.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 80.6 t90 -65.45 -44.42 87.34 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 118.351 -2.718 . . . . 0.0 110.137 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 47.2 mt -60.69 -36.3 78.45 Favored 'General case' 0 N--CA 1.446 -0.663 1 O-C-N 116.103 -4.123 . . . . 0.0 109.744 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -57.41 -29.26 63.97 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -101.74 -22.14 14.47 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 129.712 3.205 . . . . 0.0 110.79 -173.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 50.6 t -86.69 -38.53 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-O 123.78 1.752 . . . . 0.0 111.761 175.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . 0.294 15.3 mt -96.58 -28.73 14.23 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 114.002 -2.904 . . . . 0.0 116.062 -175.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 12.3 mt -102.05 34.71 2.6 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.754 1.615 . . . . 0.0 107.883 172.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . 0.313 17.6 pttp -62.15 165.69 5.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.828 178.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.37 -42.48 15.05 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.668 3.587 . . . . 0.0 113.232 -177.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.249 1.032 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 176.756 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.11 -53.81 22.69 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 119.923 -1.736 . . . . 0.0 113.414 -158.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . 0.251 25.3 tt0 -60.97 -20.04 61.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.834 -3.041 . . . . 0.0 113.697 178.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -78.21 -15.97 58.3 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 127.794 2.438 . . . . 0.0 114.571 171.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 27.7 p -90.78 151.51 43.75 Favored Pre-proline 0 N--CA 1.45 -0.436 0 C-N-CA 125.746 1.618 . . . . 0.0 113.086 -172.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -85.05 14.61 2.43 Favored 'Trans proline' 0 N--CA 1.448 -1.153 0 N-CA-C 118.982 2.647 . . . . 0.0 118.982 167.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -161.95 156.3 22.19 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 117.257 -3.402 . . . . 0.0 110.466 172.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.269 16.1 t -125.48 124.15 40.75 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 124.189 1.947 . . . . 0.0 111.624 175.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -98.82 -22.95 15.57 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 112.37 -2.196 . . . . 0.0 113.354 -175.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.97 77.16 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.068 1.747 . . . . 0.0 110.437 159.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 17.0 ttp -52.12 -44.82 64.68 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 119.764 -1.835 . . . . 0.0 111.805 170.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.44 -31.62 68.87 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 114.121 -2.847 . . . . 0.0 110.499 -173.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.271 26.6 tp10 -58.97 -43.63 91.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 125.85 1.969 . . . . 0.0 114.334 168.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -59.8 -50.7 72.77 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 125.783 2.706 . . . . 0.0 114.554 174.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -62.78 -24.74 67.88 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 117.253 -3.404 . . . . 0.0 114.396 170.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . 0.271 1.8 t60 -66.99 -43.17 83.66 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.433 1.493 . . . . 0.0 113.38 171.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -76.38 -30.71 57.64 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 125.955 2.034 . . . . 0.0 107.749 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -65.86 -41.59 91.48 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 122.053 2.206 . . . . 0.0 111.448 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 12.8 t-105 -70.0 -52.96 19.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 127.651 2.38 . . . . 0.0 108.063 176.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 mt -62.17 -21.45 65.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 114.264 -2.779 . . . . 0.0 115.378 177.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -53.28 -43.04 67.15 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 118.439 2.755 . . . . 0.0 118.439 161.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -62.38 -39.31 92.77 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 129.17 2.988 . . . . 0.0 107.429 172.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.4 t -79.68 -24.11 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 120.465 1.484 . . . . 0.0 109.997 -176.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . 0.26 6.1 m-20 -59.92 -61.25 2.75 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 116.716 -3.74 . . . . 0.0 115.937 160.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 47.9 tp -44.73 -53.22 7.56 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 131.533 3.933 . . . . 0.0 114.154 173.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.6 tp -67.24 -36.29 81.32 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -64.73 -38.37 90.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.349 176.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -75.06 -32.8 61.6 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 114.956 -2.45 . . . . 0.0 111.516 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.96 -25.14 52.46 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 120.763 1.62 . . . . 0.0 114.863 172.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.407 ' CE1' ' HB2' ' B' ' 27' ' ' LYS . 57.4 m-85 -59.8 -44.85 93.77 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 122.361 2.346 . . . . 0.0 112.042 162.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -78.31 16.68 0.74 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 113.978 -2.915 . . . . 0.0 113.348 176.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -131.76 7.39 4.42 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 121.461 1.937 . . . . 0.0 113.659 162.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.28 14.3 m-20 46.58 32.6 1.71 Allowed 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 128.138 2.575 . . . . 0.0 117.576 -165.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.1 mt -90.09 4.42 50.37 Favored 'General case' 0 N--CA 1.452 -0.368 1 O-C-N 115.877 -4.264 . . . . 0.0 113.235 166.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 p-80 -58.11 -43.73 87.31 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 116.968 -3.583 . . . . 0.0 115.164 -177.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.406 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 56.7 mt -64.06 -47.02 80.53 Favored Pre-proline 0 N--CA 1.452 -0.326 0 CA-C-O 117.087 -1.435 . . . . 0.0 111.676 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.406 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 15.0 Cg_exo -53.09 -40.2 77.54 Favored 'Trans proline' 0 N--CA 1.448 -1.187 1 C-N-CA 125.667 4.245 . . . . 0.0 114.471 174.512 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 24.7 tp -74.19 -39.4 63.19 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 117.196 -3.44 . . . . 0.0 110.277 -175.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.8 mt -83.44 3.06 33.63 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 126.334 2.271 . . . . 0.0 112.837 176.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -103.96 -9.04 19.17 Favored 'General case' 0 N--CA 1.446 -0.635 1 O-C-N 115.398 -4.564 . . . . 0.0 116.225 162.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 tt -97.0 -55.77 2.76 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.827 2.051 . . . . 0.0 108.385 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 57.8 mmm -72.69 -10.9 60.34 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 123.693 1.711 . . . . 0.0 115.41 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.5 mt -134.82 135.07 41.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 118.404 -2.685 . . . . 0.0 110.62 -176.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 74.2 p -87.27 162.18 43.9 Favored Pre-proline 0 N--CA 1.448 -0.536 0 O-C-N 116.744 -3.723 . . . . 0.0 111.64 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -56.7 -51.83 8.22 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 124.139 3.226 . . . . 0.0 112.593 -169.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -68.94 -16.76 63.83 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 127.454 2.302 . . . . 0.0 113.452 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -87.14 -39.41 15.56 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 118.237 -2.789 . . . . 0.0 112.344 170.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.266 78.5 mtm-85 -64.2 -40.5 96.2 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 117.386 -3.321 . . . . 0.0 114.205 167.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -61.4 -45.65 93.44 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 116.054 -1.927 . . . . 0.0 111.946 176.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.28 -37.78 78.03 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 128.778 3.799 . . . . 0.0 112.247 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 70.6 mt -69.34 -26.08 64.52 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 121.236 1.834 . . . . 0.0 114.401 172.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.84 -45.49 57.58 Favored Glycine 0 C--N 1.336 0.537 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 173.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.1 m -64.15 -30.26 71.34 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 115.795 -2.05 . . . . 0.0 113.18 171.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.476 HH12 ' CD ' ' B' ' 47' ' ' GLU . 32.0 ttm180 -56.8 -34.78 68.02 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 120.438 1.472 . . . . 0.0 113.099 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 65.5 t -59.03 -37.41 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 116.411 -1.757 . . . . 0.0 113.019 172.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -67.63 -31.84 72.14 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 122.749 2.522 . . . . 0.0 114.236 171.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.276 64.4 mt -63.57 -39.42 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 O-C-N 120.019 -1.676 . . . . 0.0 107.846 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.6 t -79.13 -37.19 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 127.648 2.379 . . . . 0.0 113.369 -177.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -47.16 -60.9 2.16 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 125.711 1.882 . . . . 0.0 110.87 158.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -70.6 -14.05 62.33 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 126.685 3.136 . . . . 0.0 116.204 -175.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.9 mt -82.45 -39.35 22.68 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 116.739 -3.726 . . . . 0.0 111.673 167.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 tp -68.96 -47.48 65.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.354 1.433 . . . . 0.0 111.439 172.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.1 ttm105 -57.21 -62.19 1.94 Allowed 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.521 -3.237 . . . . 0.0 108.39 173.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.06 7.53 64.05 Favored Glycine 0 CA--C 1.522 0.506 0 O-C-N 119.756 -1.84 . . . . 0.0 117.404 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -97.11 -12.7 22.82 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 -165.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 22.1 ttm -138.41 134.68 34.42 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 127.394 2.933 . . . . 0.0 114.285 -167.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -97.56 157.9 15.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.099 -2.251 . . . . 0.0 115.845 -152.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -48.67 -37.19 17.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -174.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.3 tpt85 -75.83 -13.78 60.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 118.18 -2.825 . . . . 0.0 113.509 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -102.0 -36.56 8.55 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 117.159 -3.463 . . . . 0.0 105.778 -173.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 29.0 mt -67.78 -22.11 65.21 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 117.87 -3.019 . . . . 0.0 116.32 170.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.0 tptt -50.44 -29.98 11.53 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 115.502 1.668 . . . . 0.0 115.502 159.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -103.94 -50.74 3.31 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 174.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -66.46 -16.0 63.78 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 116.89 2.181 . . . . 0.0 116.89 -175.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 95.7 mt -129.63 -5.54 4.67 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 115.313 -2.279 . . . . 0.0 112.299 170.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 73.79 6.48 72.52 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-N 119.989 1.268 . . . . 0.0 115.839 -172.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.15 157.09 22.91 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 124.321 2.01 . . . . 0.0 113.404 -160.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.71 130.12 9.61 Favored Glycine 0 N--CA 1.446 -0.689 0 O-C-N 120.436 -1.415 . . . . 0.0 115.971 172.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 16.4 mt -61.32 -38.32 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 128.346 2.658 . . . . 0.0 114.12 -168.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.12 -13.15 62.27 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 117.686 2.476 . . . . 0.0 117.686 171.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.0 p -82.67 -48.3 11.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 120.83 -1.169 . . . . 0.0 111.992 169.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.5 mm -49.13 -39.42 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 123.147 1.451 . . . . 0.0 114.013 164.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.0 m -68.55 -49.2 61.31 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 120.74 -1.225 . . . . 0.0 108.496 -174.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.9 ttt180 -64.2 -37.32 87.04 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 125.411 1.695 . . . . 0.0 113.816 174.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.38 -47.48 62.3 Favored Glycine 0 C--N 1.338 0.64 0 C-N-CA 127.18 2.324 . . . . 0.0 109.791 172.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.6 m -58.99 -54.19 49.92 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 118.966 2.95 . . . . 0.0 118.966 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -59.13 -27.53 65.7 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 126.126 1.77 . . . . 0.0 113.49 168.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 56.1 m -67.0 -43.88 81.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 120.931 1.696 . . . . 0.0 112.011 168.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.7 tp -62.33 -41.94 98.97 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.811 2.044 . . . . 0.0 109.2 176.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -60.37 -34.97 74.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 124.405 3.275 . . . . 0.0 110.29 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.33 -5.72 59.23 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.735 -1.853 . . . . 0.0 115.956 177.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.86 140.52 58.42 Favored Pre-proline 0 N--CA 1.449 -0.521 0 O-C-N 125.207 1.567 . . . . 0.0 110.605 -176.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -57.98 139.12 89.29 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 C-N-CA 125.218 3.946 . . . . 0.0 110.037 173.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.9 m -57.23 -29.52 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 119.705 -1.872 . . . . 0.0 111.738 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -70.16 -36.49 74.75 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 124.362 1.039 . . . . 0.0 113.145 -177.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 14.8 tp -60.18 -49.61 76.93 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 166.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -54.15 -42.52 69.66 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.61 1.564 . . . . 0.0 107.928 177.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -74.53 -31.1 62.03 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 123.571 1.653 . . . . 0.0 114.131 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . 0.296 65.4 t90 -70.73 -42.42 70.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 116.411 -3.93 . . . . 0.0 109.884 173.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.1 mt -60.83 -37.28 81.5 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 118.75 -2.469 . . . . 0.0 116.88 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . 0.274 44.2 mt-10 -60.65 -14.06 18.3 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 118.407 2.743 . . . . 0.0 118.407 -178.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -99.38 -12.81 19.94 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.433 2.293 . . . . 0.0 113.782 176.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.4 t -117.99 -31.98 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 O-C-N 118.106 -2.871 . . . . 0.0 116.807 -174.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.2 mt -84.08 -35.04 24.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 126.309 2.957 . . . . 0.0 118.808 174.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.283 21.3 mt -112.02 -18.83 12.53 Favored 'General case' 0 N--CA 1.448 -0.553 1 N-CA-C 122.516 4.265 . . . . 0.0 122.516 -160.289 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -75.13 -4.02 36.21 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.843 2.535 . . . . 0.0 117.843 -176.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.1 p -129.96 13.65 5.76 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -168.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.296 2.4 m-20 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 116.003 -1.951 . . . . 0.0 114.254 175.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? . . . . . 0 N--CA 1.467 0.421 0 CA-C-O 121.827 0.822 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -56.14 -44.25 79.05 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 128.799 2.84 . . . . 0.0 117.6 -175.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -79.36 -16.37 56.39 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 120.564 -1.335 . . . . 0.0 108.263 -175.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -84.39 -12.84 53.73 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.087 -2.258 . . . . 0.0 111.656 175.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 52.7 m -104.22 158.71 31.36 Favored Pre-proline 0 N--CA 1.449 -0.521 0 N-CA-C 119.887 3.292 . . . . 0.0 119.887 -162.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -62.34 -40.68 38.61 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 CA-C-N 124.364 2.594 . . . . 0.0 110.909 176.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -123.17 158.84 29.89 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 124.937 2.303 . . . . 0.0 111.154 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 4.4 t -160.02 129.73 5.29 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 114.002 -1.454 . . . . 0.0 110.181 169.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.04 74.52 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.329 -2.107 . . . . 0.0 114.133 169.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.275 . . -71.62 -34.15 69.57 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 -172.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 90.4 mtp -74.67 -47.58 30.98 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 120.503 -1.373 . . . . 0.0 110.204 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.4 -37.73 70.53 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 170.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -73.88 -33.62 64.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.779 2.082 . . . . 0.0 116.133 172.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -55.58 -59.11 5.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 163.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -48.75 -33.19 9.82 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 120.462 3.504 . . . . 0.0 120.462 172.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -60.27 -40.27 89.78 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 121.269 1.85 . . . . 0.0 112.664 170.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -72.6 -38.61 67.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 118.06 2.615 . . . . 0.0 118.06 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -59.87 -23.49 63.47 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.263 -0.975 . . . . 0.0 113.532 169.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 6.4 t-105 -82.22 -46.74 13.33 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.72 2.408 . . . . 0.0 109.167 172.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 76.9 mt -57.82 -27.21 62.96 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 119.567 -1.958 . . . . 0.0 115.727 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -59.5 -45.32 92.04 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 119.154 -2.216 . . . . 0.0 111.963 174.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -59.31 -51.58 69.32 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 114.942 -2.456 . . . . 0.0 110.96 176.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 89.1 t -67.6 -27.54 38.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 O-C-N 127.957 3.286 . . . . 0.0 110.327 -173.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -77.21 -39.74 47.6 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 116.547 -3.846 . . . . 0.0 111.397 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 31.7 tp -70.07 -37.24 75.44 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 117.659 -3.151 . . . . 0.0 110.961 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.61 -47.57 85.05 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 118.793 2.886 . . . . 0.0 118.793 165.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . 0.407 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 71.2 tttt -61.02 -29.66 69.85 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 128.338 3.524 . . . . 0.0 111.698 173.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -91.57 -24.69 19.52 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 117.073 2.249 . . . . 0.0 117.073 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.41 -26.34 63.15 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.253 1.946 . . . . 0.0 116.253 164.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -61.56 -32.09 72.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 126.205 1.802 . . . . 0.0 115.547 169.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -81.64 -2.16 49.29 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 123.744 1.735 . . . . 0.0 111.52 -170.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -128.71 7.96 5.75 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 119.039 -2.288 . . . . 0.0 109.893 -173.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.392 14.5 m-20 58.36 21.58 8.49 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 119.732 -1.855 . . . . 0.0 115.144 -167.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 mt -102.26 20.02 17.61 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 120.582 3.549 . . . . 0.0 120.582 178.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -76.52 -46.46 26.46 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 118.692 -2.505 . . . . 0.0 112.779 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 25.7 mt -63.57 -41.66 67.66 Favored Pre-proline 0 N--CA 1.448 -0.569 0 CA-C-N 121.737 2.062 . . . . 0.0 113.18 174.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.287 40.1 Cg_exo -49.08 -47.97 19.93 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 124.941 3.76 . . . . 0.0 115.887 162.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -65.78 -35.01 79.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.267 -2.771 . . . . 0.0 108.688 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 57.2 mt -70.04 -40.75 74.95 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 118.087 2.625 . . . . 0.0 118.087 177.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -52.03 -25.54 8.77 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.4 1.88 . . . . 0.0 113.129 162.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 19.0 tp -91.96 -35.31 14.07 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.587 1.555 . . . . 0.0 112.853 178.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 21.8 mmt -94.46 -8.88 37.22 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 118.507 2.78 . . . . 0.0 118.507 -176.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 53.4 mt -141.94 126.85 18.24 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.786 1.634 . . . . 0.0 113.501 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 44.7 p -61.08 154.93 58.37 Favored Pre-proline 0 N--CA 1.449 -0.501 1 O-C-N 113.841 -5.537 . . . . 0.0 110.541 169.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -50.28 -22.8 8.96 Favored 'Trans proline' 0 N--CA 1.447 -1.213 0 N-CA-C 120.498 3.23 . . . . 0.0 120.498 174.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -81.68 -36.77 28.36 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 117.483 -3.261 . . . . 0.0 114.554 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.476 ' CD ' HH12 ' A' ' 54' ' ' ARG . 19.5 mt-10 -62.23 -43.63 98.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 114.469 -2.682 . . . . 0.0 111.366 162.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -65.81 -33.99 77.13 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 125.587 1.804 . . . . 0.0 112.045 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -60.48 -43.45 96.94 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.885 -1.052 . . . . 0.0 113.276 168.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . 0.347 . . -65.91 -56.56 11.15 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 115.72 -2.086 . . . . 0.0 109.677 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.302 10.6 mt -59.0 -30.95 68.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 121.196 1.816 . . . . 0.0 111.427 -178.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.03 -52.86 44.65 Favored Glycine 0 CA--C 1.523 0.582 0 CA-C-O 114.747 -3.252 . . . . 0.0 110.929 170.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 25.8 m -66.78 -28.63 68.54 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.189 2.195 . . . . 0.0 108.713 -174.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -63.08 -26.03 68.64 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.937 1.695 . . . . 0.0 111.809 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 79.6 t -64.89 -48.89 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 125.032 1.457 . . . . 0.0 111.225 169.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 24.7 mtp180 -66.33 -33.53 75.95 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 118.121 -2.862 . . . . 0.0 109.624 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 85.2 mt -64.07 -59.27 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 O-C-N 121.022 -1.049 . . . . 0.0 111.7 172.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 39.6 t -56.33 -40.01 63.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 O-C-N 121.399 -0.813 . . . . 0.0 111.449 178.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -67.01 -32.43 73.65 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.228 -0.92 . . . . 0.0 111.828 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -80.79 -18.78 46.45 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.828 1.299 . . . . 0.0 108.935 176.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . 0.334 76.1 mt -88.93 10.18 22.28 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 114.699 -2.572 . . . . 0.0 110.95 170.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 15.1 mt -112.8 -29.33 7.44 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 118.931 2.937 . . . . 0.0 118.931 150.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.37 21.5 ttm105 -58.83 -70.0 0.17 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 127.533 2.333 . . . . 0.0 111.639 176.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.67 27.89 9.35 Favored Glycine 0 C--N 1.336 0.538 1 CA-C-O 112.905 -4.275 . . . . 0.0 112.273 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -113.41 -22.19 10.5 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 119.496 3.147 . . . . 0.0 119.496 -176.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . 0.277 13.5 mtt -84.82 147.48 26.8 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 126.364 2.29 . . . . 0.0 111.313 -174.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 87.4 p -95.1 169.55 10.03 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 116.799 -1.961 . . . . 0.0 112.322 168.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -62.56 -31.85 72.73 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 116.883 -1.532 . . . . 0.0 112.51 -176.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 31.3 ttt180 -63.1 -50.88 68.77 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 126.345 2.278 . . . . 0.0 106.052 176.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -61.53 -44.39 97.14 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 127.672 2.389 . . . . 0.0 109.232 -174.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 31.1 mt -63.49 -46.42 86.2 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.82 -1.086 . . . . 0.0 113.48 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -63.93 -43.14 96.78 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.725 1.266 . . . . 0.0 110.954 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -68.58 -59.35 3.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.102 0.961 . . . . 0.0 110.421 -176.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -93.21 -61.11 1.64 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.42 -1.276 . . . . 0.0 111.444 -161.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 30.1 mt -74.23 -14.66 60.96 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 92.89 -1.29 70.76 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-O 124.188 1.993 . . . . 0.0 112.033 162.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.07 114.72 26.67 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -162.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.7 171.1 53.65 Favored Glycine 0 C--N 1.332 0.312 0 O-C-N 119.42 -2.05 . . . . 0.0 116.074 -176.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 11.4 mm -52.91 -43.62 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-O 115.319 -2.276 . . . . 0.0 111.368 -174.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.58 -27.52 62.24 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 123.366 2.803 . . . . 0.0 113.91 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 30.3 m -67.45 -49.62 62.88 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 121.252 1.842 . . . . 0.0 112.822 173.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 15.6 mm -64.5 -39.6 86.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 C-N-CA 125.827 1.651 . . . . 0.0 112.777 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 98.3 m -49.25 -52.63 25.98 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 162.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 42.5 ttt180 -63.22 -34.56 77.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 125.91 1.684 . . . . 0.0 114.498 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -60.49 -46.76 93.76 Favored Glycine 0 CA--C 1.521 0.438 0 O-C-N 126.125 2.141 . . . . 0.0 114.198 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 2.4 p -76.02 -27.36 57.32 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.614 1.166 . . . . 0.0 107.855 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -67.26 -43.09 82.74 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 119.71 1.141 . . . . 0.0 112.314 170.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . 0.26 51.5 m -79.66 -22.6 43.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.728 2.411 . . . . 0.0 109.886 -168.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 15.0 mt -78.13 -39.92 39.68 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 118.993 -2.317 . . . . 0.0 109.102 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 47.8 tttm -70.44 -24.32 62.88 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.873 1.269 . . . . 0.0 110.483 -172.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.9 -23.67 31.11 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 115.25 -2.309 . . . . 0.0 113.502 166.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.93 150.2 88.48 Favored Pre-proline 0 N--CA 1.45 -0.46 0 CA-C-N 121.391 1.905 . . . . 0.0 115.098 -164.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -46.52 132.56 16.17 Favored 'Trans proline' 0 N--CA 1.451 -1.024 0 O-C-N 122.944 0.971 . . . . 0.0 110.641 163.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 1.1 m -61.93 -26.38 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 O-C-N 119.583 -1.948 . . . . 0.0 113.322 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pm0 -67.84 -25.04 65.35 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 124.372 2.034 . . . . 0.0 114.829 176.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 21.3 tp -73.33 -46.94 46.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 117.046 -3.534 . . . . 0.0 109.478 167.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 48.8 mtp85 -60.75 -38.63 85.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 126.743 2.527 . . . . 0.0 115.386 -175.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -60.45 -45.14 94.78 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.967 2.107 . . . . 0.0 112.182 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -77.28 -46.19 23.88 Favored 'General case' 0 N--CA 1.449 -0.525 1 C-N-CA 131.731 4.013 . . . . 0.0 108.264 -170.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 38.3 mt -54.77 -49.23 71.39 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 174.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -49.24 -55.35 12.87 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 126.099 2.125 . . . . 0.0 109.614 172.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -72.59 -18.03 61.64 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 121.037 3.717 . . . . 0.0 121.037 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 56.3 t -87.8 -42.28 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 115.639 -2.124 . . . . 0.0 111.281 171.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 52.7 mt -88.19 -65.57 1.0 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 120.405 1.457 . . . . 0.0 112.752 -167.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 83.9 mt -57.0 -30.52 64.24 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 120.054 -1.654 . . . . 0.0 114.022 -167.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -66.38 -10.26 41.65 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 117.78 2.511 . . . . 0.0 117.78 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 45.8 m -104.81 7.07 34.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 124.38 2.038 . . . . 0.0 114.651 -177.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 . . . . . 0 C--O 1.25 1.119 1 O-C-N 115.555 -4.466 . . . . 0.0 113.697 163.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ttt . . . . . 0 N--CA 1.469 0.51 0 N-CA-C 104.306 -2.479 . . . . 0.0 104.306 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.24 155.68 20.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.502 1.921 . . . . 0.0 112.77 176.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -122.6 161.88 22.9 Favored 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 125.825 1.953 . . . . 0.0 110.219 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -123.59 164.64 18.62 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.737 1.215 . . . . 0.0 110.157 165.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -151.83 154.25 32.66 Favored Pre-proline 0 N--CA 1.447 -0.592 0 O-C-N 127.25 2.843 . . . . 0.0 115.479 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.92 -14.24 13.83 Favored 'Trans proline' 0 N--CA 1.446 -1.307 1 C-N-CA 125.591 4.194 . . . . 0.0 113.321 174.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -147.48 135.31 21.15 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.766 -2.459 . . . . 0.0 106.33 172.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 15.4 t -138.19 134.47 34.53 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 123.15 1.452 . . . . 0.0 109.819 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.38 -34.54 78.19 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 116.39 -3.944 . . . . 0.0 115.198 177.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.96 -35.38 72.14 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.622 1.569 . . . . 0.0 113.018 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 59.2 mtt -64.0 -40.71 96.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 122.264 1.03 . . . . 0.0 109.374 171.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.29 -20.46 61.5 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 176.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -66.14 -50.86 62.52 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 120.456 -1.403 . . . . 0.0 107.86 162.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -60.96 -40.42 93.3 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -170.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -44.57 83.08 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 128.737 2.815 . . . . 0.0 113.906 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -62.65 -28.83 70.19 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 170.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -68.68 -24.81 64.55 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 119.01 2.967 . . . . 0.0 119.01 169.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -80.92 -42.05 21.99 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 125.729 1.893 . . . . 0.0 110.544 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . 0.619 ' CZ2' ' HD2' ' D' ' 48' ' ' ARG . 28.9 t-105 -62.96 -46.7 86.47 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 125.674 1.59 . . . . 0.0 112.997 169.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 5.7 mp -60.89 -36.8 80.17 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 116.358 -1.782 . . . . 0.0 109.551 175.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -70.24 -31.59 69.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 118.852 2.908 . . . . 0.0 118.852 171.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -53.34 -42.93 67.25 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.564 1.945 . . . . 0.0 111.175 161.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.312 42.6 t -65.63 -50.23 72.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 124.89 1.369 . . . . 0.0 112.287 174.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -70.44 -29.54 66.14 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 117.569 2.433 . . . . 0.0 117.569 -175.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 24.0 tp -70.19 -61.2 1.87 Allowed 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 126.453 3.025 . . . . 0.0 104.501 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 36.0 tp -52.12 -30.35 25.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 118.155 -2.84 . . . . 0.0 113.695 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -62.52 -39.5 93.75 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.804 1.241 . . . . 0.0 113.631 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -81.71 -20.52 39.24 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 125.868 1.667 . . . . 0.0 111.265 178.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.14 71.26 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.377 1.071 . . . . 0.0 112.102 -176.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -61.03 -35.68 77.54 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 120.059 1.3 . . . . 0.0 112.406 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -59.42 -29.22 67.6 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 126.922 2.639 . . . . 0.0 110.552 -157.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 34.7 p-10 -128.68 35.36 4.37 Favored 'General case' 0 N--CA 1.447 -0.587 1 C-N-CA 132.886 4.474 . . . . 0.0 115.339 172.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.415 79.3 m-20 61.98 18.3 9.76 Favored 'General case' 0 N--CA 1.45 -0.472 1 N-CA-C 122.293 4.183 . . . . 0.0 122.293 175.543 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.309 45.6 mt -78.71 -4.31 48.51 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 118.072 -2.893 . . . . 0.0 116.343 174.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -71.39 -41.98 68.97 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 117.081 -1.438 . . . . 0.0 111.892 -170.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . 0.409 ' HB2' ' HD3' ' C' ' 37' ' ' PRO . 12.9 mt -64.2 -51.23 63.5 Favored Pre-proline 0 N--CA 1.446 -0.669 0 CA-C-O 116.017 -1.944 . . . . 0.0 110.923 174.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . 0.409 ' HD3' ' HB2' ' C' ' 36' ' ' LEU . 7.7 Cg_exo -45.22 -36.5 12.4 Favored 'Trans proline' 0 N--CA 1.452 -0.963 1 C-N-CA 130.296 7.331 . . . . 0.0 116.495 167.069 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.79 -44.84 22.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 116.552 -1.689 . . . . 0.0 110.019 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 36.2 mt -69.63 -28.88 66.29 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 126.21 2.194 . . . . 0.0 110.67 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -79.29 -14.8 58.78 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.918 2.487 . . . . 0.0 110.493 -177.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 58.4 tp -101.71 -42.74 6.08 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.034 3.334 . . . . 0.0 111.808 172.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 12.0 mmt -62.99 -22.65 66.99 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 175.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mp -125.3 155.51 40.09 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.936 2.094 . . . . 0.0 115.092 -175.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -90.54 167.4 16.61 Favored Pre-proline 0 N--CA 1.45 -0.45 0 C-N-CA 129.136 2.975 . . . . 0.0 115.555 163.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -56.65 -38.36 95.75 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 N-CA-C 115.689 1.38 . . . . 0.0 115.689 177.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -68.76 -37.11 79.12 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 128.553 2.741 . . . . 0.0 108.442 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -71.66 -26.11 62.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 116.193 -1.86 . . . . 0.0 112.104 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . 0.256 34.0 mtm-85 -64.99 -47.48 77.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.688 2.395 . . . . 0.0 115.96 168.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.27 -49.3 77.62 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.587 1.955 . . . . 0.0 108.406 176.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -45.94 -52.91 10.82 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 126.225 2.203 . . . . 0.0 112.491 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 92.0 mt -66.89 -45.58 77.6 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 126.346 1.858 . . . . 0.0 113.03 -177.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.17 -29.03 67.62 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 121.433 1.924 . . . . 0.0 109.269 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 94.0 m -82.47 -41.42 19.81 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 121.175 -1.191 . . . . 0.0 110.249 -174.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.35 55.2 mtt180 -44.95 -38.27 4.58 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 116.045 1.869 . . . . 0.0 116.045 165.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 54.7 t -67.72 -38.3 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-O 114.093 -2.86 . . . . 0.0 109.547 174.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -70.79 -36.22 72.92 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 124.658 3.39 . . . . 0.0 113.799 170.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 70.5 mt -69.48 -27.7 35.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 122.336 2.335 . . . . 0.0 113.476 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 79.6 t -71.79 -29.49 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 117.056 2.243 . . . . 0.0 117.056 167.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -70.75 -43.36 68.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.766 2.826 . . . . 0.0 113.023 171.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -71.65 -42.42 67.57 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 119.548 1.067 . . . . 0.0 112.127 -176.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.8 -33.29 73.61 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 117.351 -1.309 . . . . 0.0 113.507 174.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . 0.392 72.0 mt -56.59 -51.7 67.64 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 121.775 2.08 . . . . 0.0 110.115 164.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -59.13 -45.2 91.56 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.36 56.65 10.41 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 106.75 -2.54 . . . . 0.0 106.75 174.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -125.45 57.96 1.31 Allowed 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 129.631 3.172 . . . . 0.0 103.719 168.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 34.0 mtt -136.69 142.61 43.15 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 127.618 2.367 . . . . 0.0 110.983 176.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 94.5 p -77.2 159.71 29.48 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 128.749 2.82 . . . . 0.0 115.711 163.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -58.73 -24.13 61.04 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.136 3.375 . . . . 0.0 111.325 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 31.3 ttp-105 -77.07 -35.0 56.96 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 167.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -75.23 -36.83 61.3 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 121.673 -0.642 . . . . 0.0 111.036 174.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.54 -14.46 42.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.081 -2.262 . . . . 0.0 113.947 171.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.7 tttt -94.4 -44.42 7.92 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 118.036 -2.915 . . . . 0.0 114.817 165.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -97.44 -23.28 16.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 126.893 2.077 . . . . 0.0 115.54 -163.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -94.35 -36.43 11.94 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 119.346 -2.096 . . . . 0.0 114.224 170.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 9.4 mp -88.25 -29.61 20.3 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.228 -1.844 . . . . 0.0 108.579 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 75.87 -154.25 44.85 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 122.038 2.199 . . . . 0.0 110.968 -176.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.71 -15.96 60.22 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 126.564 3.078 . . . . 0.0 111.959 174.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.79 -12.39 82.95 Favored Glycine 0 N--CA 1.446 -0.68 0 O-C-N 117.121 -3.487 . . . . 0.0 113.742 -166.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 13.9 tt -54.95 -40.07 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-O 115.471 -2.204 . . . . 0.0 110.989 170.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.24 -42.72 63.84 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 123.601 2.909 . . . . 0.0 112.652 174.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 3.4 m -50.47 -33.71 22.21 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 127.329 2.251 . . . . 0.0 115.726 176.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 32.1 mm -105.17 -10.68 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 126.539 1.936 . . . . 0.0 112.154 -171.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . 0.367 20.8 p -125.4 -15.97 6.01 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 119.344 3.091 . . . . 0.0 119.344 -167.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 38.9 mtp85 -110.83 164.94 12.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 O-C-N 119.799 -1.813 . . . . 0.0 112.468 162.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.88 160.48 17.85 Favored Glycine 0 C--N 1.339 0.72 0 C-N-CA 129.792 3.568 . . . . 0.0 111.44 -171.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 2.1 m -65.73 -7.31 14.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 116.858 2.17 . . . . 0.0 116.858 -173.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -105.47 7.24 32.99 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 -179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 45.6 p -75.63 168.75 19.44 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 111.707 -3.996 . . . . 0.0 112.39 -170.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . 0.3 54.9 tp -65.93 -28.21 68.76 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 122.366 2.348 . . . . 0.0 113.454 -145.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 81.4 mttt -104.22 -14.54 15.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.998 1.272 . . . . 0.0 114.047 178.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.73 -38.12 88.29 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 117.21 -3.431 . . . . 0.0 115.066 155.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.33 153.46 0.95 Allowed Pre-proline 0 N--CA 1.449 -0.516 0 C-N-CA 128.868 2.867 . . . . 0.0 113.052 174.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -65.7 149.98 86.63 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-O 124.838 1.933 . . . . 0.0 114.521 -172.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 7.4 t -79.21 -24.07 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 114.559 -2.639 . . . . 0.0 106.913 -167.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 21.8 pm0 -75.24 -16.41 60.46 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 122.043 2.201 . . . . 0.0 113.488 171.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -86.41 -37.97 17.83 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 167.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -68.12 -31.28 70.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 120.443 -1.411 . . . . 0.0 112.896 -170.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -84.72 -50.59 7.49 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.181 2.192 . . . . 0.0 110.118 -178.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 49.5 t90 -53.97 -40.4 66.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 172.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.42 -40.18 93.48 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 118.764 -2.46 . . . . 0.0 112.701 178.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -70.73 -33.85 71.27 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 120.519 1.509 . . . . 0.0 111.79 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -61.71 -27.25 68.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 116.516 2.043 . . . . 0.0 116.516 168.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 60.3 t -91.77 -53.28 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.756 -178.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 52.0 mt -91.99 -39.57 11.59 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 117.976 -1.489 . . . . 0.0 113.057 -166.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 11.0 mt -108.45 50.26 0.78 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 -173.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -96.1 144.89 25.95 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 119.333 -2.104 . . . . 0.0 113.808 -173.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 58.8 m -88.43 -1.23 57.93 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 127.435 2.294 . . . . 0.0 117.115 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 30.6 t0 . . . . . 0 C--O 1.249 1.038 0 C-N-CA 130.228 3.411 . . . . 0.0 112.157 174.862 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 43.4 mtp . . . . . 0 N--CA 1.47 0.536 0 CA-C-O 127.173 3.368 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.74 122.2 7.35 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 118.542 -2.599 . . . . 0.0 114.14 -176.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -85.18 91.33 8.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 114.908 -2.472 . . . . 0.0 108.3 -174.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -83.94 107.54 16.37 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 126.42 2.325 . . . . 0.0 112.859 178.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 96.2 p -85.09 170.67 12.72 Favored Pre-proline 0 N--CA 1.449 -0.498 0 CA-C-N 112.391 -2.186 . . . . 0.0 113.075 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -67.98 -32.86 27.56 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 N-CA-C 121.102 3.462 . . . . 0.0 121.102 -173.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -160.74 132.69 5.92 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 109.383 -3.553 . . . . 0.0 103.923 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.5 t -54.17 132.6 43.48 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 118.269 -2.769 . . . . 0.0 115.812 178.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.09 -34.62 73.73 Favored 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 117.58 -3.2 . . . . 0.0 114.737 176.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.98 -23.57 55.31 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 124.044 1.878 . . . . 0.0 111.173 -177.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -77.92 -35.7 50.25 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 117.128 -3.482 . . . . 0.0 111.095 173.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -41.6 98.29 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 121.986 0.898 . . . . 0.0 112.52 169.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -60.91 -52.18 66.14 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 113.71 -1.586 . . . . 0.0 108.644 169.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -55.1 -35.78 64.98 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 176.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.56 0.3 34.46 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 117.391 2.367 . . . . 0.0 117.391 172.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -101.69 -19.35 15.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 116.879 -1.928 . . . . 0.0 110.513 158.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 78.7 mm-40 -82.18 -31.4 30.43 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -66.55 -27.11 67.48 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 119.168 -2.208 . . . . 0.0 112.273 165.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -73.8 -44.5 55.67 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.045 0.841 . . . . 0.0 112.406 173.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 73.3 mt -59.85 -16.75 31.27 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 118.342 2.719 . . . . 0.0 118.342 165.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -75.17 -40.91 59.1 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 125.404 2.526 . . . . 0.0 109.17 169.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -65.51 -47.0 77.48 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.014 -3.554 . . . . 0.0 110.907 171.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 58.6 t -55.52 -53.36 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-O 116.479 -1.724 . . . . 0.0 110.236 178.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -55.43 -36.58 66.66 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 118.597 2.814 . . . . 0.0 118.597 175.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 31.3 tp -76.72 -44.78 31.93 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 113.594 -1.639 . . . . 0.0 114.132 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.01 -41.04 99.47 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 113.369 -3.205 . . . . 0.0 111.103 170.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 ttpp -53.83 -57.22 11.69 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.319 2.327 . . . . 0.0 113.42 165.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -42.81 -48.88 5.78 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 116.468 -1.729 . . . . 0.0 113.186 164.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.359 . . -58.26 -38.37 76.8 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 120.454 1.479 . . . . 0.0 114.74 175.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -59.54 -31.4 69.37 Favored 'General case' 0 N--CA 1.454 -0.268 1 O-C-N 115.045 -4.784 . . . . 0.0 111.439 174.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -86.53 -23.35 25.9 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.919 2.088 . . . . 0.0 111.672 -167.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 50.4 p30 -122.95 5.08 9.35 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.985 1.314 . . . . 0.0 108.991 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.385 11.9 m-20 74.88 25.74 1.4 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 114.529 -2.653 . . . . 0.0 117.593 176.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . 0.269 66.0 mt -96.78 5.74 50.03 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 126.456 2.348 . . . . 0.0 112.432 -172.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -80.49 -48.84 12.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.852 3.261 . . . . 0.0 111.72 -155.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 1.2 mt -50.77 -46.88 86.69 Favored Pre-proline 0 N--CA 1.451 -0.418 0 O-C-N 119.707 -1.87 . . . . 0.0 112.894 174.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.256 17.1 Cg_exo -70.23 -18.19 34.94 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 N-CA-C 117.731 2.166 . . . . 0.0 117.731 176.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 32.0 tp -77.32 -37.09 53.28 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.313 3.045 . . . . 0.0 108.886 167.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.13 -38.88 60.88 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 115.372 -2.252 . . . . 0.0 108.789 -179.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -75.43 -22.2 57.54 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 128.523 3.64 . . . . 0.0 112.312 174.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 18.6 tp -70.72 -42.98 69.87 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 115.898 -2.001 . . . . 0.0 111.338 171.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 19.8 mmt -84.74 -36.34 21.85 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 129.148 2.979 . . . . 0.0 114.846 -171.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mt -122.35 126.98 49.19 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 125.049 2.357 . . . . 0.0 109.208 -171.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 68.2 p -78.32 166.62 41.76 Favored Pre-proline 0 N--CA 1.448 -0.534 0 CA-C-N 111.2 -2.727 . . . . 0.0 113.352 -176.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_exo -59.07 -43.84 39.32 Favored 'Trans proline' 0 N--CA 1.447 -1.21 0 CA-C-N 121.575 1.598 . . . . 0.0 114.912 -162.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.274 48.7 m-20 -75.37 -17.28 60.26 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 117.558 -3.214 . . . . 0.0 109.238 -177.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -74.25 -37.52 63.74 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 124.912 2.292 . . . . 0.0 108.602 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . 0.619 ' HD2' ' CZ2' ' C' ' 19' ' ' TRP . 17.1 mtm180 -76.72 -31.07 56.91 Favored 'General case' 0 N--CA 1.45 -0.459 1 C-N-CA 132.386 4.275 . . . . 0.0 108.599 174.155 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -66.85 -38.34 86.18 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 122.566 2.439 . . . . 0.0 109.549 168.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.277 . . -79.71 -36.89 36.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 114.718 -2.563 . . . . 0.0 116.635 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 18.2 mt -61.16 -49.07 78.72 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 125.182 1.551 . . . . 0.0 114.418 164.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.37 -44.43 58.43 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 82.7 m -73.76 -23.33 59.72 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 127.212 2.205 . . . . 0.0 113.118 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -62.26 -20.69 64.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 117.428 -3.295 . . . . 0.0 115.288 166.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 43.7 t -66.59 -57.51 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 119.946 1.248 . . . . 0.0 108.216 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -69.31 -17.39 63.72 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.247 1.819 . . . . 0.0 112.837 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 31.8 mt -74.4 -44.2 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 O-C-N 118.055 -2.903 . . . . 0.0 110.803 173.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.45 -39.39 80.66 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 C-N-CA 128.274 2.63 . . . . 0.0 111.718 174.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -58.13 -49.44 76.97 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 117.931 -2.981 . . . . 0.0 109.731 176.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -70.42 -22.27 62.74 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 116.223 1.935 . . . . 0.0 116.223 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 46.1 mt -72.82 -28.51 62.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 121.44 1.927 . . . . 0.0 112.691 164.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 78.9 mt -76.53 -36.89 57.43 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 120.835 1.652 . . . . 0.0 110.239 169.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -76.94 -33.88 57.67 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.437 0.695 . . . . 0.0 111.498 -173.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 45.31 52.46 8.58 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 121.909 3.523 . . . . 0.0 121.909 176.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -127.48 -12.69 5.55 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 119.232 -2.334 . . . . 0.0 109.701 173.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 16.4 mmt -87.85 59.36 5.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.093 1.357 . . . . 0.0 109.977 164.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 1.5 p -66.23 144.72 56.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 119.94 3.311 . . . . 0.0 119.94 -171.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 49.03 -101.41 0.08 Allowed 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 128.768 2.827 . . . . 0.0 109.355 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -58.42 -37.38 75.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 115.038 -2.411 . . . . 0.0 114.785 -174.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -70.79 -38.73 73.38 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.279 1.99 . . . . 0.0 111.708 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.75 -35.6 81.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 117.992 -2.943 . . . . 0.0 112.13 169.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -76.68 -25.13 53.34 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 121.119 1.781 . . . . 0.0 115.691 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -119.85 -30.78 4.66 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 113.103 -3.332 . . . . 0.0 111.95 -171.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . 0.258 17.5 tp10 -94.99 -45.54 7.21 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 123.453 2.842 . . . . 0.0 110.899 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.87 -50.51 19.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 102.676 -3.083 . . . . 0.0 102.676 170.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 94.33 -141.28 15.47 Favored Glycine 0 N--CA 1.448 -0.506 1 CA-C-O 129.212 4.784 . . . . 0.0 118.298 153.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.61 -33.38 73.81 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.694 -2.651 . . . . 0.0 113.616 -167.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.18 -25.56 25.77 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 126.175 1.845 . . . . 0.0 116.166 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 5.2 tt -65.39 -15.29 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 119.732 1.766 . . . . 0.0 115.597 -173.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.23 -44.16 65.91 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.902 -1.047 . . . . 0.0 113.571 173.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 26.4 m -61.64 -39.63 91.99 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 170.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 45.6 mm -77.2 -34.98 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 O-C-N 120.864 -1.148 . . . . 0.0 111.131 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 70.0 p -104.01 -9.8 18.56 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 113.308 -3.234 . . . . 0.0 112.761 -174.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -96.16 -175.7 3.45 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 104.354 -2.461 . . . . 0.0 104.354 173.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 66.37 161.62 1.08 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 126.518 2.008 . . . . 0.0 112.445 -173.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 57.1 p -77.49 -22.5 51.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 116.142 1.905 . . . . 0.0 116.142 -148.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 72.0 m-80 -121.67 62.71 0.92 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 131.335 3.854 . . . . 0.0 111.093 175.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 84.0 p -85.41 175.92 8.58 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 125.821 2.724 . . . . 0.0 115.324 171.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.39 -11.56 60.28 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 118.933 -2.354 . . . . 0.0 110.977 161.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -71.22 -18.18 62.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 162.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -118.21 -23.38 7.34 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 116.947 2.202 . . . . 0.0 116.947 -165.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 42.62 85.85 0.15 Allowed Pre-proline 0 N--CA 1.449 -0.488 0 CA-C-O 124.298 1.999 . . . . 0.0 111.707 169.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' D' ' 95' ' ' GLU . 41.2 Cg_exo 20.11 45.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.123 0 O-C-N 116.84 -2.242 . . . . 0.0 114.45 51.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -58.95 -23.79 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 C-N-CA 127.363 2.265 . . . . 0.0 106.747 -175.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . 0.483 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -105.53 -27.76 11.2 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 117.31 -1.329 . . . . 0.0 109.207 -160.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 34.5 tp -60.92 -54.24 47.51 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 128.486 2.715 . . . . 0.0 107.003 152.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 43.7 ttp180 -55.34 -52.81 62.29 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 124.739 3.427 . . . . 0.0 112.857 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -56.39 -24.78 46.84 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 124.2 3.182 . . . . 0.0 115.868 172.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 84.6 t90 -85.11 -40.93 16.2 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 123.238 1.494 . . . . 0.0 112.475 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.06 -35.25 79.61 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 118.331 -2.73 . . . . 0.0 108.967 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -68.08 -4.84 14.85 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 112.635 -2.075 . . . . 0.0 114.051 176.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -119.21 -33.63 4.08 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 119.331 -0.948 . . . . 0.0 108.599 177.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 25.4 t -77.34 -36.21 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 116.169 1.915 . . . . 0.0 116.169 171.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 24.6 mt -80.24 -39.38 29.13 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 127.923 2.489 . . . . 0.0 112.659 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 15.1 mt -110.84 37.41 2.8 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 126.62 3.105 . . . . 0.0 111.622 -174.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -58.08 165.71 1.81 Allowed 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.526 -2.609 . . . . 0.0 112.113 176.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 59.6 m -44.79 -36.48 3.25 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 129.258 3.023 . . . . 0.0 114.692 173.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 . . . . . 0 C--O 1.253 1.242 0 C-N-CA 129.175 2.99 . . . . 0.0 115.48 -178.612 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 113.457 -3.163 . . . . 0.0 113.011 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -35.53 -52.0 0.65 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 124.341 3.246 . . . . 0.0 115.427 177.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -83.02 -15.1 52.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.67 2.788 . . . . 0.0 116.88 -171.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -87.57 -22.73 24.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 117.322 -1.323 . . . . 0.0 114.174 -166.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.51 159.78 52.15 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 121.284 1.856 . . . . 0.0 112.862 -172.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -81.86 -11.79 11.17 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 C-N-CA 124.715 3.61 . . . . 0.0 113.061 174.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -137.2 145.08 43.24 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.292 2.237 . . . . 0.0 114.399 165.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 33.4 t -120.93 124.3 44.6 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.895 2.078 . . . . 0.0 107.681 170.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.94 -33.27 21.21 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.027 0.931 . . . . 0.0 110.613 -177.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.88 -44.94 96.39 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 117.044 2.238 . . . . 0.0 117.044 163.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -28.15 67.94 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 117.466 -3.271 . . . . 0.0 115.403 170.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.39 -41.72 88.92 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 125.735 2.683 . . . . 0.0 114.014 171.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -71.5 -32.62 68.43 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 127.22 2.208 . . . . 0.0 112.105 171.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -60.33 -46.89 88.29 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.498 -2.001 . . . . 0.0 113.145 165.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.7 mmt-85 -70.32 -31.6 68.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 115.762 -2.066 . . . . 0.0 112.581 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.8 t60 -58.06 -50.88 71.91 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.038 -1.934 . . . . 0.0 111.796 165.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -53.53 -41.08 66.01 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.164 1.785 . . . . 0.0 113.421 174.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.254 34.7 tt0 -60.19 -49.86 75.95 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.187 1.795 . . . . 0.0 110.013 170.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -57.77 -61.07 2.78 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.394 -2.691 . . . . 0.0 117.014 172.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.8 mt -55.88 -29.17 59.56 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -175.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -47.89 -43.48 28.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 128.547 2.739 . . . . 0.0 111.023 168.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -67.15 -43.23 82.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 119.72 -1.862 . . . . 0.0 110.198 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.7 t -66.23 -36.81 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-O 113.722 -3.037 . . . . 0.0 111.171 175.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -61.99 -58.33 8.29 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.168 1.804 . . . . 0.0 109.67 168.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 36.8 tp -47.12 -54.62 10.08 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.171 -1.581 . . . . 0.0 113.17 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 36.3 tp -62.35 -39.95 94.8 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 124.137 3.153 . . . . 0.0 113.271 176.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -54.87 -35.77 64.4 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 127.003 3.287 . . . . 0.0 111.406 170.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -90.48 -6.28 55.01 Favored 'General case' 0 N--CA 1.452 -0.341 1 O-C-N 116.208 -4.057 . . . . 0.0 112.244 -177.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.0 -31.67 17.99 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 119.376 0.989 . . . . 0.0 111.961 163.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -50.95 -37.1 42.34 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.238 -2.163 . . . . 0.0 111.63 165.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -81.64 -10.46 59.41 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 121.91 2.141 . . . . 0.0 116.309 -174.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -109.76 -1.44 17.95 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.678 1.191 . . . . 0.0 113.771 172.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.442 12.4 m-20 63.94 34.52 11.51 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.822 2.049 . . . . 0.0 114.574 -175.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.6 mt -107.14 13.72 27.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.748 2.819 . . . . 0.0 113.978 174.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.3 p-80 -63.24 -60.04 3.93 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 116.091 1.886 . . . . 0.0 116.091 172.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.27 14.3 mt -59.92 -43.18 94.01 Favored Pre-proline 0 N--CA 1.449 -0.494 0 O-C-N 125.056 1.472 . . . . 0.0 112.734 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -45.46 -57.63 2.04 Favored 'Trans proline' 0 N--CA 1.448 -1.164 0 C-N-CA 123.216 2.611 . . . . 0.0 117.48 160.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.52 -40.38 92.9 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 117.605 -3.184 . . . . 0.0 117.375 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.3 mt -53.79 -35.18 61.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 115.793 -2.051 . . . . 0.0 110.434 169.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 -81.2 -10.45 59.62 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 120.789 1.631 . . . . 0.0 112.475 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.5 tt -92.68 -32.75 14.62 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 116.976 -3.578 . . . . 0.0 114.839 169.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 94.8 mmm -92.01 -17.59 24.86 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 120.065 3.358 . . . . 0.0 120.065 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.5 mt -120.6 129.83 53.92 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 169.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.9 p -70.34 154.11 94.71 Favored Pre-proline 0 N--CA 1.449 -0.481 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -49.01 -51.37 10.69 Favored 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 124.739 3.626 . . . . 0.0 119.089 -172.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.42 -9.59 58.74 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 116.863 -3.648 . . . . 0.0 115.269 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -81.92 -43.03 18.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 117.616 -3.177 . . . . 0.0 110.889 168.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 78.6 mtm-85 -54.28 -41.83 69.33 Favored 'General case' 0 N--CA 1.445 -0.693 1 O-C-N 114.666 -5.021 . . . . 0.0 112.226 171.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -65.83 -50.02 66.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 110.672 -2.967 . . . . 0.0 110.829 174.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.95 -33.6 62.49 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.953 2.101 . . . . 0.0 113.187 174.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.5 mt -88.75 -21.74 23.67 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 114.674 -2.584 . . . . 0.0 108.785 -175.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.93 -46.85 92.72 Favored Glycine 0 C--N 1.337 0.626 0 CA-C-N 121.391 1.905 . . . . 0.0 111.098 162.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.6 m -61.76 -28.67 69.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.132 -2.393 . . . . 0.0 110.462 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -60.68 -33.4 72.78 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 115.551 -2.166 . . . . 0.0 113.485 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.2 t -65.63 -40.33 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 121.592 1.996 . . . . 0.0 112.809 169.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -66.2 -23.17 66.39 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 122.641 2.473 . . . . 0.0 116.961 170.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.279 72.7 mt -64.67 -52.84 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 125.188 2.423 . . . . 0.0 109.101 168.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.4 t -68.55 -29.33 43.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-N 113.208 -1.815 . . . . 0.0 111.879 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -63.59 -44.98 92.45 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 118.604 -2.56 . . . . 0.0 112.816 174.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -83.9 -10.97 57.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -178.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 21.5 mt -78.74 -41.23 31.3 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 120.542 -1.349 . . . . 0.0 109.878 166.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.2 -43.44 17.66 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 115.475 -2.203 . . . . 0.0 107.476 -166.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -62.59 -36.97 84.41 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.317 2.261 . . . . 0.0 112.258 166.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.84 14.29 81.67 Favored Glycine 0 C--N 1.336 0.568 0 CA-C-N 122.392 2.36 . . . . 0.0 116.082 162.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -81.58 -28.58 33.75 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 129.255 3.022 . . . . 0.0 112.955 173.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.8 mtt -100.69 141.39 33.64 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 123.9 1.809 . . . . 0.0 108.399 -174.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 93.2 p -93.95 165.17 12.79 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.778 165.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -56.35 -35.48 67.71 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 125.72 2.676 . . . . 0.0 116.094 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.1 tpt85 -73.59 -21.23 60.39 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.808 -2.433 . . . . 0.0 110.532 -177.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -79.22 -42.53 25.79 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 113.911 -2.947 . . . . 0.0 110.55 166.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 57.4 mt -70.77 -18.36 62.76 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 115.612 -2.435 . . . . 0.0 114.752 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -57.25 -34.75 68.93 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.736 2.014 . . . . 0.0 111.804 169.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -90.83 -59.57 2.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.186 1.794 . . . . 0.0 107.914 167.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -62.32 -26.71 68.57 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 128.552 2.741 . . . . 0.0 117.829 -166.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.5 mt -122.82 11.35 9.68 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.393 1.877 . . . . 0.0 114.383 165.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 57.52 20.53 38.46 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 120.309 1.413 . . . . 0.0 114.26 -171.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -79.99 139.03 37.17 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.128 1.771 . . . . 0.0 114.051 -161.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.42 103.57 1.53 Allowed Glycine 0 CA--C 1.523 0.56 0 C-N-CA 127.908 2.671 . . . . 0.0 109.571 172.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 67.6 mt -37.61 -48.83 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 128.877 2.871 . . . . 0.0 112.347 -179.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.32 -34.45 74.66 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 129.731 3.212 . . . . 0.0 110.972 -172.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.3 p -65.31 -45.81 82.85 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 119.24 -2.162 . . . . 0.0 111.788 167.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.0 mm -63.64 -32.06 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 O-C-N 117.604 -3.185 . . . . 0.0 110.952 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -49.97 -52.52 33.03 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 118.645 -2.534 . . . . 0.0 115.137 165.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -59.55 -42.29 92.05 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 125.32 1.638 . . . . 0.0 110.729 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.86 -40.67 99.15 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 113.06 -1.882 . . . . 0.0 113.65 -177.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.9 m -61.74 -34.9 76.65 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 113.529 -3.129 . . . . 0.0 110.877 171.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -75.8 -30.17 58.97 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 120.771 1.623 . . . . 0.0 114.561 177.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 17.8 m -68.39 -34.97 76.99 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 115.902 -1.999 . . . . 0.0 109.967 171.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.9 tp -77.58 -45.61 24.72 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 117.255 -1.355 . . . . 0.0 111.41 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -53.76 -45.64 70.69 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 130.264 3.425 . . . . 0.0 108.262 169.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.25 -34.94 75.97 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.073 1.749 . . . . 0.0 115.302 176.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.05 171.87 4.19 Favored Pre-proline 0 N--CA 1.447 -0.614 0 O-C-N 119.496 -2.003 . . . . 0.0 113.321 -168.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . 0.317 28.5 Cg_exo -67.79 131.74 24.95 Favored 'Trans proline' 0 N--CA 1.447 -1.258 1 C-N-CA 126.847 5.032 . . . . 0.0 116.615 178.514 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 m -45.08 -39.93 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 N-CA-C 117.838 2.533 . . . . 0.0 117.838 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.1 pm0 -75.93 -31.84 59.31 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 118.26 -2.775 . . . . 0.0 110.796 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 15.7 tp -64.87 -41.95 95.24 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 112.696 -3.526 . . . . 0.0 111.394 164.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 89.1 mtm-85 -64.53 -43.47 93.91 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 126.167 2.167 . . . . 0.0 111.572 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -56.32 -20.86 20.87 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.376 2.27 . . . . 0.0 113.752 170.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -94.78 -46.26 6.98 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 127.562 3.553 . . . . 0.0 110.378 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 29.2 mt -56.32 -26.69 53.2 Favored 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 115.373 -4.579 . . . . 0.0 111.263 171.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -70.65 -24.85 62.78 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 118.11 -2.869 . . . . 0.0 117.433 170.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -101.41 -4.17 27.4 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.29 1.836 . . . . 0.0 111.968 176.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . 0.301 59.6 t -122.67 -36.66 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -170.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.2 mt -82.36 -54.83 4.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 117.866 -3.021 . . . . 0.0 115.135 165.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.7 mt -70.08 -3.89 18.63 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.747 2.019 . . . . 0.0 112.832 -167.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.264 28.9 tttt -101.5 0.37 36.51 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 129.597 3.159 . . . . 0.0 113.694 -166.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.8 p -75.37 -9.03 58.2 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 120.102 3.371 . . . . 0.0 120.102 160.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.256 1.399 0 CA-C-O 123.981 1.848 . . . . 0.0 114.367 -166.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.2 tmm? . . . . . 0 N--CA 1.472 0.664 0 CA-C-O 115.565 -2.16 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -56.72 -24.72 51.56 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 122.232 2.287 . . . . 0.0 115.566 -165.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -75.85 -36.71 59.5 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 127.259 2.224 . . . . 0.0 109.015 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -92.25 -24.05 19.12 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 124.345 1.058 . . . . 0.0 111.529 -163.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -86.98 131.59 44.41 Favored Pre-proline 0 N--CA 1.446 -0.668 0 C-N-CA 128.438 2.695 . . . . 0.0 108.578 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -81.48 0.15 10.1 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 O-C-N 115.483 -2.956 . . . . 0.0 117.081 -174.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -123.88 135.46 53.74 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 126.311 2.257 . . . . 0.0 111.32 158.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.3 t -133.66 141.81 47.77 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 120.742 -1.224 . . . . 0.0 112.651 161.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.25 -39.91 84.32 Favored 'General case' 0 N--CA 1.448 -0.571 1 O-C-N 116.255 -4.028 . . . . 0.0 116.896 172.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.89 -43.8 82.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 125.95 2.031 . . . . 0.0 111.236 175.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 36.9 mtt -69.73 -34.77 74.31 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 114.152 -2.832 . . . . 0.0 110.402 176.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.68 -40.68 93.05 Favored 'General case' 0 N--CA 1.449 -0.509 1 O-C-N 130.196 4.685 . . . . 0.0 111.766 177.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 32.1 tp10 -65.46 -29.56 70.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 126.474 3.035 . . . . 0.0 116.86 171.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -68.36 -37.99 81.0 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 125.326 2.489 . . . . 0.0 116.761 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 51.9 mmt-85 -81.34 -20.0 41.61 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 115.036 -2.411 . . . . 0.0 111.078 176.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -61.53 -57.24 12.91 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 122.502 2.41 . . . . 0.0 108.064 162.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.35 -31.68 72.98 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 123.107 2.685 . . . . 0.0 116.767 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.69 -39.25 83.93 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 117.648 2.462 . . . . 0.0 117.648 165.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 11.8 t-105 -74.69 -46.91 34.64 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.708 2.003 . . . . 0.0 107.385 175.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 83.7 mt -58.93 -17.94 29.04 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 118.105 -2.872 . . . . 0.0 114.996 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . 0.381 49.4 ttt180 -67.55 -45.04 76.79 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.172 1.789 . . . . 0.0 113.527 168.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -60.03 -39.66 86.67 Favored 'General case' 0 N--CA 1.451 -0.4 1 O-C-N 115.997 -4.189 . . . . 0.0 119.492 165.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.01 -34.14 67.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-O 122.656 1.217 . . . . 0.0 110.738 176.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -61.88 -47.91 82.86 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 116.719 -3.738 . . . . 0.0 110.771 173.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 51.6 tp -62.79 -41.58 99.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.974 1.845 . . . . 0.0 109.061 -173.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.327 14.1 tp -76.46 -28.49 56.54 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 124.003 1.859 . . . . 0.0 115.917 -178.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -62.98 -37.52 87.46 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 119.04 -2.287 . . . . 0.0 111.987 164.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -79.41 -23.29 43.33 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 119.622 -1.924 . . . . 0.0 110.727 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.49 -32.34 32.5 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -69.61 -35.79 75.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 124.107 3.14 . . . . 0.0 113.921 167.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.33 -8.97 4.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 120.469 3.507 . . . . 0.0 120.469 159.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . 0.266 65.2 m-80 -128.74 9.79 5.95 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 116.389 -3.945 . . . . 0.0 110.002 -175.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.489 5.2 m-20 55.65 9.7 0.44 Allowed 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 121.137 3.754 . . . . 0.0 121.137 -168.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.3 mt -82.04 10.0 7.41 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 113.654 -1.612 . . . . 0.0 115.078 176.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . 0.266 18.5 p-80 -61.3 -49.92 75.07 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 119.801 -1.812 . . . . 0.0 112.783 -170.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.337 54.8 mt -63.07 -55.29 38.57 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-O 115.724 -2.084 . . . . 0.0 113.679 176.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -42.23 -36.24 4.01 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 N-CA-C 118.918 2.622 . . . . 0.0 118.918 168.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 58.6 tp -87.23 -28.35 22.42 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.141 0.428 . . . . 0.0 111.291 -176.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 19.8 mt -79.9 -34.07 39.37 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 120.833 -1.167 . . . . 0.0 113.362 172.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -60.8 -42.97 98.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 113.309 -3.234 . . . . 0.0 108.032 167.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -61.89 -55.59 28.07 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 126.245 2.216 . . . . 0.0 112.14 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.0 mmt -82.85 -31.5 27.98 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 126.398 2.311 . . . . 0.0 114.759 -165.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 33.4 mt -108.3 127.13 53.59 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 104.715 -2.328 . . . . 0.0 104.715 -179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 24.3 p -69.59 157.4 89.64 Favored Pre-proline 0 N--CA 1.448 -0.538 0 C-N-CA 125.393 1.477 . . . . 0.0 113.741 172.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.67 -29.79 63.08 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 123.68 2.92 . . . . 0.0 115.721 -176.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.05 -21.04 43.91 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 125.244 1.59 . . . . 0.0 114.429 178.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -84.15 -28.11 27.65 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 169.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -70.86 -46.77 62.09 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 117.703 -3.123 . . . . 0.0 107.076 171.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -58.72 -37.61 76.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.102 1.501 . . . . 0.0 114.007 170.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.88 -45.32 95.03 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 119.666 -1.896 . . . . 0.0 114.31 169.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 12.0 mt -68.51 -43.42 76.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 117.33 -1.748 . . . . 0.0 112.426 -174.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.11 -30.27 60.54 Favored Glycine 0 CA--C 1.525 0.715 0 O-C-N 125.427 1.704 . . . . 0.0 115.485 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.6 m -73.85 -44.41 55.66 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 174.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 38.2 mtt180 -60.56 -27.9 68.04 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.064 -3.523 . . . . 0.0 110.74 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 90.9 t -41.76 -62.75 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 123.245 2.748 . . . . 0.0 114.5 162.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 -71.13 -29.09 64.81 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -166.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 19.1 mt -71.45 -44.51 71.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 C-N-CA 126.795 2.038 . . . . 0.0 112.572 177.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 93.7 t -66.76 -41.8 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 124.332 2.015 . . . . 0.0 111.232 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -52.67 -49.19 65.75 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 115.343 1.608 . . . . 0.0 115.343 168.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . 0.254 22.8 tp10 -68.35 -30.45 69.42 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 113.169 -3.3 . . . . 0.0 109.798 174.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 8.5 mt -66.58 -25.11 66.47 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 123.353 2.797 . . . . 0.0 111.568 172.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 48.4 mt -86.61 -28.68 23.11 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 124.52 1.138 . . . . 0.0 109.614 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 28.5 ttm105 -83.02 -44.86 14.74 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 118.855 2.909 . . . . 0.0 118.855 -171.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.79 64.19 3.72 Favored Glycine 0 CA--C 1.522 0.47 0 O-C-N 119.256 -2.152 . . . . 0.0 114.638 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -128.39 -36.13 1.92 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 127.298 2.239 . . . . 0.0 109.077 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 60.0 mtp -81.16 134.31 35.61 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 118.526 -2.609 . . . . 0.0 116.117 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 88.5 p -84.29 174.41 10.17 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 125.322 1.639 . . . . 0.0 113.255 168.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -64.47 -36.47 84.3 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.293 -2.129 . . . . 0.0 113.657 -169.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -72.25 -35.88 68.91 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 120.029 -1.669 . . . . 0.0 112.923 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.72 -40.75 79.79 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 113.457 -1.701 . . . . 0.0 109.051 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 87.5 mt -58.93 -61.45 2.63 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.181 2.192 . . . . 0.0 112.21 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -53.58 -50.55 65.35 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 128.342 2.657 . . . . 0.0 112.974 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -104.14 -7.44 20.18 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 128.129 3.393 . . . . 0.0 109.764 -165.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -118.47 -7.04 10.7 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 125.201 3.637 . . . . 0.0 111.466 173.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 36.4 mt -122.09 -17.24 7.28 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 113.985 -2.912 . . . . 0.0 115.316 168.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.56 16.85 78.68 Favored Glycine 0 C--N 1.336 0.533 0 CA-C-N 125.08 3.582 . . . . 0.0 119.376 -168.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -105.23 71.03 0.92 Allowed 'General case' 0 N--CA 1.447 -0.58 1 C-N-CA 132.278 4.231 . . . . 0.0 106.571 -160.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.92 179.58 44.54 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 119.805 -1.188 . . . . 0.0 115.749 172.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 51.2 mm -44.85 -51.27 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-O 115.788 -2.054 . . . . 0.0 114.089 -171.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.8 -32.02 73.39 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.272 2.323 . . . . 0.0 117.272 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 2.9 m -66.59 -43.07 85.88 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 31.4 mm -70.08 -42.25 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 130.228 3.411 . . . . 0.0 113.432 168.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 26.3 m -59.17 -51.04 71.71 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 118.284 -2.76 . . . . 0.0 109.52 172.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -63.11 -42.58 99.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 114.916 -2.469 . . . . 0.0 113.077 175.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.84 -45.16 90.05 Favored Glycine 0 CA--C 1.522 0.499 0 O-C-N 125.703 1.877 . . . . 0.0 115.779 -176.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 88.2 p -62.88 -39.85 95.72 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 164.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -68.07 -37.46 81.28 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 117.074 -3.516 . . . . 0.0 112.469 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 48.1 m -74.41 -0.75 18.34 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 171.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mt -95.77 -43.52 7.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 128.271 2.628 . . . . 0.0 116.548 167.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 54.8 tttm -68.84 -31.76 70.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 123.003 0.521 . . . . 0.0 110.698 169.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.74 -14.72 60.33 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 129.554 3.141 . . . . 0.0 117.227 166.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.38 148.36 98.71 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-N 121.599 2.0 . . . . 0.0 108.9 165.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -72.71 151.53 52.04 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 122.598 2.198 . . . . 0.0 115.308 169.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.323 31.4 m -62.71 -34.84 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 O-C-N 118.892 -2.38 . . . . 0.0 117.362 -166.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -50.62 -34.51 26.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 128.204 2.602 . . . . 0.0 111.63 172.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 7.0 tp -97.23 -38.61 9.62 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 115.952 -1.975 . . . . 0.0 108.333 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 26.0 mtp85 -47.87 -51.91 21.25 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 121.748 2.067 . . . . 0.0 111.552 171.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -62.86 -28.64 70.17 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 117.365 2.357 . . . . 0.0 117.365 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -71.26 -60.4 2.25 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.35 1.86 . . . . 0.0 110.702 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 96.4 mt -54.49 -43.79 72.09 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -66.48 -13.94 61.55 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -104.19 -8.51 19.34 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 126.478 1.911 . . . . 0.0 114.134 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 39.4 t -111.55 -43.55 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 123.38 1.562 . . . . 0.0 107.875 -177.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.96 -47.17 39.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 116.948 -3.595 . . . . 0.0 109.567 -178.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 84.0 mt -72.25 -24.25 61.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 117.75 -1.58 . . . . 0.0 112.701 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -90.25 -8.97 49.66 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 119.373 -2.08 . . . . 0.0 111.329 -178.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.3 m -71.89 -22.77 61.46 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 165.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.394 61.9 m-20 . . . . . 0 C--O 1.249 1.036 0 N-CA-C 117.117 2.266 . . . . 0.0 117.117 161.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ttt . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.61 170.36 15.93 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.454 -1.299 . . . . 0.0 113.832 172.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -130.81 149.72 52.32 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 113.485 -1.689 . . . . 0.0 108.542 177.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -121.48 153.49 37.86 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 124.155 3.161 . . . . 0.0 109.492 177.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 94.9 p -143.85 169.7 9.84 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 172.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -89.8 -27.24 0.34 Allowed 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 116.873 -1.618 . . . . 0.0 114.333 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -140.88 144.29 35.17 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 117.167 -1.397 . . . . 0.0 114.16 176.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.7 t -148.06 118.53 7.42 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 125.335 1.647 . . . . 0.0 113.243 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.71 -12.31 2.85 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 157.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.87 -40.76 95.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 123.485 2.857 . . . . 0.0 115.399 163.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 39.2 mtt -79.38 -36.98 38.4 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 124.067 1.889 . . . . 0.0 110.513 -172.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.06 -36.04 60.18 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 128.549 2.74 . . . . 0.0 112.158 175.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -79.58 -37.69 35.74 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 119.4 -2.063 . . . . 0.0 109.724 175.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -70.56 -43.79 68.77 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 120.36 1.437 . . . . 0.0 112.334 -178.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -30.69 71.59 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 119.269 -2.144 . . . . 0.0 114.09 174.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -72.78 -48.38 38.73 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 126.6 2.437 . . . . 0.0 110.964 171.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -61.47 -24.01 66.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 112.748 -3.501 . . . . 0.0 113.871 171.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -59.65 -39.01 82.98 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 123.794 2.997 . . . . 0.0 115.999 164.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -78.22 -41.3 34.8 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.067 -1.424 . . . . 0.0 110.58 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 4.8 mp -67.12 -17.69 64.98 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 119.927 -1.733 . . . . 0.0 110.715 174.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -82.98 -38.56 22.52 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 118.159 -2.838 . . . . 0.0 116.668 175.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -55.46 -38.79 69.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 113.383 -1.735 . . . . 0.0 110.405 165.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 5.6 t -70.6 -41.94 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 O-C-N 118.91 -2.369 . . . . 0.0 108.466 -177.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -72.71 -25.62 61.3 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 119.077 2.991 . . . . 0.0 119.077 176.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 49.1 tp -71.63 -40.49 69.71 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 52.7 tp -69.35 -40.28 77.61 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -44.0 -51.5 7.71 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 123.342 1.544 . . . . 0.0 114.187 178.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -79.67 -13.4 59.51 Favored 'General case' 0 N--CA 1.45 -0.425 0 O-C-N 119.311 -2.118 . . . . 0.0 113.269 -175.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.31 -28.49 61.19 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 120.977 1.717 . . . . 0.0 114.968 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -65.19 -22.97 66.97 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 117.867 -3.021 . . . . 0.0 109.598 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.79 -20.74 61.1 Favored 'General case' 0 N--CA 1.448 -0.564 1 O-C-N 113.869 -5.519 . . . . 0.0 110.947 -166.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -126.66 30.4 5.53 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 118.545 -2.597 . . . . 0.0 113.677 168.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 42.16 44.84 3.33 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 129.151 2.98 . . . . 0.0 115.262 -173.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.264 95.9 mt -93.55 -10.0 36.3 Favored 'General case' 0 N--CA 1.448 -0.549 1 C-N-CA 132.125 4.17 . . . . 0.0 109.71 172.801 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 29.4 p-80 -47.9 -41.81 25.39 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 130.947 3.699 . . . . 0.0 109.653 168.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mt -76.34 -52.35 2.37 Favored Pre-proline 0 N--CA 1.45 -0.452 1 O-C-N 115.612 -4.43 . . . . 0.0 117.074 174.181 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -49.43 -33.58 30.2 Favored 'Trans proline' 0 N--CA 1.448 -1.174 0 C-N-CA 123.751 2.967 . . . . 0.0 118.54 164.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 18.8 tp -65.74 -39.18 90.85 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.005 -2.309 . . . . 0.0 115.337 168.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 66.9 mt -84.8 -16.22 42.2 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.986 2.175 . . . . 0.0 115.422 172.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -85.38 -5.12 59.33 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 129.336 3.054 . . . . 0.0 113.816 163.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 54.7 tp -91.77 -64.59 1.1 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 116.025 -1.941 . . . . 0.0 110.971 156.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -83.46 -5.83 59.28 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 119.642 3.201 . . . . 0.0 119.642 -162.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mp -114.85 155.06 27.49 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 112.731 -2.032 . . . . 0.0 111.915 162.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 44' ' ' THR . . . . . 0.406 ' HB ' ' CD ' ' C' ' 45' ' ' PRO . 58.6 p -94.23 173.56 4.51 Favored Pre-proline 0 N--CA 1.449 -0.495 0 C-N-CA 129.965 3.306 . . . . 0.0 110.624 166.055 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . 0.406 ' CD ' ' HB ' ' C' ' 44' ' ' THR . 16.8 Cg_exo -70.91 -30.91 16.23 Favored 'Trans proline' 0 N--CA 1.451 -0.989 1 C-N-CA 125.815 4.344 . . . . 0.0 111.385 -168.109 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -43.59 97.01 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.073 2.149 . . . . 0.0 108.44 178.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -71.53 -24.12 61.89 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.132 1.373 . . . . 0.0 114.465 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 82.8 mtm-85 -80.28 -33.02 38.04 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 117.156 -3.465 . . . . 0.0 108.968 170.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -64.76 -42.77 94.89 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 123.226 1.488 . . . . 0.0 113.827 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.79 -56.58 18.79 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 128.705 2.802 . . . . 0.0 109.671 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 79.9 mt -56.6 -39.81 74.23 Favored 'General case' 0 N--CA 1.446 -0.641 1 O-C-N 116.146 -4.096 . . . . 0.0 116.823 170.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.63 -18.89 46.74 Favored Glycine 0 N--CA 1.448 -0.506 0 O-C-N 119.643 -1.91 . . . . 0.0 114.598 170.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 19.7 m -92.5 -43.54 9.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 112.945 -1.628 . . . . 0.0 110.714 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -63.68 -37.65 88.15 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.61 -2.138 . . . . 0.0 107.747 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 6.8 t -52.9 -47.49 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-N 124.332 3.242 . . . . 0.0 114.346 170.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -65.36 -38.39 89.92 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 115.68 -2.105 . . . . 0.0 114.254 173.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 20.8 mt -65.14 -45.43 94.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 123.294 2.77 . . . . 0.0 107.316 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 24.3 t -57.95 -37.87 63.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 115.503 -2.189 . . . . 0.0 112.171 167.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -70.92 -41.27 71.43 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 124.159 3.163 . . . . 0.0 113.324 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -66.48 -36.33 82.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 114.402 -2.713 . . . . 0.0 111.427 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 63.7 mt -70.94 -37.62 72.85 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 122.688 2.495 . . . . 0.0 114.276 172.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 35.8 mt -77.53 -22.23 51.44 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 114.645 -2.822 . . . . 0.0 109.9 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -67.34 -51.64 49.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.069 -2.269 . . . . 0.0 112.502 165.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.27 21.02 74.19 Favored Glycine 0 CA--C 1.521 0.429 0 O-C-N 117.824 -3.048 . . . . 0.0 118.483 177.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . 0.501 30.6 tt0 -83.48 40.35 0.72 Allowed 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 128.425 2.69 . . . . 0.0 113.995 171.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 23.2 mmt -110.42 119.19 38.39 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -173.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 85.1 p -80.75 160.06 25.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.291 -3.381 . . . . 0.0 113.46 161.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.98 -30.2 61.41 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 119.275 -2.141 . . . . 0.0 112.718 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . 0.253 35.9 ttp-105 -58.7 -45.21 90.03 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 119.966 3.321 . . . . 0.0 119.966 161.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -76.16 -29.58 57.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 126.569 2.418 . . . . 0.0 112.03 -177.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.92 -16.66 52.6 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 117.326 -3.359 . . . . 0.0 115.799 171.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -98.74 -69.58 0.76 Allowed 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 172.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -74.87 -10.92 59.96 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.618 -3.176 . . . . 0.0 113.679 -164.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -106.32 -35.57 7.11 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 120.301 1.41 . . . . 0.0 110.896 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.5 mp -88.81 -28.23 20.57 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 116.776 -1.583 . . . . 0.0 113.165 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 54.66 -122.85 26.56 Favored Glycine 0 C--N 1.336 0.577 1 C-N-CA 130.95 4.119 . . . . 0.0 114.79 -173.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.2 -23.99 37.76 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 126.121 1.768 . . . . 0.0 113.301 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.68 -14.7 77.86 Favored Glycine 0 CA--C 1.526 0.74 0 O-C-N 128.617 3.698 . . . . 0.0 117.198 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 17.4 tt -51.4 -55.94 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 155.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.31 -25.85 64.43 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 119.327 -2.108 . . . . 0.0 111.724 -177.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 1.4 m -68.92 -27.91 66.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.916 1.686 . . . . 0.0 113.171 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 19.5 mm -98.33 -36.55 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 O-C-N 125.538 1.774 . . . . 0.0 114.075 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 78.1 p -91.95 -24.33 19.3 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -170.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 71.9 mtp85 -93.6 161.09 14.49 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 130.654 3.582 . . . . 0.0 112.053 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.06 169.28 41.38 Favored Glycine 0 CA--C 1.524 0.642 0 O-C-N 118.706 -2.496 . . . . 0.0 116.879 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 25.5 m -64.26 -33.93 76.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 119.048 2.981 . . . . 0.0 119.048 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -93.78 28.66 2.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 126.649 2.468 . . . . 0.0 113.749 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 8.0 p -75.15 159.17 31.95 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.766 -2.459 . . . . 0.0 108.27 -172.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 30.3 tp -44.13 -54.7 5.35 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.833 2.453 . . . . 0.0 113.1 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -82.73 2.45 33.72 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 120.893 1.679 . . . . 0.0 112.663 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -124.03 -16.4 6.55 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.376 1.87 . . . . 0.0 113.054 -172.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.53 152.9 88.36 Favored Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 130.536 3.534 . . . . 0.0 114.822 163.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -66.01 158.98 51.44 Favored 'Trans proline' 0 N--CA 1.446 -1.295 0 O-C-N 115.515 -2.939 . . . . 0.0 117.926 -167.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 89.3 t -65.9 -43.63 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 117.948 -1.025 . . . . 0.0 108.648 -170.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.3 pm0 -60.88 -23.05 64.89 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 116.194 -1.86 . . . . 0.0 112.229 -178.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 18.3 tp -76.86 -49.71 15.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.254 1.822 . . . . 0.0 108.745 169.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 67.6 mtp180 -71.84 -42.44 66.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 118.695 -2.503 . . . . 0.0 111.208 -167.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -50.05 -50.0 49.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 128.794 2.838 . . . . 0.0 108.783 167.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 90.6 t90 -63.31 -41.25 98.91 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 127.998 3.311 . . . . 0.0 117.467 -178.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 81.3 mt -51.79 -36.67 48.54 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 117.077 -1.44 . . . . 0.0 114.349 168.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -80.94 -24.57 38.03 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.774 1.296 . . . . 0.0 113.708 172.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -71.12 -14.23 62.22 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 119.944 1.247 . . . . 0.0 111.162 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 72.9 t -112.03 -61.3 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-O 115.221 -2.324 . . . . 0.0 112.454 176.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 31.6 mt -66.05 -32.43 73.9 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 121.58 1.991 . . . . 0.0 115.398 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 84.9 mt -136.83 62.82 1.59 Allowed 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.662 1.585 . . . . 0.0 111.185 -168.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.281 15.2 pttp -98.42 173.83 6.76 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 112.262 -2.244 . . . . 0.0 112.595 -174.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 6.7 m -132.79 2.21 3.69 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 173.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 35.4 t0 . . . . . 0 C--O 1.251 1.166 0 O-C-N 117.347 -3.346 . . . . 0.0 111.646 172.846 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 6.5 ttt . . . . . 0 N--CA 1.468 0.475 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.62 165.59 35.11 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.047 1.339 . . . . 0.0 110.428 -167.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -128.82 140.51 51.67 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 118.496 -2.628 . . . . 0.0 107.683 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -143.95 125.15 14.56 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 117.339 2.348 . . . . 0.0 117.339 172.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 78.2 p -100.38 154.79 37.0 Favored Pre-proline 0 N--CA 1.452 -0.357 0 C-N-CA 125.392 1.477 . . . . 0.0 114.41 -173.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -50.18 -38.71 51.47 Favored 'Trans proline' 0 N--CA 1.446 -1.322 1 C-N-CA 125.585 4.19 . . . . 0.0 109.728 170.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -153.24 147.22 25.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 128.325 2.65 . . . . 0.0 108.889 178.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 12.7 t -92.66 140.37 29.6 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 120.382 1.446 . . . . 0.0 113.935 -175.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.6 -17.47 64.13 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 120.558 -1.339 . . . . 0.0 112.939 173.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.28 -35.74 66.21 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 120.653 -1.28 . . . . 0.0 111.194 167.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 14.8 mmm -72.01 -47.86 48.85 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 127.311 2.244 . . . . 0.0 114.193 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.97 -59.97 2.05 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.279 2.632 . . . . 0.0 112.263 169.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -67.43 -37.56 83.19 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 116.648 -1.644 . . . . 0.0 113.909 173.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -57.69 -22.54 46.68 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 121.705 2.048 . . . . 0.0 114.286 164.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER -93.88 -4.67 49.56 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 125.13 3.605 . . . . 0.0 106.74 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -90.19 -21.13 22.33 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 122.683 2.492 . . . . 0.0 114.81 153.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . 0.305 75.3 mm-40 -92.41 -36.14 13.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 123.876 1.798 . . . . 0.0 110.13 -166.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -46.6 -36.27 6.75 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 127.201 2.201 . . . . 0.0 111.807 161.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . 0.456 ' CZ3' ' CD1' ' D' ' 22' ' ' PHE 0.254 4.7 t-105 -85.14 -36.32 21.16 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 118.778 -2.451 . . . . 0.0 114.658 -177.564 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 50.7 mt -70.95 -22.75 62.17 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 120.037 -1.664 . . . . 0.0 113.05 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -66.51 -32.19 73.38 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 164.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . 0.456 ' CD1' ' CZ3' ' D' ' 19' ' ' TRP 0.297 13.8 t80 -66.76 -55.26 15.79 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 121.049 1.75 . . . . 0.0 107.728 173.86 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 61.1 t -57.83 -36.33 55.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 117.057 -1.449 . . . . 0.0 110.123 -172.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . 0.281 22.1 t70 -84.92 -28.38 25.96 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 125.745 1.618 . . . . 0.0 112.637 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 23.8 tp -66.27 -53.59 35.0 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 170.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 57.7 tp -55.33 -38.55 68.87 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 114.386 -2.721 . . . . 0.0 112.123 -178.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp -66.96 -37.35 84.12 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 127.124 2.765 . . . . 0.0 112.895 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -72.17 -29.98 64.54 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 113.535 -1.666 . . . . 0.0 113.143 171.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.3 -35.91 76.66 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 126.217 1.807 . . . . 0.0 115.591 164.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -73.39 -11.03 60.34 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 123.553 1.645 . . . . 0.0 113.734 172.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -102.36 -2.47 28.85 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 112.308 -3.71 . . . . 0.0 116.266 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 52.1 p30 -137.4 10.63 2.97 Favored 'General case' 0 N--CA 1.448 -0.55 1 O-C-N 129.228 4.08 . . . . 0.0 117.857 169.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 66.28 33.93 6.84 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 117.627 2.455 . . . . 0.0 117.627 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 20.2 mt -103.24 7.69 38.45 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.553 1.541 . . . . 0.0 111.485 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.42 -49.18 77.07 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 130.762 3.625 . . . . 0.0 112.541 174.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 18.0 mt -71.37 -45.68 13.59 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-N 122.729 2.513 . . . . 0.0 110.486 -178.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.259 82.4 Cg_exo -61.26 -32.47 90.3 Favored 'Trans proline' 0 N--CA 1.45 -1.085 1 C-N-CA 125.465 4.11 . . . . 0.0 115.982 173.745 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 34.6 tp -72.46 -45.59 58.84 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 118.836 -2.415 . . . . 0.0 110.726 174.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 11.3 mt -70.02 -27.85 65.01 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 117.575 -3.203 . . . . 0.0 112.53 176.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -76.85 -30.39 56.29 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 118.046 -2.909 . . . . 0.0 115.195 172.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 56.9 tp -57.97 -46.43 85.15 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 157.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.0 mmt -82.59 -37.7 24.68 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.064 -1.023 . . . . 0.0 112.695 -165.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 64.0 mt -114.63 137.42 51.91 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 114.691 -2.576 . . . . 0.0 111.957 -165.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 42.7 p -78.27 168.16 29.72 Favored Pre-proline 0 N--CA 1.449 -0.493 0 O-C-N 125.421 1.701 . . . . 0.0 112.342 -176.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -52.34 -32.9 53.57 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-N 123.164 2.166 . . . . 0.0 117.631 -174.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -91.49 -32.12 15.7 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 127.028 2.131 . . . . 0.0 112.805 -172.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -58.36 -39.75 80.38 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.05 1.34 . . . . 0.0 113.318 168.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 31.2 mtm-85 -64.26 -52.6 57.89 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.589 2.356 . . . . 0.0 108.491 169.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -54.28 -35.99 63.18 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 127.535 3.022 . . . . 0.0 114.082 174.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.22 -36.91 66.55 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 119.615 -1.928 . . . . 0.0 114.374 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 43.5 mt -72.15 -45.73 59.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 119.211 -2.181 . . . . 0.0 113.412 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.3 -42.41 99.77 Favored Glycine 0 C--N 1.338 0.676 0 C-N-CA 125.16 1.362 . . . . 0.0 110.572 166.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 36.2 m -60.67 -33.86 73.47 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 124.175 3.988 . . . . 0.0 114.504 169.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.4 61.2 mtt180 -52.99 -27.12 17.67 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 118.038 -2.914 . . . . 0.0 116.993 166.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 76.4 t -69.2 -50.5 52.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-O 114.75 -2.548 . . . . 0.0 107.377 175.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -68.02 -35.9 79.05 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 125.601 3.819 . . . . 0.0 110.67 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 59.4 mt -52.48 -53.8 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 120.56 1.527 . . . . 0.0 109.877 173.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 69.6 t -67.66 -44.96 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 O-C-N 117.136 -3.478 . . . . 0.0 106.234 -175.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -49.67 -41.72 43.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.043 -2.286 . . . . 0.0 116.427 168.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . 0.254 45.1 mm-40 -76.28 -24.3 54.44 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 125.802 1.939 . . . . 0.0 110.73 178.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 48.0 mt -76.74 -44.78 31.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 119.29 -2.131 . . . . 0.0 110.447 176.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . 0.261 30.6 mt -62.11 -25.79 67.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.957 1.703 . . . . 0.0 114.213 168.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 37.4 ttm180 -84.99 -41.41 15.86 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 119.924 -1.735 . . . . 0.0 111.547 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 41.03 64.71 1.21 Allowed Glycine 0 CA--C 1.522 0.478 0 C-N-CA 126.524 2.011 . . . . 0.0 116.797 -174.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -130.95 -36.81 1.33 Allowed 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 131.121 3.768 . . . . 0.0 112.457 177.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 13.4 mmt -85.37 49.08 1.68 Allowed 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 130.04 3.336 . . . . 0.0 108.322 166.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 53.3 p -69.64 165.3 21.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 124.549 2.119 . . . . 0.0 115.583 -168.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 56.62 -103.42 0.18 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 117.594 2.442 . . . . 0.0 117.594 158.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -53.44 -45.06 69.33 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 114.306 -2.759 . . . . 0.0 114.48 168.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -82.03 -40.1 22.55 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 123.682 2.946 . . . . 0.0 110.314 -166.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.63 -30.74 14.16 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 118.146 2.647 . . . . 0.0 118.146 165.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -86.2 -46.85 9.99 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 116.792 2.145 . . . . 0.0 116.792 169.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -74.74 -45.81 41.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 115.278 -2.296 . . . . 0.0 110.9 -175.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -119.0 -32.55 4.43 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 120.085 1.311 . . . . 0.0 112.788 -160.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.258 1.3 mm? -72.73 -28.85 62.89 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 116.131 -1.89 . . . . 0.0 109.24 157.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 105.68 -174.35 20.88 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-O 125.63 2.795 . . . . 0.0 106.959 151.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.254 . . -58.72 -9.2 1.61 Allowed 'General case' 0 N--CA 1.45 -0.47 1 C-N-CA 133.719 4.808 . . . . 0.0 119.596 171.2 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.87 -21.79 65.81 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 115.243 0.857 . . . . 0.0 115.243 164.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 3.7 tt -38.06 -31.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 127.031 2.132 . . . . 0.0 115.672 172.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.54 -7.25 13.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 118.283 -2.761 . . . . 0.0 114.924 -171.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 47.3 m -66.89 -44.02 81.94 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.536 150.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 15.7 mm -68.09 -35.85 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 129.164 2.986 . . . . 0.0 114.328 168.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 68.4 p -119.75 8.1 11.12 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 123.868 3.031 . . . . 0.0 116.692 -175.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.2 mtp85 -115.76 170.54 8.38 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 121.744 2.066 . . . . 0.0 113.848 149.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.11 156.12 32.38 Favored Glycine 0 C--N 1.334 0.464 0 CA-C-O 123.794 1.775 . . . . 0.0 111.659 -166.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 53.1 p -78.16 -5.91 53.17 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 -156.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -138.89 41.24 2.14 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 128.839 2.856 . . . . 0.0 109.944 169.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 12.7 p -56.67 174.51 0.15 Allowed 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 129.271 3.028 . . . . 0.0 107.586 164.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp -66.38 -24.76 66.54 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 118.021 -2.925 . . . . 0.0 111.145 174.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 36.8 tttt -76.65 0.75 19.13 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 167.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -130.86 5.32 4.58 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 115.069 -2.396 . . . . 0.0 115.09 -176.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . 0.506 ' HA ' ' C ' ' D' ' 93' ' ' PRO 0.376 . . 48.33 76.5 0.54 Allowed Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 119.252 3.056 . . . . 0.0 119.252 140.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . 0.527 ' C ' ' H ' ' D' ' 95' ' ' GLU . 76.8 Cg_exo 33.01 28.4 0.0 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.985 0 CA-C-N 123.543 2.301 . . . . 0.0 113.665 36.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 t -50.76 -21.93 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 C-N-CA 125.784 1.634 . . . . 0.0 108.781 166.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . 0.527 ' H ' ' C ' ' D' ' 93' ' ' PRO 0.333 0.0 OUTLIER -103.47 -35.92 8.17 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.948 1.699 . . . . 0.0 111.919 -169.082 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 27.4 tp -50.86 -54.24 25.6 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 117.445 -1.702 . . . . 0.0 110.031 151.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 -60.48 -46.02 91.62 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 128.582 2.753 . . . . 0.0 113.816 -169.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -75.1 -12.99 60.43 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 116.957 -3.589 . . . . 0.0 116.927 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 64.5 t90 -77.47 -48.41 17.19 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 117.144 -1.408 . . . . 0.0 110.81 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 38.9 mt -58.24 -34.68 70.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 126.742 2.526 . . . . 0.0 108.33 169.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -60.97 -31.74 71.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.298 2.239 . . . . 0.0 114.018 175.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -97.97 -23.12 15.94 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 119.681 -1.887 . . . . 0.0 112.884 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.254 49.0 t -78.19 -23.57 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 CA-C-N 121.702 2.047 . . . . 0.0 111.488 167.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 78.7 mt -120.75 -20.1 7.13 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 -163.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 67.7 mt -115.44 29.72 7.82 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.252 2.221 . . . . 0.0 107.188 166.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -52.6 167.32 0.15 Allowed 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.713 2.805 . . . . 0.0 115.704 173.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 53.8 m -40.35 -50.26 2.81 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 119.524 3.157 . . . . 0.0 119.524 -175.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 . . . . . 0 C--O 1.245 0.832 0 C-N-CA 126.055 1.742 . . . . 0.0 113.944 177.54 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.254 1.1 tmt? . . . . . 0 N--CA 1.47 0.541 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.39 -43.9 97.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 116.352 -1.785 . . . . 0.0 113.35 177.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -69.95 -9.98 56.97 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 124.699 3.409 . . . . 0.0 113.272 -175.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -106.22 -42.64 5.01 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 116.493 -3.879 . . . . 0.0 107.658 -171.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.6 m -73.32 117.44 60.35 Favored Pre-proline 0 N--CA 1.446 -0.641 0 C-N-CA 126.72 2.008 . . . . 0.0 108.643 -163.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -71.82 0.64 6.78 Favored 'Trans proline' 0 N--CA 1.449 -1.113 1 C-N-CA 127.406 5.404 . . . . 0.0 110.469 -165.078 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -155.99 151.73 27.29 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 117.711 -3.118 . . . . 0.0 112.279 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.9 t -142.36 111.62 6.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.242 1.417 . . . . 0.0 107.208 -174.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.96 -36.47 81.54 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 125.274 1.609 . . . . 0.0 113.075 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.67 -31.25 64.92 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 119.4 -2.063 . . . . 0.0 115.042 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.2 ttt -67.53 -47.12 70.81 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.004 0.922 . . . . 0.0 111.02 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -37.62 74.78 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.215 -0.902 . . . . 0.0 112.915 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -64.97 -37.19 86.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 120.027 -1.671 . . . . 0.0 110.915 166.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -55.33 -49.34 72.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 117.231 -3.418 . . . . 0.0 111.141 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -74.53 -17.84 60.69 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.769 -177.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -65.84 -49.74 67.1 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 118.914 -1.115 . . . . 0.0 110.85 168.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -70.12 -24.78 63.24 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.332 2.345 . . . . 0.0 117.332 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -67.31 -41.93 84.54 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.756 2.423 . . . . 0.0 109.808 170.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.457 ' CZ2' HG23 ' A' ' 23' ' ' VAL 0.261 3.0 t-105 -74.51 -44.1 52.86 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.977 -2.327 . . . . 0.0 113.456 174.373 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 15.4 mt -67.07 -29.27 68.99 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 117.527 -1.669 . . . . 0.0 112.061 -176.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 25.8 ttt180 -30.14 -63.05 0.14 Allowed 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 116.437 2.014 . . . . 0.0 116.437 153.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -53.95 -37.07 63.51 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 116.326 1.972 . . . . 0.0 116.326 173.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.457 HG23 ' CZ2' ' A' ' 19' ' ' TRP 0.279 2.7 t -69.51 -40.62 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 125.406 1.482 . . . . 0.0 112.282 -176.056 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -68.54 -50.68 50.13 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 116.203 -1.856 . . . . 0.0 109.329 167.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.0 tp -53.26 -40.15 64.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 123.536 2.88 . . . . 0.0 111.506 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.3 tp -76.74 -30.16 56.47 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 120.103 1.319 . . . . 0.0 111.526 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -62.74 -47.67 82.56 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 166.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -53.97 -38.81 65.39 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.38 -2.724 . . . . 0.0 111.028 165.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.406 ' HB1' HD22 ' A' ' 38' ' ' LEU . . . -75.94 -38.81 57.21 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 122.834 2.561 . . . . 0.0 110.964 -177.255 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.434 ' CD1' ' CG ' ' A' ' 35' ' ' HIS . 28.2 m-85 -67.49 -35.42 79.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 118.732 -2.48 . . . . 0.0 109.02 176.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -66.59 -10.78 49.03 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 173.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -115.8 7.22 14.52 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.384 1.073 . . . . 0.0 112.242 177.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.28 24.7 m-20 60.88 14.91 5.56 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 121.474 3.879 . . . . 0.0 121.474 -171.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.1 mt -101.03 13.49 35.03 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 119.624 -1.922 . . . . 0.0 113.648 -175.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.434 ' CG ' ' CD1' ' A' ' 30' ' ' TYR . 19.8 p-80 -55.2 -53.38 56.8 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.822 -2.423 . . . . 0.0 113.381 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.9 mt -70.09 -47.33 21.74 Favored Pre-proline 0 N--CA 1.445 -0.716 0 CA-C-N 123.547 2.885 . . . . 0.0 111.039 -178.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -41.87 -47.81 6.28 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.299 2.666 . . . . 0.0 114.524 168.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.406 HD22 ' HB1' ' A' ' 29' ' ' ALA . 27.4 tp -66.56 -55.47 15.28 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 112.887 -1.96 . . . . 0.0 113.419 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 29.0 mt -61.71 -21.92 64.9 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 119.702 1.137 . . . . 0.0 112.37 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -73.63 -31.95 63.79 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.084 1.754 . . . . 0.0 109.549 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.87 -39.48 43.19 Favored 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 133.915 4.886 . . . . 0.0 115.993 169.229 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.3 mmm -73.58 -32.13 63.97 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 129.066 2.946 . . . . 0.0 113.241 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.4 mt -127.59 120.6 28.54 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.132 1.373 . . . . 0.0 108.724 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.4 p -53.79 163.01 1.19 Allowed Pre-proline 0 N--CA 1.45 -0.465 0 CA-C-N 114.836 -1.074 . . . . 0.0 113.418 172.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -64.86 -28.11 58.92 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 CA-C-N 121.965 1.737 . . . . 0.0 115.93 -172.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -77.23 -27.2 53.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.73 2.122 . . . . 0.0 116.73 177.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -72.17 -39.56 68.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.625 1.97 . . . . 0.0 114.07 172.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.6 mtm-85 -55.96 -46.58 78.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 168.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -49.26 -54.05 18.72 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 119.568 -1.958 . . . . 0.0 113.173 169.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.31 -50.08 55.98 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 114.934 -2.46 . . . . 0.0 107.464 -172.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.9 mt -54.4 -33.42 59.28 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 124.443 3.292 . . . . 0.0 115.707 171.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.24 -47.06 92.35 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 127.928 2.68 . . . . 0.0 114.566 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.0 m -60.11 -27.3 66.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 114.857 -2.497 . . . . 0.0 112.331 163.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -81.61 -23.49 37.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 125.429 1.706 . . . . 0.0 110.795 -173.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 51.6 t -57.36 -45.22 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-O 115.795 -2.05 . . . . 0.0 107.992 167.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.29 11.6 ttt180 -63.26 -37.75 88.45 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 126.779 2.032 . . . . 0.0 110.707 173.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 28.6 mt -57.79 -42.82 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 O-C-N 117.422 -3.299 . . . . 0.0 112.358 174.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.5 t -65.19 -48.25 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 O-C-N 119.178 -2.201 . . . . 0.0 112.458 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -57.27 -47.99 80.03 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.904 1.282 . . . . 0.0 110.526 178.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -69.0 -44.15 73.37 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 115.202 -2.333 . . . . 0.0 114.623 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.1 mt -67.63 -27.13 66.63 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 120.61 1.55 . . . . 0.0 113.997 177.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 tp -77.59 -47.66 18.84 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.359 1.464 . . . . 0.0 108.915 177.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.3 ttm105 -53.96 -35.42 61.75 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 169.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.33 -9.24 14.42 Favored Glycine 0 C--N 1.334 0.45 0 C-N-CA 129.25 3.309 . . . . 0.0 117.259 169.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -60.25 -22.51 63.15 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 127.458 2.303 . . . . 0.0 116.084 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 41.4 mtt -95.4 140.83 29.72 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 126.176 1.79 . . . . 0.0 114.915 175.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.8 p -93.44 176.87 6.22 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 127.628 2.371 . . . . 0.0 109.906 174.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -69.16 -31.88 70.83 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 119.368 -2.082 . . . . 0.0 111.482 169.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.5 tpt85 -62.27 -27.52 69.07 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 167.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -90.67 -40.04 12.11 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 117.265 -1.35 . . . . 0.0 111.763 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.4 mt -63.56 -30.21 71.36 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 120.153 1.342 . . . . 0.0 109.997 176.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -56.86 -25.48 56.63 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -95.79 -54.32 3.38 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 126.2 1.8 . . . . 0.0 111.861 172.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -65.73 -47.81 74.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 118.219 -2.801 . . . . 0.0 114.439 -170.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.3 mt -108.73 -0.34 20.07 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.535 -171.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.86 21.36 73.2 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 119.841 1.2 . . . . 0.0 114.106 -171.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.08 133.1 33.64 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 116.434 2.013 . . . . 0.0 116.434 -165.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.57 129.46 9.13 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-O 114.562 -3.354 . . . . 0.0 111.601 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 83.8 mt -61.48 -17.77 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 1 O-C-N 131.356 4.798 . . . . 0.0 111.477 -164.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -77.19 -28.38 53.93 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.852 2.569 . . . . 0.0 113.361 169.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 26.4 p -84.69 -25.38 28.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 118.067 -1.453 . . . . 0.0 109.855 -173.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 51.1 mm -69.92 -43.29 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-O 113.886 -2.959 . . . . 0.0 109.619 166.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.6 m -49.75 -52.05 34.5 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 122.981 2.628 . . . . 0.0 113.347 168.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.277 42.7 ttt180 -62.45 -29.62 70.65 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 113.779 -3.01 . . . . 0.0 115.396 175.063 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.64 -36.86 41.84 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 122.216 2.28 . . . . 0.0 117.696 166.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 16.3 m -61.35 -44.35 97.33 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 114.988 -2.434 . . . . 0.0 114.223 173.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -58.27 -37.85 75.8 Favored 'General case' 0 N--CA 1.448 -0.527 1 O-C-N 129.186 4.054 . . . . 0.0 112.02 165.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 64.5 m -70.55 -35.32 73.04 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 124.083 3.129 . . . . 0.0 117.709 172.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.4 tp -69.35 -40.12 77.7 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 128.176 3.422 . . . . 0.0 113.499 170.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 18.7 tttp -59.99 -36.99 78.38 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 120.575 -1.328 . . . . 0.0 113.252 176.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.13 -13.13 58.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 172.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.55 126.36 91.42 Favored Pre-proline 0 N--CA 1.449 -0.504 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -67.63 155.73 68.91 Favored 'Trans proline' 0 N--CA 1.446 -1.281 1 C-N-CA 126.786 4.991 . . . . 0.0 108.759 -172.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . 0.396 3.1 m -68.06 -34.03 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 113.288 -1.778 . . . . 0.0 113.906 -165.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.28 13.0 pm0 -61.29 -35.46 77.38 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 170.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 43.0 tp -70.34 -44.7 67.64 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 124.525 2.107 . . . . 0.0 108.618 173.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.5 mtm180 -70.09 -29.41 66.38 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 116.733 -3.729 . . . . 0.0 114.661 -168.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -80.1 -30.45 39.16 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 117.028 2.232 . . . . 0.0 117.028 168.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 85.7 t90 -73.12 -37.16 66.77 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 169.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.99 -24.31 67.67 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.489 1.516 . . . . 0.0 114.078 174.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -80.33 -8.61 59.56 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.922 2.489 . . . . 0.0 114.883 165.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -99.34 -38.61 8.78 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 112.019 -3.848 . . . . 0.0 105.904 173.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.8 t -83.88 -57.72 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 O-C-N 127.992 3.308 . . . . 0.0 106.879 -165.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.4 mt -85.25 -30.33 23.9 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 120.413 1.46 . . . . 0.0 114.04 -158.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mt -105.86 -27.64 11.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 124.686 2.184 . . . . 0.0 108.276 -148.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.8 tttt -83.18 5.12 23.87 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 128.568 2.747 . . . . 0.0 115.994 -159.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.4 p -86.5 -18.28 32.01 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.669 2.787 . . . . 0.0 110.939 171.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.261 3.6 m-20 . . . . . 0 C--O 1.249 1.031 0 C-N-CA 129.257 3.023 . . . . 0.0 118.305 -161.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.7 tmm? . . . . . 0 N--CA 1.468 0.44 0 CA-C-O 124.478 2.085 . . . . 0.0 115.126 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.56 -8.2 53.98 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 120.325 -1.485 . . . . 0.0 114.86 -157.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -106.23 -19.5 13.69 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 117.867 2.543 . . . . 0.0 117.867 165.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . 0.283 3.8 tp-100 -72.53 -38.45 68.04 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 168.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 17.5 m -82.74 137.57 44.08 Favored Pre-proline 0 N--CA 1.449 -0.485 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 178.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -74.02 5.92 3.24 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 N-CA-C 121.214 3.505 . . . . 0.0 121.214 172.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . 0.293 48.1 t80 -134.32 145.34 48.95 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 129.892 3.277 . . . . 0.0 113.323 167.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.2 t -162.05 137.3 7.27 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 126.858 2.599 . . . . 0.0 108.618 167.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.51 -28.28 65.91 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 129.062 2.945 . . . . 0.0 108.718 -179.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.93 -37.12 62.12 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 124.564 2.126 . . . . 0.0 108.332 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 21.7 mmt -74.32 -24.81 59.26 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 117.674 -3.141 . . . . 0.0 108.936 -178.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.94 -42.86 56.85 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 120.305 -1.497 . . . . 0.0 109.837 171.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -62.02 -40.56 96.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.075 1.75 . . . . 0.0 111.022 177.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -65.8 -39.25 90.75 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.577 2.351 . . . . 0.0 108.79 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -86.38 -14.54 43.15 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 118.027 -2.921 . . . . 0.0 112.824 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -51.7 -47.7 63.83 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 121.025 1.739 . . . . 0.0 114.757 149.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -64.68 -44.83 89.07 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 118.354 -2.716 . . . . 0.0 110.605 -177.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -53.94 -45.88 71.4 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.702 1.601 . . . . 0.0 112.425 174.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 28.0 t-105 -64.26 -58.91 5.19 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 170.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 73.8 mt -51.78 -25.84 8.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 116.721 -1.609 . . . . 0.0 110.651 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -65.08 -31.93 73.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 174.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -67.43 -53.84 25.56 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 121.048 1.749 . . . . 0.0 109.941 165.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 29.7 t -46.11 -38.57 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 117.495 2.405 . . . . 0.0 117.495 171.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -75.07 -52.49 10.91 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.106 2.162 . . . . 0.0 106.61 171.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 46.2 tp -59.27 -34.08 71.83 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 124.891 3.496 . . . . 0.0 112.083 -175.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 27.8 tp -72.76 -37.58 67.62 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 114.503 -2.665 . . . . 0.0 115.39 173.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -65.14 -39.03 92.47 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 121.098 1.772 . . . . 0.0 113.363 176.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -71.59 -34.7 70.11 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 127.011 2.125 . . . . 0.0 108.484 173.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.51 -26.22 65.34 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 121.938 2.154 . . . . 0.0 113.098 175.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -70.77 -28.08 64.41 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.138 -2.226 . . . . 0.0 110.267 173.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -71.59 -13.08 61.66 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -123.55 -1.22 8.56 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 118.214 -2.804 . . . . 0.0 112.194 -172.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.332 0.3 OUTLIER 70.66 8.69 6.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.063 2.545 . . . . 0.0 116.556 -172.522 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.44 3.89 26.36 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 119.566 -1.959 . . . . 0.0 111.905 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -54.49 -47.86 72.53 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 177.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 27.8 tp -65.16 -61.9 5.47 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-O 116.167 -1.873 . . . . 0.0 111.23 -178.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -55.95 -31.47 81.96 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 CA-C-N 124.338 2.585 . . . . 0.0 118.687 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 46.5 tp -70.39 -42.11 72.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 113.623 -3.084 . . . . 0.0 114.22 170.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 21.8 mt -69.47 -33.59 73.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 123.403 2.819 . . . . 0.0 111.576 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -70.56 -26.88 63.75 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 125.144 1.528 . . . . 0.0 112.332 171.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . 0.282 11.7 tp -75.38 -33.48 61.03 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 116.543 -3.848 . . . . 0.0 115.277 164.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 24.4 mmt -84.2 -26.76 28.51 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -170.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 38.7 mt -122.82 136.92 55.03 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 124.242 0.964 . . . . 0.0 109.452 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 59.7 p -68.03 155.78 91.16 Favored Pre-proline 0 N--CA 1.447 -0.601 0 O-C-N 120.05 -1.656 . . . . 0.0 108.926 174.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -47.11 -38.84 25.43 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 122.886 2.391 . . . . 0.0 113.894 174.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -66.91 -45.41 78.05 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 115.592 -2.147 . . . . 0.0 114.902 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -64.1 -38.73 92.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 125.91 2.006 . . . . 0.0 115.118 171.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 42.2 mtm-85 -64.96 -37.95 89.35 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.052 -2.28 . . . . 0.0 111.595 170.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -69.46 -31.26 69.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 173.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.04 -62.42 1.71 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 114.622 -2.608 . . . . 0.0 109.218 170.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 7.2 mt -53.5 -35.7 60.9 Favored 'General case' 0 N--CA 1.447 -0.59 0 O-C-N 127.965 3.291 . . . . 0.0 117.548 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.17 -28.87 70.95 Favored Glycine 0 CA--C 1.522 0.494 0 O-C-N 125.446 1.716 . . . . 0.0 113.485 168.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.7 m -72.87 -34.72 66.91 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.716 -2.638 . . . . 0.0 110.099 166.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . 0.416 ' HA ' ' HB ' ' B' ' 57' ' ' ILE . 95.4 mtt180 -69.79 -18.67 63.49 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 112.634 -3.555 . . . . 0.0 114.804 174.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.38 -59.15 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 122.145 2.248 . . . . 0.0 109.882 157.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -55.42 -34.71 64.67 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 122.437 2.381 . . . . 0.0 116.81 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.416 ' HB ' ' HA ' ' B' ' 54' ' ' ARG 0.347 45.1 mt -57.11 -70.09 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 124.763 2.22 . . . . 0.0 108.678 173.556 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 57.6 t -54.52 -38.15 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 125.382 1.473 . . . . 0.0 112.29 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -65.46 -39.48 92.03 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 119.32 3.082 . . . . 0.0 119.32 169.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -74.38 -31.55 62.41 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 119.533 -1.979 . . . . 0.0 111.096 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 3.6 mt -55.47 -33.77 63.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.442 1.897 . . . . 0.0 113.227 168.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . 0.284 73.3 mt -85.52 -45.84 11.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 116.384 -1.77 . . . . 0.0 108.625 174.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.319 5.0 ttm105 -62.17 -64.3 0.97 Allowed 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 130.035 3.334 . . . . 0.0 110.79 -169.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.91 44.87 13.19 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 119.375 2.51 . . . . 0.0 119.375 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -106.63 -36.48 6.72 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 112.538 -1.831 . . . . 0.0 115.075 168.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 52.2 mtt -70.77 145.6 50.32 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 116.836 2.162 . . . . 0.0 116.836 -173.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 83.3 p -78.46 161.59 26.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 119.77 -1.831 . . . . 0.0 112.738 164.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -68.25 -20.15 64.78 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 119.345 -2.097 . . . . 0.0 108.665 -175.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -64.26 -45.09 89.62 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 115.093 -2.384 . . . . 0.0 113.083 164.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -62.3 -36.94 83.69 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 125.173 1.545 . . . . 0.0 113.059 177.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 91.3 mt -73.01 -51.81 16.8 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.43 1.492 . . . . 0.0 113.554 173.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 18.0 tptp -65.92 -46.14 79.33 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 119.443 -2.036 . . . . 0.0 110.892 -174.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -100.93 -17.53 16.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 124.177 0.923 . . . . 0.0 111.004 -164.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . 0.296 34.9 mt-10 -121.92 -16.25 7.64 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 115.613 -2.137 . . . . 0.0 111.432 -172.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 81.7 mt -112.04 -5.03 14.32 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 117.589 2.44 . . . . 0.0 117.589 162.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.63 21.65 69.18 Favored Glycine 0 C--N 1.334 0.467 0 O-C-N 124.433 1.083 . . . . 0.0 111.758 -177.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -111.9 108.32 17.65 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.617 -0.931 . . . . 0.0 112.131 -172.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.5 -176.19 51.26 Favored Glycine 0 CA--C 1.523 0.558 0 O-C-N 126.374 2.296 . . . . 0.0 109.606 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 26.8 mm -53.68 -46.02 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-O 125.925 2.774 . . . . 0.0 112.833 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.38 -23.94 54.1 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 117.643 -3.16 . . . . 0.0 110.12 -171.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 5.6 m -79.1 -35.47 42.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 125.696 1.873 . . . . 0.0 109.919 177.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 38.5 mm -74.77 -52.03 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 C-N-CA 130.884 3.674 . . . . 0.0 110.549 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 30.9 m -57.61 -37.98 74.17 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 130.095 3.358 . . . . 0.0 113.34 173.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -66.75 -47.09 73.32 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.997 -1.001 . . . . 0.0 111.531 169.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -54.64 -36.97 59.98 Favored Glycine 0 CA--C 1.521 0.466 0 O-C-N 119.121 -2.237 . . . . 0.0 114.83 166.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 24.2 p -72.47 -29.19 63.43 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.223 1.011 . . . . 0.0 110.24 -178.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -70.77 -44.59 66.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.475 1.51 . . . . 0.0 114.821 166.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 70.5 m -57.85 -34.63 69.93 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 115.072 1.508 . . . . 0.0 115.072 177.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 16.8 mt -60.89 -24.64 66.13 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 127.599 3.062 . . . . 0.0 111.598 168.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -93.8 -43.35 8.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.697 1.999 . . . . 0.0 111.353 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.35 -1.21 1.56 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.398 1.879 . . . . 0.0 115.328 162.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.16 149.76 50.7 Favored Pre-proline 0 N--CA 1.447 -0.585 0 O-C-N 119.708 -1.87 . . . . 0.0 110.287 174.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -60.47 144.61 99.53 Favored 'Trans proline' 0 N--CA 1.448 -1.204 0 C-N-CA 122.857 2.371 . . . . 0.0 112.658 164.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 25.2 m -67.92 -23.72 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -178.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -68.84 -4.68 17.17 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 117.852 -3.03 . . . . 0.0 114.308 166.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 15.0 tp -99.5 -35.61 9.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 120.726 1.603 . . . . 0.0 110.338 170.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 57.9 mtp85 -54.55 -41.29 69.59 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 130.9 3.68 . . . . 0.0 113.959 173.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -74.44 -42.41 59.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.158 2.183 . . . . 0.0 110.409 167.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -52.81 -36.82 59.01 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 116.362 -1.78 . . . . 0.0 114.244 178.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 21.0 mt -83.76 -35.27 24.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.081 1.753 . . . . 0.0 113.606 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -61.91 -31.54 71.86 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 171.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -103.1 -15.49 16.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 125.493 1.746 . . . . 0.0 115.378 -175.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 53.9 t -85.1 -54.21 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 128.668 2.787 . . . . 0.0 110.879 167.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 14.0 mt -78.11 -44.36 26.34 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 116.886 2.18 . . . . 0.0 116.886 -168.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 88.3 mt -76.67 -22.72 53.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 127.308 2.88 . . . . 0.0 111.07 -169.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -86.58 -4.7 59.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 128.704 2.802 . . . . 0.0 112.255 170.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 17.6 m -104.49 3.57 32.17 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.304 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 19.1 t70 . . . . . 0 C--O 1.251 1.139 0 C-N-CA 128.704 2.802 . . . . 0.0 114.203 178.444 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ttt . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.86 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.275 . . -72.33 154.43 40.95 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 127.45 2.969 . . . . 0.0 113.35 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -126.94 145.74 50.57 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 126.193 1.797 . . . . 0.0 110.414 -177.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -121.14 126.17 49.06 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.935 1.294 . . . . 0.0 112.228 171.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 5' ' ' SER . . . . . 0.436 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 58.5 p -136.82 142.3 38.25 Favored Pre-proline 0 N--CA 1.445 -0.725 0 C-N-CA 128.117 2.567 . . . . 0.0 109.225 -179.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' C' ' 5' ' ' SER . 53.3 Cg_exo -64.88 -14.99 48.12 Favored 'Trans proline' 0 N--CA 1.451 -1.013 0 N-CA-C 120.157 3.099 . . . . 0.0 120.157 -164.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -140.97 147.76 39.26 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.125 1.37 . . . . 0.0 114.29 176.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 9.1 t -140.84 133.65 28.98 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.222 1.963 . . . . 0.0 108.527 164.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.52 -25.05 53.75 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 111.981 -2.372 . . . . 0.0 113.576 173.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.19 -29.36 34.61 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 119.381 -2.074 . . . . 0.0 110.096 178.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 39.8 mtt -66.07 -38.32 88.0 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.174 2.19 . . . . 0.0 112.284 169.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.17 84.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 117.441 2.386 . . . . 0.0 117.441 164.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -73.01 -35.48 66.81 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 125.533 1.771 . . . . 0.0 106.467 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -63.51 -44.92 92.91 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.514 2.042 . . . . 0.0 116.514 166.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -32.33 73.83 Favored 'General case' 0 N--CA 1.448 -0.547 1 O-C-N 116.141 -4.099 . . . . 0.0 107.973 177.066 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -68.0 -54.09 21.08 Favored 'General case' 0 N--CA 1.453 -0.292 1 O-C-N 115.628 -4.42 . . . . 0.0 111.416 173.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.275 67.0 mm-40 -54.44 -35.78 63.35 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 114.867 1.432 . . . . 0.0 114.867 172.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -64.58 -35.04 79.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 172.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 -71.16 -37.51 72.23 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 124.257 1.98 . . . . 0.0 108.383 177.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . 0.285 9.7 mp -67.09 -16.87 64.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.628 177.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -93.31 -31.41 14.69 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 114.099 -2.857 . . . . 0.0 113.377 178.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -64.06 -33.9 76.81 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 126.518 2.386 . . . . 0.0 109.008 168.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.284 11.1 t -60.99 -44.31 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 O-C-N 118.562 -2.586 . . . . 0.0 114.917 168.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -71.7 -32.3 67.68 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 126.623 2.452 . . . . 0.0 117.229 -174.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 50.0 tp -68.37 -50.61 51.92 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 118.482 -1.287 . . . . 0.0 108.599 173.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 61.7 tp -57.23 -37.2 71.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 120.544 -1.347 . . . . 0.0 110.461 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -47.67 -55.66 8.94 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.789 2.436 . . . . 0.0 111.849 173.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -74.87 -25.13 58.74 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.192 -2.813 . . . . 0.0 107.57 -177.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.5 -26.12 68.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 118.818 2.896 . . . . 0.0 118.818 -175.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -64.01 -41.33 97.49 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 122.745 1.259 . . . . 0.0 114.343 171.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -61.34 -36.5 80.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.072 -1.422 . . . . 0.0 111.551 -174.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . 0.312 29.6 p-10 -108.29 9.31 27.95 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.13 2.172 . . . . 0.0 116.756 173.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.535 5.0 m-20 61.21 28.45 18.05 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 117.065 -3.522 . . . . 0.0 120.507 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.02 4.13 35.33 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 116.654 2.094 . . . . 0.0 116.654 165.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -67.59 -43.31 80.84 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 122.08 2.218 . . . . 0.0 115.212 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 80.6 mt -65.92 -50.21 54.12 Favored Pre-proline 0 N--CA 1.45 -0.432 0 O-C-N 117.747 -3.096 . . . . 0.0 112.449 166.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -42.82 -49.4 6.78 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 CA-C-N 124.176 2.527 . . . . 0.0 118.205 162.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 19.8 tp -63.36 -40.62 97.77 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.318 66.8 mt -70.77 -8.4 52.05 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 118.329 -2.732 . . . . 0.0 115.514 174.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -107.96 -1.49 20.58 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 130.997 3.719 . . . . 0.0 111.32 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 12.3 tp -104.98 -48.05 3.84 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 120.814 -1.179 . . . . 0.0 113.194 166.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 87.5 mmm -78.29 -2.53 38.41 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -170.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mp -138.75 154.84 48.56 Favored 'General case' 0 N--CA 1.452 -0.342 1 O-C-N 115.877 -4.264 . . . . 0.0 107.663 -172.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 54.6 p -79.67 160.25 69.94 Favored Pre-proline 0 N--CA 1.449 -0.521 0 C-N-CA 129.791 3.236 . . . . 0.0 112.655 163.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -48.52 -43.35 33.43 Favored 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 122.811 2.341 . . . . 0.0 114.907 169.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -40.35 94.9 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 118.091 -2.881 . . . . 0.0 108.717 175.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -66.94 -35.32 79.72 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 123.686 2.948 . . . . 0.0 113.346 -176.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 82.3 mtm-85 -64.8 -31.36 72.56 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 127.608 3.575 . . . . 0.0 115.132 165.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.78 -30.0 45.33 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 111.882 -2.417 . . . . 0.0 105.521 -172.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.46 -37.05 77.15 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 123.485 1.612 . . . . 0.0 114.613 175.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 68.6 mt -74.91 -25.63 59.05 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 117.724 2.49 . . . . 0.0 117.724 167.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.11 -45.88 94.49 Favored Glycine 0 CA--C 1.526 0.751 0 O-C-N 118.837 -2.414 . . . . 0.0 111.87 164.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 58.3 m -60.98 -57.16 13.8 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 130.249 3.42 . . . . 0.0 109.412 174.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.38 26.9 mtt180 -60.59 -31.37 70.52 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.025 -1.047 . . . . 0.0 113.452 -170.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 46.8 t -67.97 -45.47 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.251 0.62 . . . . 0.0 110.088 174.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.76 -1.96 6.27 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.549 -2.594 . . . . 0.0 115.329 171.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 53.1 mt -99.49 -34.13 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 120.557 1.526 . . . . 0.0 110.328 173.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 77.5 t -69.85 -41.49 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 117.592 -3.192 . . . . 0.0 113.852 172.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -64.02 -42.66 97.06 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 122.494 1.14 . . . . 0.0 111.944 176.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -64.34 -24.6 67.7 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 170.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 97.0 mt -90.73 -17.34 26.88 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 63.5 mt -84.81 -41.08 16.44 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.881 2.472 . . . . 0.0 111.482 163.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 29.7 ttm105 -61.88 -41.85 98.35 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 126.228 2.918 . . . . 0.0 112.373 175.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.35 12.99 61.96 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 119.682 2.633 . . . . 0.0 119.682 172.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -73.28 -31.49 64.09 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 118.442 -2.799 . . . . 0.0 111.604 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 17.3 mmt -72.04 141.53 49.29 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 126.503 3.049 . . . . 0.0 110.585 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 53.8 p -114.1 169.01 9.33 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 111.466 -2.606 . . . . 0.0 113.833 -171.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -43.43 -33.91 1.18 Allowed 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 126.668 2.48 . . . . 0.0 116.606 -170.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 26.2 ttp-105 -72.37 -51.68 19.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 126.252 1.821 . . . . 0.0 109.468 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -69.37 -40.78 77.24 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 128.523 2.729 . . . . 0.0 112.414 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 91.1 mt -52.28 -21.46 3.5 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 117.233 2.309 . . . . 0.0 117.233 167.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -106.16 -42.79 4.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 120.322 -1.486 . . . . 0.0 110.949 166.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -88.16 -8.21 55.72 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 120.927 -1.108 . . . . 0.0 112.788 -165.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -129.71 -47.31 1.15 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 116.185 -1.864 . . . . 0.0 114.342 -177.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 mp -64.71 -28.3 69.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 120.164 1.347 . . . . 0.0 111.336 163.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 57.09 -151.6 26.35 Favored Glycine 0 N--CA 1.447 -0.595 0 N-CA-C 117.214 1.645 . . . . 0.0 117.214 -168.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.03 -20.84 55.42 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 116.491 -3.947 . . . . 0.0 114.981 -168.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.32 -5.1 26.63 Favored Glycine 0 C--N 1.337 0.599 0 O-C-N 126.958 2.661 . . . . 0.0 115.618 -178.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 16.5 tt -64.4 -31.87 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 O-C-N 117.601 -3.293 . . . . 0.0 110.468 170.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.15 -18.44 36.72 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 122.326 2.33 . . . . 0.0 114.142 -177.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 55.1 m -73.99 -26.8 60.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.269 2.228 . . . . 0.0 112.841 170.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 24.4 mm -98.13 -6.39 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 O-C-N 117.134 -3.479 . . . . 0.0 110.954 178.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 80.8 p -125.01 4.95 7.96 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 118.584 -2.573 . . . . 0.0 116.586 -166.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -127.66 149.09 50.36 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.399 0.68 . . . . 0.0 111.952 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.61 178.15 42.55 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-O 117.194 -1.892 . . . . 0.0 114.77 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 18.4 m -71.16 -15.56 62.49 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 118.045 2.609 . . . . 0.0 118.045 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -96.15 -7.3 36.22 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 120.524 3.528 . . . . 0.0 120.524 170.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 8.4 p -42.96 158.71 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 123.209 1.48 . . . . 0.0 114.277 175.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 57.5 tp -54.59 -38.24 66.5 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 130.536 3.534 . . . . 0.0 109.119 -167.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -99.3 -1.15 39.7 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 122.126 2.239 . . . . 0.0 113.077 -175.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -116.4 -13.21 11.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.322 -0.853 . . . . 0.0 112.656 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.29 155.76 6.54 Favored Pre-proline 0 N--CA 1.454 -0.257 0 C-N-CA 126.628 1.971 . . . . 0.0 113.896 171.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.28 149.86 83.27 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.12 1.88 . . . . 0.0 112.73 178.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 29.3 t -65.88 -46.61 88.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 126.105 1.762 . . . . 0.0 109.614 -172.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -62.29 -25.85 68.08 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 113.172 -3.299 . . . . 0.0 117.684 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 15.8 tp -66.55 -48.37 69.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 125.793 1.933 . . . . 0.0 109.377 163.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -63.95 -51.01 66.35 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.355 -165.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -60.15 -29.76 68.86 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.819 2.048 . . . . 0.0 116.236 168.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.7 t90 -78.25 -30.11 48.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 122.384 2.357 . . . . 0.0 108.673 -177.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 16.2 mt -63.77 -40.54 96.93 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 116.815 -1.564 . . . . 0.0 115.121 177.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -70.18 -18.32 63.19 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 127.522 2.329 . . . . 0.0 111.552 177.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -85.7 -28.16 24.84 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 115.359 -2.258 . . . . 0.0 116.158 167.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 17.4 t -96.42 -51.03 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.99 2.632 . . . . 0.0 112.803 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 85.1 mt -76.58 -23.63 53.49 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.101 -175.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 71.6 mt -128.91 29.48 5.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.102 1.761 . . . . 0.0 110.494 -168.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -53.55 131.82 39.22 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 128.08 3.8 . . . . 0.0 117.518 -174.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 70.3 m -100.92 -27.19 13.44 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 117.308 -3.37 . . . . 0.0 113.269 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 29.8 t70 . . . . . 0 C--O 1.253 1.278 0 CA-C-N 120.844 1.656 . . . . 0.0 108.521 -167.81 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 11.4 ttt . . . . . 0 N--CA 1.471 0.587 0 CA-C-O 117.19 -1.386 . . . . 0.0 114.318 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -156.36 145.03 20.09 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -168.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . 0.252 4.6 tt0 -119.23 139.88 51.14 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.382 1.473 . . . . 0.0 110.49 171.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -130.88 150.53 52.0 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 116.705 -1.616 . . . . 0.0 109.922 175.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 59.7 p -103.14 168.03 9.36 Favored Pre-proline 0 N--CA 1.451 -0.388 0 C-N-CA 126.037 1.735 . . . . 0.0 111.292 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . 0.329 89.5 Cg_endo -78.74 -18.42 11.83 Favored 'Trans proline' 0 N--CA 1.45 -1.049 1 C-N-CA 126.943 5.095 . . . . 0.0 118.774 -166.822 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -154.87 129.69 9.35 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.638 3.175 . . . . 0.0 106.513 156.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.9 t -64.81 124.74 22.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 118.432 2.752 . . . . 0.0 118.432 -174.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.82 -42.54 58.41 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 128.033 2.533 . . . . 0.0 110.37 166.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.38 -27.08 65.92 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.294 -2.129 . . . . 0.0 111.979 177.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.298 9.2 mmt -66.57 -49.09 67.55 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 112.956 -3.402 . . . . 0.0 113.882 161.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.14 -36.52 51.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 125.842 2.734 . . . . 0.0 115.126 175.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 35.7 tp10 -76.04 -47.9 22.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 116.406 -1.759 . . . . 0.0 108.899 174.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -55.55 -44.23 76.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 128.682 2.793 . . . . 0.0 110.668 176.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . 0.419 HH21 ' CD ' ' D' ' 18' ' ' GLU . 0.0 OUTLIER -64.66 -37.06 86.28 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.324 -2.735 . . . . 0.0 115.372 173.651 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -57.56 -45.39 85.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 119.809 1.186 . . . . 0.0 114.199 165.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -74.99 -35.04 62.04 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.639 -1.913 . . . . 0.0 114.305 -175.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . 0.419 ' CD ' HH21 ' D' ' 15' ' ' ARG . 79.0 mt-10 -62.0 -21.28 64.73 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 116.189 -1.862 . . . . 0.0 113.924 163.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -89.33 -26.72 20.95 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 127.22 2.825 . . . . 0.0 113.104 172.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 20.4 mt -69.61 -30.23 67.93 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 123.788 1.756 . . . . 0.0 113.607 172.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 37.7 ttt180 -71.51 -24.79 62.03 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.317 -2.115 . . . . 0.0 112.261 168.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -74.06 -56.45 4.92 Favored 'General case' 0 N--CA 1.453 -0.318 1 O-C-N 115.746 -4.346 . . . . 0.0 108.972 167.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 23.4 t -58.76 -37.82 68.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 121.527 1.967 . . . . 0.0 114.476 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -61.19 -39.4 90.03 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 124.76 1.288 . . . . 0.0 114.442 166.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 16.6 tp -67.44 -41.67 84.38 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 119.937 -1.727 . . . . 0.0 112.466 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 55.0 tp -63.07 -49.36 74.8 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 113.53 -3.128 . . . . 0.0 112.07 171.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -48.91 -55.7 11.0 Favored 'General case' 0 N--CA 1.451 -0.389 1 CA-C-N 126.978 4.445 . . . . 0.0 111.561 167.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -52.81 -30.84 35.65 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 121.294 1.861 . . . . 0.0 112.655 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.88 -34.06 62.16 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 123.126 1.441 . . . . 0.0 112.746 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -68.78 -4.93 17.9 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.109 -3.494 . . . . 0.0 115.233 163.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -104.94 -6.97 19.63 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 117.347 -3.345 . . . . 0.0 113.054 176.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 50.2 p30 -132.97 9.75 4.18 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 128.251 2.62 . . . . 0.0 114.016 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.38 7.1 m-20 67.35 6.76 5.07 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 116.555 2.058 . . . . 0.0 116.555 173.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 32.1 mt -77.68 16.24 0.7 Allowed 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 116.484 -3.885 . . . . 0.0 115.2 166.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -81.19 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.872 2.469 . . . . 0.0 114.059 171.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 14.3 mt -48.58 -30.12 1.95 Allowed Pre-proline 0 N--CA 1.447 -0.615 0 O-C-N 116.613 -3.804 . . . . 0.0 114.085 -176.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -68.13 -48.17 1.42 Allowed 'Trans proline' 0 N--CA 1.447 -1.241 0 O-C-N 114.412 -3.52 . . . . 0.0 116.095 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . 0.261 63.6 tp -48.97 -50.74 34.15 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 116.558 -1.687 . . . . 0.0 108.713 170.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 2.8 mt -66.54 -39.32 88.5 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 113.69 -3.052 . . . . 0.0 106.299 -172.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 -84.22 -17.26 40.44 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 115.587 -2.149 . . . . 0.0 114.119 -176.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 39.9 tp -65.72 -54.5 26.49 Favored 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 125.01 1.444 . . . . 0.0 108.379 161.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 1.7 mmt -68.1 -39.52 82.81 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.101 -1.428 . . . . 0.0 108.43 -168.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 37.3 mt -119.59 137.32 53.93 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 -165.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 8.0 p -73.85 153.75 89.07 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-N 114.057 -1.429 . . . . 0.0 112.757 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -48.99 -37.15 36.66 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 124.97 3.78 . . . . 0.0 120.496 -174.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.365 24.5 m-20 -72.39 -23.16 61.07 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 115.069 -2.396 . . . . 0.0 111.189 176.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -85.1 -32.03 23.03 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 15.7 mtm180 -75.8 -37.1 59.46 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.597 1.559 . . . . 0.0 110.6 173.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -54.83 -47.21 74.4 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 129.401 3.081 . . . . 0.0 107.76 170.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.46 -46.18 80.86 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -178.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.71 -42.76 95.05 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 116.141 -1.885 . . . . 0.0 113.4 174.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.76 -27.07 65.97 Favored Glycine 0 C--N 1.338 0.643 0 CA-C-N 120.307 1.412 . . . . 0.0 116.063 167.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 95.7 m -82.99 -35.48 25.84 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 117.052 -3.617 . . . . 0.0 110.94 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -60.71 -33.39 72.81 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 116.841 -3.662 . . . . 0.0 108.519 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 43.9 t -64.27 -36.11 76.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 123.738 2.972 . . . . 0.0 114.124 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -80.56 -32.28 36.66 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 115.973 -1.965 . . . . 0.0 114.52 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 82.7 mt -49.0 -48.75 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 116.612 -1.661 . . . . 0.0 113.568 160.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 75.3 t -68.99 -43.77 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 O-C-N 124.578 1.174 . . . . 0.0 109.835 -178.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -59.13 -40.02 84.16 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -67.04 -25.86 66.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 116.213 -1.851 . . . . 0.0 112.35 175.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 mt -72.96 -13.35 61.22 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 122.152 2.251 . . . . 0.0 112.169 173.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 85.5 mt -111.85 -18.96 12.57 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 117.393 -1.289 . . . . 0.0 113.759 176.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 ttm105 -69.85 -47.49 62.46 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 162.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 44.55 66.02 1.54 Allowed Glycine 0 CA--C 1.52 0.381 0 C-N-CA 126.285 1.898 . . . . 0.0 110.156 -173.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -130.67 -29.78 1.91 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.023 0.929 . . . . 0.0 112.282 164.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 22.2 mmt -81.02 69.35 7.6 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 125.213 2.435 . . . . 0.0 108.342 165.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 89.6 p -79.16 145.68 33.55 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.593 1.957 . . . . 0.0 111.243 -162.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 56.55 -88.17 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.125 -2.307 . . . . 0.0 115.927 156.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -72.54 -33.46 66.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 169.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -64.66 -42.72 95.2 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.94 -41.09 77.62 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.58 1.8 . . . . 0.0 112.517 174.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 58.1 mtmt -77.71 -37.31 49.77 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 125.09 1.493 . . . . 0.0 112.088 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -83.34 -56.3 3.84 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 121.692 2.042 . . . . 0.0 111.441 -177.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -93.95 -38.69 11.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 125.126 1.516 . . . . 0.0 113.128 -162.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -90.21 -24.06 21.1 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.258 -1.353 . . . . 0.0 108.152 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 74.58 -153.76 46.38 Favored Glycine 0 C--N 1.335 0.52 0 O-C-N 118.356 -2.715 . . . . 0.0 118.187 141.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -34.83 -65.02 0.23 Allowed 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 129.228 3.011 . . . . 0.0 113.71 -165.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.73 -1.7 2.9 Favored Glycine 0 C--N 1.339 0.701 0 O-C-N 126.412 2.32 . . . . 0.0 116.851 -174.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 2.2 tt -47.53 -34.69 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 122.549 3.175 . . . . 0.0 111.181 164.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -91.63 -20.78 21.26 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 119.388 -2.07 . . . . 0.0 110.266 -169.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 81.9 m -65.55 -46.2 80.46 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.349 1.86 . . . . 0.0 110.695 163.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 mm -73.9 -33.89 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 125.347 1.459 . . . . 0.0 111.361 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 16.3 p -119.72 9.61 11.45 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 118.775 2.88 . . . . 0.0 118.775 -174.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 17.8 mtp85 -123.85 173.47 8.16 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 153.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.63 152.98 29.72 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-O 116.633 -2.204 . . . . 0.0 113.498 -154.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 9.6 p -61.44 -29.6 70.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -165.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -128.6 45.05 2.85 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 123.878 1.799 . . . . 0.0 112.18 -177.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 1.7 p -69.24 177.73 2.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 119.808 -1.808 . . . . 0.0 109.382 -178.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 tp -66.22 -24.05 66.54 Favored 'General case' 0 N--CA 1.451 -0.379 1 O-C-N 116.108 -4.12 . . . . 0.0 114.731 176.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -67.72 -7.81 30.24 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 118.394 2.739 . . . . 0.0 118.394 159.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -133.93 11.95 3.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 115.382 -2.247 . . . . 0.0 113.245 -168.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 30.35 99.32 0.03 OUTLIER Pre-proline 0 N--CA 1.452 -0.343 0 N-CA-C 116.558 2.058 . . . . 0.0 116.558 134.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . 0.402 ' C ' ' H ' ' D' ' 95' ' ' GLU 0.346 0.3 OUTLIER 39.33 43.98 0.0 OUTLIER 'Cis proline' 0 N--CA 1.445 -1.341 0 O-C-N 117.147 -2.08 . . . . 0.0 109.902 26.339 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.94 -21.11 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 O-C-N 119.508 -1.995 . . . . 0.0 111.26 170.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' D' ' 93' ' ' PRO 0.304 0.0 OUTLIER -91.15 -26.16 19.23 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 125.462 1.726 . . . . 0.0 112.201 -171.414 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.21 -51.7 55.14 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 131.064 3.745 . . . . 0.0 108.495 162.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -58.94 -48.8 80.2 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 126.128 1.771 . . . . 0.0 113.802 -174.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -63.56 -29.14 70.44 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 125.423 1.702 . . . . 0.0 115.399 170.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 70.6 t90 -83.37 -27.31 29.76 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 121.335 1.88 . . . . 0.0 111.652 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 25.7 mt -69.59 -34.8 74.65 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.179 -3.451 . . . . 0.0 110.498 171.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -67.64 -20.52 65.34 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 116.812 -1.566 . . . . 0.0 112.769 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -104.74 -9.88 17.82 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 126.556 2.41 . . . . 0.0 116.765 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.439 3.2 t -106.74 -26.61 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-O 125.698 2.666 . . . . 0.0 116.141 171.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 36.0 mt -104.83 -19.24 13.96 Favored 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 116.611 -3.806 . . . . 0.0 114.545 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 5.1 mp -110.73 44.7 1.23 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.771 1.628 . . . . 0.0 110.495 153.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -62.83 167.71 4.44 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 117.835 2.532 . . . . 0.0 117.835 169.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.9 m -52.4 -42.23 63.85 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 119.314 -2.116 . . . . 0.0 115.08 -170.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.247 0.945 0 C-N-CA 128.612 2.765 . . . . 0.0 118.104 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 117.905 -1.045 . . . . 0.0 112.308 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.97 -1.93 53.8 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 112.683 -3.607 . . . . 0.0 115.435 -159.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . 0.254 36.4 tt0 -89.32 -19.44 25.28 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 128.973 2.909 . . . . 0.0 110.488 171.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -79.49 7.73 7.61 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 117.628 2.455 . . . . 0.0 117.628 162.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.31 142.1 39.23 Favored Pre-proline 0 N--CA 1.447 -0.621 0 C-N-CA 128.342 2.657 . . . . 0.0 111.995 178.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -101.4 13.32 0.41 Allowed 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 123.71 2.94 . . . . 0.0 110.311 176.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -143.94 154.55 43.43 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.213 2.205 . . . . 0.0 113.791 170.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.0 t -152.77 132.65 13.28 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 129.764 3.225 . . . . 0.0 112.543 168.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.06 -15.78 63.35 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 116.687 -1.625 . . . . 0.0 111.682 175.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.46 -43.26 10.98 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 121.999 2.181 . . . . 0.0 111.228 -172.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 14.3 tpt -69.12 -27.56 65.68 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.473 1.909 . . . . 0.0 109.286 167.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.32 -22.78 61.13 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 120.428 3.492 . . . . 0.0 120.428 167.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -69.78 -37.51 76.37 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 120.985 -1.072 . . . . 0.0 112.292 157.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -66.78 -37.25 84.22 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 116.645 -3.784 . . . . 0.0 109.414 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -76.97 -3.81 40.83 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 130.747 3.619 . . . . 0.0 116.683 169.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -83.0 -50.31 8.67 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 116.412 -2.115 . . . . 0.0 110.334 163.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -41.76 -41.19 2.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 119.37 3.1 . . . . 0.0 119.37 161.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -65.17 -36.9 85.66 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.032 1.333 . . . . 0.0 113.694 174.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 9.2 t-105 -72.44 -45.57 59.01 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 117.61 -1.186 . . . . 0.0 112.807 170.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.32 -27.52 67.4 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 117.696 -1.145 . . . . 0.0 113.002 178.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . 0.313 12.1 ttt-85 -60.24 -23.22 63.9 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 130.756 3.622 . . . . 0.0 115.329 169.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.252 61.6 t80 -79.79 -43.95 21.54 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 115.427 -2.509 . . . . 0.0 109.684 165.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 68.8 t -69.51 -35.99 69.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -168.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -60.96 -37.01 80.89 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 165.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.9 tp -72.61 -30.41 64.32 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.257 1.023 . . . . 0.0 112.298 -177.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 48.5 tp -82.28 -31.76 29.91 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 128.047 2.539 . . . . 0.0 106.056 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -62.73 -44.35 96.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 121.996 2.18 . . . . 0.0 108.261 175.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -68.39 -36.29 78.94 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 127.475 3.512 . . . . 0.0 109.65 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.83 -40.93 95.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 116.535 -3.853 . . . . 0.0 117.477 175.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -68.84 -33.48 73.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 120.544 1.52 . . . . 0.0 113.044 173.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -71.96 -21.24 61.62 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 117.161 -3.462 . . . . 0.0 116.39 170.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -101.26 11.72 38.81 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 114.04 -2.886 . . . . 0.0 114.512 168.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 48.67 42.94 20.27 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 125.225 1.578 . . . . 0.0 113.142 -175.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -114.28 -1.66 13.53 Favored 'General case' 0 N--CA 1.45 -0.458 1 C-N-CA 133.538 4.735 . . . . 0.0 113.314 176.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -56.81 -43.08 80.62 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 122.683 2.492 . . . . 0.0 112.951 -178.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.5 mt -64.17 -63.45 3.82 Favored Pre-proline 0 N--CA 1.447 -0.584 0 O-C-N 120.549 -1.344 . . . . 0.0 109.841 -175.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -70.17 -11.58 30.56 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 CA-C-O 115.462 -1.974 . . . . 0.0 112.716 -174.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.6 tp -70.52 -63.25 1.13 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 129.254 3.021 . . . . 0.0 105.105 167.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 37.0 mt -58.86 -34.5 71.67 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 119.571 -1.956 . . . . 0.0 114.537 -175.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -51.71 -50.76 59.88 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.479 1.112 . . . . 0.0 112.299 164.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.8 tt -64.32 -47.18 80.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 126.584 1.954 . . . . 0.0 109.869 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 65.9 mmm -83.86 -17.95 39.17 Favored 'General case' 0 N--CA 1.453 -0.295 1 CA-C-O 111.306 -4.188 . . . . 0.0 116.49 -167.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 mt -133.5 138.77 46.28 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 124.201 3.182 . . . . 0.0 108.444 170.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.9 p -73.5 155.5 89.41 Favored Pre-proline 0 N--CA 1.448 -0.544 0 CA-C-N 114.359 -1.291 . . . . 0.0 111.011 177.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -59.45 -29.24 89.55 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 CA-C-O 114.905 -2.206 . . . . 0.0 117.212 -170.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.49 -23.61 53.76 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 122.748 2.522 . . . . 0.0 107.372 178.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -81.26 -27.63 35.08 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 116.74 -3.725 . . . . 0.0 113.221 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.8 mtm-85 -69.73 -57.13 5.5 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 117.904 -2.998 . . . . 0.0 108.373 178.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . 0.275 24.4 tt0 -61.84 -27.18 68.59 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.365 1.866 . . . . 0.0 111.889 177.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.75 -38.05 70.44 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.62 2.368 . . . . 0.0 110.269 174.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.9 mt -70.62 -27.71 64.29 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 120.823 1.647 . . . . 0.0 115.199 166.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.5 -38.02 95.69 Favored Glycine 0 C--N 1.335 0.501 0 CA-C-N 122.094 2.225 . . . . 0.0 111.299 167.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.0 m -68.91 -39.87 79.42 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 119.614 3.19 . . . . 0.0 119.614 171.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -54.93 -24.13 22.21 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 114.829 -2.51 . . . . 0.0 115.724 163.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.3 t -60.93 -38.66 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 122.397 2.362 . . . . 0.0 113.17 164.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -77.74 -29.67 51.23 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 114.983 -2.436 . . . . 0.0 114.378 171.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 66.8 mt -74.74 -24.57 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 122.48 2.4 . . . . 0.0 112.556 172.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 4.3 t -71.12 -51.77 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 C-N-CA 124.789 1.236 . . . . 0.0 110.986 159.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -50.51 -67.99 0.21 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.067 1.747 . . . . 0.0 111.922 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -71.79 -34.93 69.82 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.611 2.365 . . . . 0.0 110.541 -165.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.66 -39.45 91.42 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 118.022 2.601 . . . . 0.0 118.022 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.89 -37.14 72.98 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.751 2.02 . . . . 0.0 113.877 177.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 34.8 ttm105 -66.76 -44.6 80.97 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 165.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.7 18.02 55.49 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 110.014 -3.266 . . . . 0.0 113.372 155.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.257 47.9 mm-40 -88.18 -27.22 21.98 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 120.595 2.198 . . . . 0.0 107.025 -179.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 57.3 mtt -91.91 124.95 36.4 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 125.098 1.499 . . . . 0.0 112.603 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.8 p -73.07 164.63 26.41 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.024 1.73 . . . . 0.0 112.589 166.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -59.4 -40.06 85.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 123.967 0.792 . . . . 0.0 112.999 166.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 42.2 tpt85 -57.63 -27.37 62.73 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 173.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -87.1 -34.99 18.93 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 117.063 2.245 . . . . 0.0 117.063 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 92.0 mt -58.6 -26.16 63.38 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 118.806 -2.434 . . . . 0.0 115.592 167.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -42.28 -44.67 3.92 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 115.663 1.727 . . . . 0.0 115.663 157.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -83.37 -46.12 12.93 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 174.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -62.53 -46.77 86.87 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 125.458 1.503 . . . . 0.0 111.148 -169.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.9 mt -119.09 9.21 11.73 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 111.787 -2.46 . . . . 0.0 109.042 -169.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.79 12.1 74.17 Favored Glycine 0 C--N 1.337 0.596 0 N-CA-C 117.985 1.954 . . . . 0.0 117.985 174.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -97.2 141.59 30.14 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 118.875 2.917 . . . . 0.0 118.875 -157.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.03 123.17 21.04 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-O 116.656 -2.191 . . . . 0.0 110.422 168.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 72.0 mt -53.88 -35.08 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 118.719 1.259 . . . . 0.0 112.387 -162.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.2 -14.36 61.78 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 119.308 -2.12 . . . . 0.0 114.491 -171.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 78.0 p -74.56 -44.6 50.2 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.9 mm -68.93 -29.23 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-O 115.091 -2.385 . . . . 0.0 107.453 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 99.0 m -60.89 -32.15 71.62 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 120.908 1.686 . . . . 0.0 114.009 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -69.69 -46.26 66.43 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.919 -1.113 . . . . 0.0 113.114 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.15 -26.97 65.05 Favored Glycine 0 CA--C 1.525 0.712 0 O-C-N 119.739 -1.851 . . . . 0.0 110.29 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.2 m -64.64 -38.93 92.68 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.854 0.862 . . . . 0.0 110.161 169.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -77.34 -30.03 53.72 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 118.697 -2.502 . . . . 0.0 110.757 175.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.7 m -67.43 -40.14 85.46 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 122.362 2.346 . . . . 0.0 112.938 170.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.4 tp -64.4 -41.7 96.5 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 117.626 2.454 . . . . 0.0 117.626 168.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -57.8 -39.53 77.79 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 119.756 -1.84 . . . . 0.0 111.04 165.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.71 3.59 44.2 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 121.422 3.86 . . . . 0.0 121.422 175.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.44 153.36 85.8 Favored Pre-proline 0 N--CA 1.449 -0.482 0 O-C-N 126.336 2.272 . . . . 0.0 108.782 178.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -67.12 148.57 81.28 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 N-CA-C 109.303 -1.076 . . . . 0.0 109.303 -175.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.14 -30.79 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 117.852 -1.071 . . . . 0.0 111.692 -163.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 16.1 pm0 -76.86 -7.96 56.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.267 2.227 . . . . 0.0 111.392 -177.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 49.3 tp -87.34 -46.85 9.29 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 124.794 1.309 . . . . 0.0 112.944 168.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 54.5 mtm-85 -56.86 -35.28 68.7 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 119.251 -2.156 . . . . 0.0 110.493 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -66.94 -20.61 65.93 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 116.844 -3.66 . . . . 0.0 117.69 171.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -90.27 -42.94 10.7 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 118.061 -2.9 . . . . 0.0 106.715 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.66 -20.45 64.83 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 126.12 1.768 . . . . 0.0 114.683 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -70.21 -48.53 56.69 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.861 -3.024 . . . . 0.0 108.677 170.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -71.44 -32.23 68.12 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.239 -175.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 80.8 t -81.37 -59.75 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-O 113.464 -3.16 . . . . 0.0 110.959 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.6 mt -96.28 -29.69 13.86 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 127.367 2.917 . . . . 0.0 113.268 -172.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 11.7 mt -107.46 -22.9 12.38 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 114.735 -2.786 . . . . 0.0 110.84 -159.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -59.51 -22.93 62.34 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 125.319 2.485 . . . . 0.0 115.19 -175.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 85.9 p -66.24 -27.73 68.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 111.855 -2.43 . . . . 0.0 117.442 -173.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.252 1.209 0 O-C-N 117.229 -3.419 . . . . 0.0 116.919 176.676 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.6 tmm? . . . . . 0 N--CA 1.473 0.717 0 CA-C-O 118.048 -0.977 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.49 -24.56 63.7 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 127.556 2.342 . . . . 0.0 116.618 -165.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -100.96 -10.31 20.7 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 124.823 2.249 . . . . 0.0 114.601 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -82.5 -50.35 8.93 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 118.31 -2.744 . . . . 0.0 113.786 172.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 34.9 m -88.15 125.21 64.83 Favored Pre-proline 0 N--CA 1.449 -0.475 0 C-N-CA 127.678 2.391 . . . . 0.0 109.433 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -67.63 -19.91 47.47 Favored 'Trans proline' 0 N--CA 1.448 -1.183 0 N-CA-C 121.368 3.565 . . . . 0.0 121.368 172.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . 0.292 78.2 t80 -104.6 133.96 48.57 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 127.499 2.32 . . . . 0.0 108.383 167.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 14.3 t -161.43 124.93 3.24 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 119.382 -2.074 . . . . 0.0 110.886 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.79 -45.45 74.33 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.185 2.594 . . . . 0.0 110.043 174.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.76 -28.82 69.71 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 118.244 2.683 . . . . 0.0 118.244 174.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.86 -30.27 28.74 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.289 1.836 . . . . 0.0 108.097 172.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.77 -17.9 65.1 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 163.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -85.02 -46.14 11.47 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.508 1.123 . . . . 0.0 112.615 171.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 36.5 tp60 -63.77 -28.78 70.11 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 118.392 -0.813 . . . . 0.0 111.863 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 25.9 mmt180 -85.41 -16.21 40.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.774 -1.829 . . . . 0.0 113.793 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -80.69 -33.46 35.4 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 119.182 -2.199 . . . . 0.0 108.433 172.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -78.03 -13.52 59.84 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 118.185 -2.822 . . . . 0.0 110.852 175.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -72.91 -39.0 66.68 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 126.183 1.793 . . . . 0.0 113.321 160.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -62.05 -35.94 80.12 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.37 -2.081 . . . . 0.0 111.005 173.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 93.9 mt -70.01 -26.78 64.23 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 128.425 2.69 . . . . 0.0 113.963 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -54.0 -59.97 3.94 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 115.685 -2.102 . . . . 0.0 110.336 165.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -44.33 -45.74 8.94 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.011 2.187 . . . . 0.0 112.949 166.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 39.8 t -65.29 -48.42 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 -176.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.14 -33.74 73.93 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 117.427 -3.296 . . . . 0.0 113.5 172.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 48.6 tp -61.53 -47.03 87.44 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 177.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.261 65.3 tp -66.96 -39.56 87.27 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.308 -3.37 . . . . 0.0 116.066 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -56.3 -44.8 80.24 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 120.423 -1.423 . . . . 0.0 110.079 173.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -71.87 -30.08 65.04 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . 0.299 . . -68.14 -42.33 80.29 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 113.475 -3.155 . . . . 0.0 114.938 168.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -70.27 -10.59 59.38 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 116.617 2.081 . . . . 0.0 116.617 170.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -84.35 -13.3 52.72 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.845 1.258 . . . . 0.0 112.865 168.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -121.63 6.79 9.99 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 122.513 1.149 . . . . 0.0 112.747 176.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.294 1.7 m-20 57.04 30.12 17.66 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 119.429 -2.045 . . . . 0.0 115.496 -176.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 50.4 mt -102.3 14.21 32.57 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 128.886 2.874 . . . . 0.0 110.127 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -64.93 -38.57 91.39 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 114.583 -2.627 . . . . 0.0 117.764 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.26 34.0 tp -67.59 -55.1 15.33 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 126.007 2.067 . . . . 0.0 109.569 -175.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.31 -14.45 22.91 Favored 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 123.794 2.996 . . . . 0.0 114.025 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 40.4 tp -73.93 -41.74 61.61 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 119.405 -2.059 . . . . 0.0 112.511 163.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 46.3 mt -75.9 -25.57 56.18 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.917 -1.992 . . . . 0.0 115.144 175.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -67.76 -41.26 83.61 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.855 1.262 . . . . 0.0 110.345 163.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 26.7 tp -62.3 -46.38 89.02 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 117.671 -3.143 . . . . 0.0 107.283 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 23.7 mmt -77.57 -17.22 58.08 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.602 -2.561 . . . . 0.0 116.975 -169.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 mt -134.01 138.12 45.19 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 118.634 -2.541 . . . . 0.0 108.059 -175.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 64.8 p -89.01 164.98 29.05 Favored Pre-proline 0 N--CA 1.45 -0.467 0 C-N-CA 127.58 2.352 . . . . 0.0 109.607 -171.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -60.66 -27.99 85.78 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 124.215 3.277 . . . . 0.0 117.311 -172.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -76.49 -25.8 54.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 119.67 -1.894 . . . . 0.0 112.052 173.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -92.5 -33.7 14.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 116.628 -3.795 . . . . 0.0 110.168 -169.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 mtm-85 -70.88 -40.96 71.94 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 115.354 -2.26 . . . . 0.0 111.808 176.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -67.27 -30.78 70.76 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 119.891 1.223 . . . . 0.0 111.335 170.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.85 -34.08 60.05 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 120.003 -1.686 . . . . 0.0 115.044 177.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 28.3 mt -62.7 -44.59 95.83 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 118.694 -2.504 . . . . 0.0 110.635 166.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -42.65 -52.43 5.44 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-N 122.295 2.316 . . . . 0.0 114.411 163.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 6.2 m -74.74 -37.86 62.4 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.503 -0.848 . . . . 0.0 111.262 -170.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -57.48 -35.94 70.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 113.11 -3.329 . . . . 0.0 113.597 168.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 62.5 t -65.7 -35.25 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 114.241 -2.984 . . . . 0.0 106.749 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 48.6 mtp180 -74.98 -22.37 58.59 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 116.973 -1.489 . . . . 0.0 114.788 177.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 31.6 mt -70.17 -47.59 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 119.789 1.177 . . . . 0.0 108.767 173.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.283 47.1 t -73.84 -25.26 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 118.099 -2.876 . . . . 0.0 109.362 -175.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -64.34 -49.45 71.65 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 115.496 1.665 . . . . 0.0 115.496 166.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -64.68 -33.9 77.03 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 127.435 2.959 . . . . 0.0 110.858 175.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 52.1 mt -63.01 -21.22 66.0 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 122.567 2.44 . . . . 0.0 116.74 169.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 39.0 mt -89.05 -38.74 14.15 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 116.9 -1.524 . . . . 0.0 112.173 167.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.281 26.2 ttm105 -55.02 -53.13 59.67 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 123.964 1.84 . . . . 0.0 112.879 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.61 45.91 33.91 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-O 114.666 -3.297 . . . . 0.0 116.034 -172.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -118.26 -44.95 2.66 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 121.107 2.453 . . . . 0.0 115.018 -173.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 50.7 mtt -70.34 148.36 48.55 Favored 'General case' 0 N--CA 1.447 -0.586 2 O-C-N 113.286 -5.884 . . . . 0.0 114.43 179.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 73.0 p -74.96 161.36 29.57 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 128.063 2.545 . . . . 0.0 115.452 158.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -55.02 -24.42 24.46 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.557 0.694 . . . . 0.0 112.119 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 67.0 ttt-85 -77.1 -39.59 48.97 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 127.553 2.341 . . . . 0.0 110.61 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -70.68 -45.44 65.05 Favored 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 127.229 2.831 . . . . 0.0 108.229 174.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 44.7 mt -49.72 -41.02 42.49 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 117.451 2.389 . . . . 0.0 117.451 173.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 17.7 tptp -62.32 -43.91 97.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.479 2.311 . . . . 0.0 116.491 171.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -114.95 -24.09 8.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 126.02 1.728 . . . . 0.0 113.104 -158.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -105.7 -13.89 15.42 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 125.121 1.368 . . . . 0.0 113.862 175.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 57.4 mt -137.62 -3.6 1.87 Allowed 'General case' 0 N--CA 1.446 -0.628 1 O-C-N 116.044 -4.16 . . . . 0.0 108.398 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 84.46 2.75 88.89 Favored Glycine 0 C--N 1.336 0.561 0 O-C-N 120.033 -1.667 . . . . 0.0 113.902 164.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.54 133.76 52.24 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.602 -3.293 . . . . 0.0 118.306 -172.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.59 177.6 39.09 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 127.978 2.704 . . . . 0.0 114.471 174.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 40.6 mm -70.19 -35.86 65.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 O-C-N 118.071 -3.017 . . . . 0.0 111.513 -161.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.35 -36.62 81.77 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 113.894 -2.955 . . . . 0.0 113.127 170.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 74.9 m -54.89 -54.3 44.27 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 127.898 3.249 . . . . 0.0 114.1 172.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 20.4 mm -79.62 -37.05 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 112.527 -2.124 . . . . 0.0 112.391 -170.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 18.6 m -55.4 -47.39 75.96 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 116.154 -1.879 . . . . 0.0 109.724 168.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -55.68 -53.67 53.64 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 123.13 2.695 . . . . 0.0 116.198 173.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -49.24 -31.68 12.65 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 116.042 1.177 . . . . 0.0 116.042 166.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 60.4 p -81.83 -36.31 28.44 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.377 -2.249 . . . . 0.0 114.026 173.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -62.49 -30.48 71.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 115.847 -2.025 . . . . 0.0 114.778 167.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 50.7 m -66.84 -32.04 73.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 122.2 2.273 . . . . 0.0 112.079 171.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 5.7 mt -73.82 -35.27 64.84 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 115.68 -2.105 . . . . 0.0 112.409 168.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -66.82 -36.19 81.79 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 121.011 1.732 . . . . 0.0 114.635 164.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.24 -28.26 67.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 118.086 -2.884 . . . . 0.0 108.4 175.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.76 145.82 97.32 Favored Pre-proline 0 N--CA 1.446 -0.647 0 CA-C-N 123.811 3.005 . . . . 0.0 111.306 -170.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -72.9 153.89 53.16 Favored 'Trans proline' 0 N--CA 1.449 -1.122 0 C-N-CA 124.397 3.398 . . . . 0.0 111.526 173.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 16.7 m -64.47 -19.07 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 O-C-N 118.434 -2.666 . . . . 0.0 116.192 -177.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -77.18 -16.07 59.25 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.356 1.462 . . . . 0.0 113.738 173.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 18.0 tp -90.85 -47.57 7.53 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 118.209 -2.807 . . . . 0.0 114.248 161.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.1 mtp85 -57.75 -48.06 80.71 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 116.2 -1.857 . . . . 0.0 114.404 -176.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -78.82 -12.07 60.01 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 127.088 2.743 . . . . 0.0 115.063 177.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -76.69 -45.0 31.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.563 1.145 . . . . 0.0 109.744 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 11.4 mt -62.08 -42.95 99.74 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 118.726 -2.484 . . . . 0.0 113.528 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -58.95 -31.53 68.8 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 115.689 -2.404 . . . . 0.0 115.257 -178.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -92.74 -27.38 17.26 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 128.521 2.728 . . . . 0.0 118.156 -171.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.39 -42.05 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 O-C-N 119.086 -2.259 . . . . 0.0 110.351 168.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 75.9 mt -77.49 -77.04 0.16 Allowed 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 123.574 0.546 . . . . 0.0 112.125 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 13.3 mt -77.35 -24.83 50.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.204 1.401 . . . . 0.0 110.77 -153.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -61.03 -22.46 64.58 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 123.641 2.928 . . . . 0.0 110.896 171.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 49.5 m -110.85 8.93 22.45 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 129.588 3.155 . . . . 0.0 115.305 -177.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 26.5 t70 . . . . . 0 C--O 1.25 1.095 0 N-CA-C 116.102 1.89 . . . . 0.0 116.102 178.413 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 19.8 ttt . . . . . 0 N--CA 1.471 0.604 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.53 159.13 25.21 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 122.451 1.12 . . . . 0.0 110.419 -173.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -152.82 155.3 36.85 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.453 2.301 . . . . 0.0 107.745 -167.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -154.32 111.42 3.38 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -164.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 81.5 p -101.02 159.03 30.64 Favored Pre-proline 0 N--CA 1.444 -0.736 0 O-C-N 118.992 -2.318 . . . . 0.0 109.042 -175.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -63.5 -28.93 70.75 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 CA-C-O 115.851 -1.812 . . . . 0.0 112.977 -167.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -153.67 142.63 21.19 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 127.827 3.205 . . . . 0.0 111.957 176.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 44.5 t -133.81 118.77 18.41 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 125.665 2.65 . . . . 0.0 107.092 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.79 -20.2 60.54 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.482 -2.011 . . . . 0.0 109.333 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.19 -26.91 32.94 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 121.752 2.069 . . . . 0.0 112.84 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 17.9 mtt -70.1 -31.94 69.74 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 121.104 3.742 . . . . 0.0 121.104 151.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.84 -40.25 83.68 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 126.147 1.779 . . . . 0.0 112.352 163.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -71.72 -37.7 70.59 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 116.369 -2.132 . . . . 0.0 112.898 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -63.15 -29.76 71.05 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.911 1.284 . . . . 0.0 112.033 173.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . 0.28 0.0 OUTLIER -66.15 -39.3 89.71 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 118.36 -2.713 . . . . 0.0 112.826 163.037 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -68.16 -38.49 82.16 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 115.417 -2.23 . . . . 0.0 113.375 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.255 31.5 mm-40 -67.53 -37.47 82.79 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 172.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -61.19 -40.51 94.21 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 115.734 -2.079 . . . . 0.0 113.697 169.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 24.8 t-105 -63.89 -46.09 86.41 Favored 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 129.713 4.383 . . . . 0.0 113.519 177.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.44 -30.98 70.92 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 113.022 -1.899 . . . . 0.0 109.795 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -67.93 -27.67 66.83 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 118.557 -2.589 . . . . 0.0 115.484 172.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -61.21 -41.91 97.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 119.887 -1.758 . . . . 0.0 114.889 156.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 83.6 t -70.59 -41.76 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 C-N-CA 128.474 2.71 . . . . 0.0 112.0 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.61 -44.83 89.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 117.84 -1.076 . . . . 0.0 113.884 169.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 34.1 tp -56.79 -48.85 76.99 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 120.376 1.444 . . . . 0.0 111.651 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 25.9 tp -63.98 -34.8 78.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.394 1.878 . . . . 0.0 111.668 176.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -60.76 -39.0 87.12 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 118.224 -2.798 . . . . 0.0 114.348 -178.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -76.85 -19.13 57.86 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 125.529 1.768 . . . . 0.0 115.272 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 -22.1 35.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.148 -2.22 . . . . 0.0 113.877 -172.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -56.83 -46.64 81.57 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 116.363 -3.96 . . . . 0.0 104.534 170.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -58.67 -35.62 72.86 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 117.041 -3.537 . . . . 0.0 112.065 -170.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -106.26 9.04 32.16 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 117.425 2.38 . . . . 0.0 117.425 174.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.41 7.7 m-20 49.47 39.41 16.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 119.094 -2.254 . . . . 0.0 113.095 177.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 33.9 mt -86.43 -0.35 55.81 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.669 2.388 . . . . 0.0 110.937 160.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -53.65 -51.04 64.39 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 121.19 1.814 . . . . 0.0 109.374 -169.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 mt -62.05 -52.88 64.33 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-O 115.856 -2.021 . . . . 0.0 114.676 174.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . 0.282 70.5 Cg_exo -43.36 -47.11 9.28 Favored 'Trans proline' 0 N--CA 1.45 -1.054 1 C-N-CA 127.458 5.438 . . . . 0.0 116.259 166.567 . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 tp -64.99 -37.4 87.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 116.987 2.217 . . . . 0.0 116.987 171.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.292 33.0 mt -77.43 -25.14 50.43 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 127.545 3.028 . . . . 0.0 110.921 177.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -59.31 -44.54 92.55 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 117.733 -1.127 . . . . 0.0 108.779 166.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 64.1 tp -75.71 -46.35 31.59 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.989 2.515 . . . . 0.0 111.506 -169.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 84.7 mmm -88.77 -14.77 36.32 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.912 -1.117 . . . . 0.0 113.187 -163.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mp -125.48 164.9 19.46 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 122.536 1.16 . . . . 0.0 109.092 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 69.7 p -97.22 169.37 8.74 Favored Pre-proline 0 N--CA 1.448 -0.564 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 175.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -54.51 -45.8 38.27 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.685 2.257 . . . . 0.0 113.668 174.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -42.92 97.19 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.542 1.937 . . . . 0.0 111.63 177.091 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -59.52 -32.18 70.07 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.417 1.487 . . . . 0.0 114.047 179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 95.9 mtm-85 -88.02 -34.93 17.84 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 127.665 2.386 . . . . 0.0 112.733 177.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -60.33 -41.18 93.01 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 117.092 2.256 . . . . 0.0 117.092 162.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.12 -53.92 15.01 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 119.425 -2.047 . . . . 0.0 115.303 169.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 26.3 mt -75.71 -32.66 60.16 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 126.371 2.295 . . . . 0.0 115.863 -174.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.9 -33.08 86.07 Favored Glycine 0 N--CA 1.448 -0.521 0 O-C-N 120.363 -1.46 . . . . 0.0 110.153 166.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 27.4 m -80.7 -47.26 14.26 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.85 0.825 . . . . 0.0 111.743 -178.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.304 89.0 mtt180 -53.39 -24.43 12.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 167.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 39.8 t -68.24 -38.87 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 O-C-N 117.078 -3.514 . . . . 0.0 113.157 169.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 33.9 mtp180 -81.53 -1.7 47.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 123.772 0.829 . . . . 0.0 109.001 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 79.9 mt -95.17 -52.05 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 O-C-N 119.678 -1.889 . . . . 0.0 108.495 170.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 37.4 t -46.64 -52.58 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 C-N-CA 128.282 2.633 . . . . 0.0 116.949 166.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -56.04 -47.46 77.81 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 122.25 1.024 . . . . 0.0 112.223 173.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -72.53 -18.62 61.63 Favored 'General case' 0 N--CA 1.452 -0.364 1 O-C-N 115.175 -4.703 . . . . 0.0 113.083 -171.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 60.3 mt -87.5 -31.76 19.79 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 118.384 -2.698 . . . . 0.0 108.313 173.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 24.3 mt -68.55 -10.81 58.14 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 118.507 -2.621 . . . . 0.0 114.358 160.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttm105 -104.32 -43.02 5.32 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 125.302 1.626 . . . . 0.0 113.084 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.11 2.16 60.89 Favored Glycine 0 C--N 1.336 0.583 0 O-C-N 119.238 -2.164 . . . . 0.0 112.497 158.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -89.26 -17.41 29.07 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 120.977 -1.308 . . . . 0.0 114.351 -166.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 10.7 mmt -56.08 125.89 23.57 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.409 1.483 . . . . 0.0 114.589 177.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . 0.285 55.4 p -78.14 166.64 22.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.932 2.02 . . . . 0.0 110.233 169.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -51.03 -29.88 13.89 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 116.555 2.057 . . . . 0.0 116.555 169.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 -65.74 -44.17 86.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 125.557 2.598 . . . . 0.0 107.788 172.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -75.56 -39.21 58.5 Favored 'General case' 0 N--CA 1.452 -0.336 1 O-C-N 116.027 -4.171 . . . . 0.0 111.572 -174.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 96.8 mt -56.76 -6.59 0.34 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 118.637 2.828 . . . . 0.0 118.637 166.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -112.1 -65.07 1.21 Allowed 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 125.551 1.782 . . . . 0.0 109.912 171.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -85.53 -9.73 56.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 112.96 -3.4 . . . . 0.0 115.892 -169.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -105.74 -45.81 4.3 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 128.71 2.804 . . . . 0.0 114.752 173.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 5.2 mp -86.51 -12.06 49.92 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 116.865 -1.54 . . . . 0.0 111.659 177.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 58.51 -133.56 52.68 Favored Glycine 0 C--N 1.338 0.641 0 CA-C-N 120.6 1.545 . . . . 0.0 110.848 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.72 -23.78 9.99 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 126.687 2.051 . . . . 0.0 110.756 -162.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.07 -13.19 6.41 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 127.404 2.43 . . . . 0.0 117.382 167.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 19.2 tt -58.3 -39.63 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 1 O-C-N 116.181 -4.129 . . . . 0.0 115.501 175.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.91 -56.13 11.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 116.919 -1.515 . . . . 0.0 111.975 168.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . 0.337 28.3 m -55.57 -37.98 68.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 125.977 2.048 . . . . 0.0 113.889 -179.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 6.5 mm -70.58 -23.54 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-O 115.105 -2.378 . . . . 0.0 115.509 170.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 52.9 p -122.51 -17.86 6.85 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 129.71 3.204 . . . . 0.0 114.925 -164.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 74.3 mtp85 -104.05 149.44 25.18 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.883 3.673 . . . . 0.0 112.283 171.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 98.28 153.45 28.66 Favored Glycine 0 C--N 1.337 0.6 0 CA-C-N 121.216 1.826 . . . . 0.0 109.498 -176.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 4.3 m -75.66 9.92 2.02 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 128.522 2.729 . . . . 0.0 117.045 176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -118.89 -2.64 10.83 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.684 1.593 . . . . 0.0 115.072 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 80.1 p -45.75 166.84 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.01 1.324 . . . . 0.0 114.43 172.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 42.7 tp -56.37 -35.76 68.05 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.618 2.451 . . . . 0.0 117.618 -164.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -90.15 -25.2 20.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 126.785 2.034 . . . . 0.0 113.033 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.94 -12.66 59.36 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 125.581 1.801 . . . . 0.0 111.801 174.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.24 161.23 5.56 Favored Pre-proline 0 N--CA 1.45 -0.457 0 C-N-CA 128.625 2.77 . . . . 0.0 113.701 174.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -68.76 143.78 57.14 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 125.08 3.853 . . . . 0.0 112.411 177.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 81.0 t -54.47 -39.73 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 124.921 1.288 . . . . 0.0 114.439 -173.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 15.6 pm0 -63.85 -33.94 76.8 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 112.511 -3.614 . . . . 0.0 113.523 173.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 32.7 tp -71.16 -43.95 66.48 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 127.558 3.036 . . . . 0.0 116.261 172.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -63.69 -39.5 94.48 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 115.488 -2.196 . . . . 0.0 110.231 -174.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -81.69 -32.75 31.59 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 116.532 -1.699 . . . . 0.0 110.635 172.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.3 t90 -67.17 -42.93 83.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 122.598 2.454 . . . . 0.0 112.645 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 22.6 mt -66.5 -16.69 64.33 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 123.604 2.911 . . . . 0.0 114.116 172.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -78.8 -18.89 53.36 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.133 1.773 . . . . 0.0 111.507 172.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -100.18 -41.98 6.88 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 120.173 -1.579 . . . . 0.0 108.963 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 48.9 t -72.12 -62.05 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.492 1 C-N-CA 131.822 4.049 . . . . 0.0 114.54 176.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . 0.26 38.9 mt -77.65 -18.03 57.13 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 124.414 3.279 . . . . 0.0 109.796 -171.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 90.4 mt -117.66 50.84 1.09 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 121.039 1.745 . . . . 0.0 114.817 -169.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.257 17.3 pttp -88.42 124.49 34.01 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.605 3.066 . . . . 0.0 112.591 -157.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 17.2 m -125.02 3.87 7.99 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 127.404 2.94 . . . . 0.0 110.583 176.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 58.0 t0 . . . . . 0 C--O 1.252 1.226 0 CA-C-O 115.529 -2.177 . . . . 0.0 110.903 169.44 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.469 0.501 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.91 149.08 27.87 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -166.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -128.35 137.31 51.86 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.289 1.435 . . . . 0.0 110.781 171.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -127.34 143.09 51.28 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 127.48 2.312 . . . . 0.0 111.275 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 78.0 p -95.33 153.01 39.72 Favored Pre-proline 0 N--CA 1.451 -0.381 0 C-N-CA 128.564 2.746 . . . . 0.0 110.277 173.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -57.86 -30.8 90.72 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 122.935 2.423 . . . . 0.0 113.12 -175.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -148.57 142.91 26.23 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 129.189 2.995 . . . . 0.0 106.914 164.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 26.6 t -76.46 128.26 34.44 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 125.743 2.687 . . . . 0.0 112.263 -173.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.74 -20.86 37.75 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 118.075 -2.891 . . . . 0.0 114.288 165.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -83.76 -33.09 25.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 120.737 -1.227 . . . . 0.0 112.797 172.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 16.6 mmt -66.68 -42.81 85.94 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 118.404 -2.685 . . . . 0.0 112.531 173.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.9 -39.48 62.77 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 169.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -65.15 -55.31 19.41 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.471 -2.018 . . . . 0.0 107.466 176.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -50.92 -44.56 60.19 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.918 2.087 . . . . 0.0 109.331 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . 0.401 HH21 ' CD ' ' D' ' 18' ' ' GLU . 0.0 OUTLIER -66.12 -11.25 47.8 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 124.425 3.284 . . . . 0.0 110.816 173.383 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -95.91 -19.28 19.67 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.974 -2.329 . . . . 0.0 108.754 168.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -86.36 -33.24 20.6 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.318 -3.364 . . . . 0.0 114.273 176.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . 0.401 ' CD ' HH21 ' D' ' 15' ' ' ARG . 95.9 mt-10 -67.29 -33.0 74.37 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 126.637 3.113 . . . . 0.0 111.908 173.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -62.99 -51.14 67.99 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 112.782 -2.008 . . . . 0.0 112.682 168.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.64 -16.97 62.87 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.116 -2.24 . . . . 0.0 111.717 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 49.2 ttt-85 -84.1 -6.46 59.41 Favored 'General case' 0 N--CA 1.449 -0.523 1 O-C-N 116.083 -4.135 . . . . 0.0 118.628 161.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -76.06 -41.28 51.13 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 119.28 -2.137 . . . . 0.0 113.207 149.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 99.3 t -66.42 -39.66 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 O-C-N 121.189 -0.945 . . . . 0.0 113.413 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -64.78 -39.63 93.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 124.652 2.168 . . . . 0.0 114.674 174.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 63.5 tp -67.38 -40.59 85.73 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 118.878 -2.389 . . . . 0.0 115.117 173.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 39.6 tp -74.14 -41.6 61.29 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.31 1.844 . . . . 0.0 110.293 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -51.79 -57.81 8.24 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 163.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -63.0 -31.74 72.94 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 117.465 -1.255 . . . . 0.0 110.728 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.82 -38.0 80.77 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 120.839 1.654 . . . . 0.0 114.726 167.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -72.62 -14.82 61.69 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 130.43 3.492 . . . . 0.0 109.958 170.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . 0.315 47.8 mt-30 -87.48 -14.9 39.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 118.697 -2.502 . . . . 0.0 109.554 176.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . 0.39 47.2 p30 -128.76 5.46 5.52 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 129.166 2.986 . . . . 0.0 115.911 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 62.66 25.49 15.15 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 124.439 2.066 . . . . 0.0 112.826 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 44.2 mt -88.37 -8.0 55.76 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.279 -2.763 . . . . 0.0 114.927 170.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -49.03 -57.56 6.35 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 127.967 2.507 . . . . 0.0 115.382 -173.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.321 3.1 mt -53.18 -52.87 61.83 Favored Pre-proline 0 N--CA 1.447 -0.582 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 177.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -62.63 -15.27 45.13 Favored 'Trans proline' 0 N--CA 1.446 -1.317 0 C-N-CA 122.322 2.015 . . . . 0.0 113.406 176.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 47.0 tp -77.46 -43.54 32.0 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 125.592 3.814 . . . . 0.0 111.386 164.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 25.2 mt -57.94 -45.09 87.17 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 125.413 3.733 . . . . 0.0 111.844 171.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -73.03 -23.32 60.58 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 119.572 -0.851 . . . . 0.0 111.831 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 19.2 tp -78.69 -27.6 45.07 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.347 -2.095 . . . . 0.0 111.059 170.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 13.2 mmt -89.24 -41.09 12.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 119.602 -1.936 . . . . 0.0 114.444 -174.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt -117.03 147.26 42.49 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 125.847 2.736 . . . . 0.0 112.798 -171.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 30.4 p -74.09 156.27 87.83 Favored Pre-proline 0 N--CA 1.45 -0.443 0 C-N-CA 128.721 2.808 . . . . 0.0 108.675 172.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -44.57 -44.01 13.94 Favored 'Trans proline' 0 N--CA 1.451 -1.024 1 C-N-CA 126.967 5.111 . . . . 0.0 122.168 173.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.265 18.9 m-20 -71.21 -22.44 62.01 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 120.376 3.473 . . . . 0.0 120.376 170.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -75.71 -36.54 59.97 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 126.143 2.152 . . . . 0.0 112.864 164.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 25.5 mtm180 -67.46 -43.7 80.44 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 126.205 2.191 . . . . 0.0 109.306 171.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -70.01 -35.84 74.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -170.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.28 -32.87 73.33 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 174.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 23.9 mt -77.79 -49.12 14.98 Favored 'General case' 0 N--CA 1.45 -0.451 1 O-C-N 115.388 -4.57 . . . . 0.0 114.113 -176.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -51.44 -37.25 39.84 Favored Glycine 0 C--N 1.335 0.507 0 CA-C-O 122.637 1.132 . . . . 0.0 113.906 164.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 86.9 m -72.33 -42.27 65.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 118.017 -3.049 . . . . 0.0 108.582 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -55.3 -23.15 21.87 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 121.579 3.918 . . . . 0.0 121.579 170.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 24.4 t -64.48 -33.5 63.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 172.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -89.02 -20.77 23.97 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 172.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 17.9 mt -54.19 -49.65 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 118.748 -2.47 . . . . 0.0 111.506 158.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . 0.495 ' CG2' HD11 ' D' ' 82' ' ' ILE . 65.0 t -68.24 -47.57 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 CA-C-O 117.028 -1.463 . . . . 0.0 109.63 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -51.12 -48.32 61.77 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 119.446 3.128 . . . . 0.0 119.446 170.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -65.42 -24.79 67.29 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.074 2.25 . . . . 0.0 117.074 172.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 59.3 mt -68.27 -13.44 62.26 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 121.859 2.118 . . . . 0.0 113.178 168.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 80.0 mt -104.6 -36.49 7.47 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 114.914 -2.47 . . . . 0.0 105.005 -177.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -81.4 -39.08 25.52 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.643 2.377 . . . . 0.0 113.083 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 53.01 41.67 59.92 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 120.168 2.827 . . . . 0.0 120.168 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -119.62 -1.91 10.55 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 117.806 -3.173 . . . . 0.0 116.231 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 8.5 mmt -129.86 39.51 3.69 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 128.702 2.801 . . . . 0.0 118.105 169.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 26.1 p -81.01 -179.95 7.58 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 110.235 -3.166 . . . . 0.0 117.532 -168.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . 0.515 ' O ' ' HE2' ' D' ' 72' ' ' LYS . 6.0 tp-100 63.05 -105.43 0.16 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 169.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -63.84 -43.01 97.45 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.331 1.452 . . . . 0.0 110.92 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -86.81 -16.09 37.26 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 116.876 2.176 . . . . 0.0 116.876 -171.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.42 -31.85 58.14 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.652 1.215 . . . . 0.0 109.664 176.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . 0.515 ' HE2' ' O ' ' D' ' 68' ' ' GLN 0.303 38.6 mtmt -72.09 -45.97 58.58 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 114.58 -1.191 . . . . 0.0 113.052 166.255 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -86.49 -25.81 24.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 124.299 2.0 . . . . 0.0 115.582 -163.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -122.39 -45.44 2.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 120.775 -1.203 . . . . 0.0 111.695 -171.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -69.46 -42.51 74.79 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.15 -2.844 . . . . 0.0 110.08 166.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.47 -167.22 18.86 Favored Glycine 0 C--N 1.339 0.742 0 CA-C-N 125.694 3.861 . . . . 0.0 122.273 155.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.71 -19.83 64.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.569 -1.548 . . . . 0.0 114.578 -164.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.45 -17.23 5.85 Favored Glycine 0 N--CA 1.446 -0.644 0 O-C-N 119.278 -2.139 . . . . 0.0 118.261 166.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 10.0 tt -52.5 -33.06 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 125.752 1.621 . . . . 0.0 108.032 -177.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -86.28 -12.48 49.39 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.736 2.414 . . . . 0.0 111.522 -173.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.3 m -79.75 -25.06 41.17 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 124.999 2.333 . . . . 0.0 114.004 165.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . 0.495 HD11 ' CG2' ' D' ' 58' ' ' VAL . 26.1 mm -100.11 -31.45 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 130.219 3.408 . . . . 0.0 115.215 -163.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 81.6 p -117.21 -2.73 11.58 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 126.348 2.28 . . . . 0.0 114.776 174.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.354 28.5 mtp85 -121.29 175.1 6.31 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 122.447 1.118 . . . . 0.0 112.872 167.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.99 160.96 27.67 Favored Glycine 0 N--CA 1.445 -0.706 0 O-C-N 118.054 -2.904 . . . . 0.0 114.165 -155.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 77.5 p -71.62 -42.01 68.17 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 118.759 -2.613 . . . . 0.0 112.968 -147.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -118.75 63.92 0.77 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.476 2.71 . . . . 0.0 106.652 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . 0.266 3.1 p -73.46 -175.46 1.97 Allowed 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 117.424 2.379 . . . . 0.0 117.424 173.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.27 5.5 tp -54.76 -32.95 60.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 113.187 -3.292 . . . . 0.0 111.446 162.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -72.44 -2.14 18.36 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.005 2.691 . . . . 0.0 114.03 174.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -124.28 -23.72 4.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 116.359 -1.781 . . . . 0.0 113.76 -171.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . 0.292 . . 63.3 94.37 0.05 OUTLIER Pre-proline 0 N--CA 1.447 -0.576 0 CA-C-N 121.671 2.032 . . . . 0.0 112.226 148.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . 0.446 ' C ' ' H ' ' D' ' 95' ' ' GLU 0.324 32.1 Cg_exo 33.81 32.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 129.216 0.923 . . . . 0.0 114.351 36.825 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 88.0 t -56.51 -17.74 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 C-N-CA 127.988 2.515 . . . . 0.0 110.022 176.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . 0.446 ' H ' ' C ' ' D' ' 93' ' ' PRO 0.285 0.1 OUTLIER -92.31 -49.36 6.2 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 117.984 -2.948 . . . . 0.0 112.899 -173.739 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 54.2 tp -38.38 -53.16 1.53 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 128.138 3.399 . . . . 0.0 109.531 150.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 31.7 ttp180 -65.87 -50.99 62.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 122.977 1.37 . . . . 0.0 111.856 -167.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.99 -28.05 15.55 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.137 -1.392 . . . . 0.0 113.726 170.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 45.6 t90 -85.61 -43.51 13.41 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -177.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.52 -38.86 69.79 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 125.614 1.821 . . . . 0.0 108.974 166.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -72.67 -14.82 61.67 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.873 1.321 . . . . 0.0 112.826 -177.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -94.2 -46.05 7.25 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.983 -2.323 . . . . 0.0 111.724 169.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 97.7 t -68.0 -27.92 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 O-C-N 119.345 -2.097 . . . . 0.0 113.869 177.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 82.6 mt -108.78 -18.87 13.6 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 122.055 2.207 . . . . 0.0 114.369 -171.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 4.6 mp -105.96 23.81 13.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.094 -2.879 . . . . 0.0 108.506 168.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 16.8 pttp -61.19 169.13 2.23 Favored 'General case' 0 N--CA 1.448 -0.534 1 C-N-CA 132.419 4.288 . . . . 0.0 113.342 -172.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 45.5 m -49.73 -45.56 49.4 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 110.654 -2.975 . . . . 0.0 114.557 -170.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 113.362 -3.208 . . . . 0.0 116.089 177.354 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -49.79 -46.09 50.48 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 120.585 -1.322 . . . . 0.0 113.92 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -74.67 -14.58 60.76 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -175.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -107.44 1.66 23.71 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.588 2.755 . . . . 0.0 111.703 178.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 29.2 m -132.61 103.54 13.43 Favored Pre-proline 0 N--CA 1.447 -0.583 0 O-C-N 116.993 -3.567 . . . . 0.0 110.4 -174.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -56.13 -25.44 54.95 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 N-CA-C 120.388 3.188 . . . . 0.0 120.388 158.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -131.65 135.28 46.79 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 119.176 -2.203 . . . . 0.0 112.035 -167.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.3 t -149.09 138.8 21.86 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 104.727 -2.323 . . . . 0.0 104.727 158.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.24 -20.41 41.84 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 112.186 -3.769 . . . . 0.0 113.477 169.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -90.36 -20.18 23.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 122.457 2.389 . . . . 0.0 110.165 -174.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . 0.253 16.5 tpt -84.72 -43.09 14.63 Favored 'General case' 0 N--CA 1.45 -0.434 1 O-C-N 115.739 -4.35 . . . . 0.0 106.509 176.604 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -27.93 65.11 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 111.933 -3.889 . . . . 0.0 112.391 166.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -73.64 -38.75 64.91 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 126.517 2.386 . . . . 0.0 111.116 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -59.98 -42.14 93.52 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 127.163 2.79 . . . . 0.0 111.147 171.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -68.65 -34.39 75.64 Favored 'General case' 0 N--CA 1.448 -0.555 1 O-C-N 115.75 -4.344 . . . . 0.0 114.096 170.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.6 t60 -64.86 -32.58 74.35 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 121.993 2.179 . . . . 0.0 114.6 171.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -67.36 -35.72 79.93 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 174.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -75.28 -30.08 60.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.262 -2.149 . . . . 0.0 109.104 -175.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -76.45 -40.52 50.27 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 119.707 1.139 . . . . 0.0 111.096 172.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 51.3 mt -71.96 -15.81 62.08 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.476 -1.39 . . . . 0.0 109.68 -171.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.2 ttt180 -54.03 -57.39 11.23 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 120.162 -1.586 . . . . 0.0 113.582 167.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.456 ' CE1' HD22 ' A' ' 26' ' ' LEU . 77.5 t80 -49.89 -35.15 22.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 120.41 1.459 . . . . 0.0 114.427 168.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.0 t -67.42 -51.83 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 121.225 -0.922 . . . . 0.0 112.533 -175.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -71.46 -23.72 61.88 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 125.435 2.541 . . . . 0.0 110.787 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.0 tp -75.13 -43.58 51.83 Favored 'General case' 0 N--CA 1.451 -0.41 1 O-C-N 114.244 -5.285 . . . . 0.0 108.307 173.28 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.456 HD22 ' CE1' ' A' ' 22' ' ' PHE . 20.9 tp -64.66 -31.03 72.07 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 116.639 -1.648 . . . . 0.0 110.103 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -57.01 -58.07 9.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 127.599 3.062 . . . . 0.0 109.13 173.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -60.57 -37.79 82.45 Favored 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 117.496 -3.253 . . . . 0.0 108.432 175.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.87 -41.31 83.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.716 -3.115 . . . . 0.0 113.569 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.486 ' CE1' ' HB2' ' B' ' 27' ' ' LYS . 16.9 m-85 -61.44 -35.99 79.13 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 124.708 3.413 . . . . 0.0 112.186 172.034 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.316 84.6 mt-30 -62.78 -16.65 58.93 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 119.448 -2.033 . . . . 0.0 115.139 173.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -124.38 18.84 8.95 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 127.627 2.371 . . . . 0.0 116.52 -176.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 41.32 33.24 0.25 Allowed 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 -165.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.1 mt -91.11 -5.8 54.6 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.577 2.751 . . . . 0.0 114.005 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -68.54 -41.42 79.86 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 113.405 -3.188 . . . . 0.0 113.923 -167.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.28 39.9 mt -61.9 -50.77 79.65 Favored Pre-proline 0 N--CA 1.448 -0.542 0 O-C-N 126.3 2.25 . . . . 0.0 112.593 165.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . 0.261 84.8 Cg_exo -51.25 -39.73 61.91 Favored 'Trans proline' 0 N--CA 1.451 -1.004 1 C-N-CA 127.94 5.76 . . . . 0.0 113.256 174.811 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.4 tp -81.39 -36.23 29.79 Favored 'General case' 0 N--CA 1.449 -0.522 1 O-C-N 115.153 -4.717 . . . . 0.0 111.643 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.9 mt -74.5 -30.54 61.85 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 126.14 1.776 . . . . 0.0 115.517 -177.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -66.75 -30.05 70.17 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 125.972 2.045 . . . . 0.0 113.625 163.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tt -69.72 -48.15 60.59 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 127.614 2.366 . . . . 0.0 111.019 173.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 80.4 mmm -91.44 -11.42 37.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.124 -2.86 . . . . 0.0 115.243 -162.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.8 mt -130.34 136.62 49.3 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 128.04 2.536 . . . . 0.0 110.714 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.2 p -94.49 157.97 36.36 Favored Pre-proline 0 N--CA 1.448 -0.555 0 O-C-N 119.154 -2.216 . . . . 0.0 112.393 176.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -47.89 -39.79 32.12 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.566 2.177 . . . . 0.0 116.135 -169.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . 0.288 5.3 p-10 -72.77 -18.89 61.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 129.121 2.968 . . . . 0.0 112.528 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -97.01 -32.53 11.95 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.884 1.274 . . . . 0.0 108.356 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.2 mtm-85 -69.54 -44.37 71.1 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 119.919 -1.738 . . . . 0.0 112.763 173.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -68.82 -14.56 63.1 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 112.043 -3.837 . . . . 0.0 112.158 166.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.45 -46.99 62.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 123.553 2.888 . . . . 0.0 113.035 164.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.06 -42.2 73.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 118.834 -2.416 . . . . 0.0 110.551 -173.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.26 -42.58 82.89 Favored Glycine 0 C--N 1.333 0.405 0 O-C-N 117.113 -3.492 . . . . 0.0 114.484 167.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.5 m -68.82 -33.15 73.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 124.064 1.887 . . . . 0.0 112.861 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.21 -24.12 67.04 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 116.746 2.128 . . . . 0.0 116.746 178.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.332 5.0 t -61.99 -39.6 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-O 117.171 -1.395 . . . . 0.0 108.138 172.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -70.53 -31.79 69.0 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 121.257 1.844 . . . . 0.0 113.687 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 95.3 mt -64.14 -48.92 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 117.126 -1.416 . . . . 0.0 107.895 176.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.1 t -61.89 -41.56 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-O 115.776 -2.059 . . . . 0.0 112.637 170.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -58.4 -53.2 61.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 123.372 2.806 . . . . 0.0 112.023 174.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -67.15 -26.4 66.65 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.316 76.6 mt -81.93 -35.87 28.66 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.101 2.96 . . . . 0.0 112.151 173.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 tp -72.12 -45.75 59.33 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 114.418 -2.706 . . . . 0.0 113.292 171.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -53.24 -55.66 22.69 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 120.61 1.55 . . . . 0.0 110.375 163.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.81 -0.8 89.39 Favored Glycine 0 C--N 1.333 0.391 0 CA-C-O 116.561 -2.244 . . . . 0.0 114.503 171.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -75.39 -4.92 42.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 120.437 3.495 . . . . 0.0 120.437 -176.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 94.6 mtp -106.2 155.83 19.07 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 129.252 3.021 . . . . 0.0 113.901 167.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 60.4 p -83.63 156.67 22.58 Favored 'General case' 0 N--CA 1.447 -0.615 0 O-C-N 124.476 1.11 . . . . 0.0 112.647 164.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -42.82 -39.8 2.64 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 120.573 -1.33 . . . . 0.0 111.429 166.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.8 tpt85 -79.77 -23.49 42.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 115.656 -2.116 . . . . 0.0 110.96 -175.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -76.12 -31.93 58.91 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 121.954 2.161 . . . . 0.0 112.99 168.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.8 mt -68.14 -31.39 70.94 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 124.39 2.043 . . . . 0.0 114.863 175.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -50.94 -54.39 24.66 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 117.55 -3.219 . . . . 0.0 108.83 174.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -59.2 -38.04 78.91 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.923 1.082 . . . . 0.0 113.923 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -70.56 -32.6 70.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 119.448 -2.033 . . . . 0.0 110.307 -177.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 74.3 mt -119.44 -26.45 5.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -156.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 81.77 -28.29 3.21 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 120.469 2.948 . . . . 0.0 120.469 174.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.6 163.83 25.89 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 120.226 -1.749 . . . . 0.0 110.058 -173.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.28 140.85 34.59 Favored Glycine 0 C--N 1.339 0.702 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -177.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.346 89.1 mt -53.07 -27.38 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-O 116.104 -1.903 . . . . 0.0 111.757 -178.237 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.42 -36.15 53.7 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 120.163 1.347 . . . . 0.0 111.064 175.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 56.5 p -80.9 -23.88 38.66 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 119.614 -1.929 . . . . 0.0 110.922 -173.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 50.0 mm -78.81 -42.5 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 C-N-CA 127.529 2.332 . . . . 0.0 108.999 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.4 m -67.89 -33.95 75.71 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.837 1.255 . . . . 0.0 108.477 177.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.1 ttt180 -61.55 -46.65 89.0 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 121.796 -0.565 . . . . 0.0 110.762 172.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.28 -26.82 74.27 Favored Glycine 0 C--N 1.334 0.426 0 CA-C-O 117.065 -1.964 . . . . 0.0 113.487 175.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 58.1 m -63.54 -40.29 96.62 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.261 1.825 . . . . 0.0 110.789 174.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -68.88 -43.86 74.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 116.988 -1.482 . . . . 0.0 113.96 169.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.0 m -63.26 -25.87 68.52 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 127.21 2.204 . . . . 0.0 106.666 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.0 tp -85.44 -32.35 22.35 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 117.117 -3.489 . . . . 0.0 115.901 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -78.28 -38.0 43.61 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.875 2.07 . . . . 0.0 109.069 -173.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.56 -13.03 60.34 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 129.743 3.217 . . . . 0.0 116.132 167.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.82 126.72 92.25 Favored Pre-proline 0 N--CA 1.449 -0.48 0 C-N-CA 131.088 3.755 . . . . 0.0 107.771 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -59.93 152.48 64.12 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 O-C-N 128.209 3.742 . . . . 0.0 115.298 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -34.88 67.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 CA-C-O 116.395 -1.764 . . . . 0.0 111.086 -173.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.6 pm0 -71.83 -18.07 62.1 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 122.174 2.261 . . . . 0.0 111.896 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 13.6 tp -85.52 -36.35 20.56 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 58.2 mtm-85 -82.41 -35.06 28.0 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 117.545 -3.222 . . . . 0.0 115.934 -171.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -69.58 -6.06 28.59 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.095 1.758 . . . . 0.0 114.148 165.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 40.3 t90 -98.97 -48.34 4.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 117.996 2.591 . . . . 0.0 117.996 166.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.0 mt -61.59 -32.7 72.82 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 120.015 -1.678 . . . . 0.0 111.589 177.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.93 -22.63 65.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 122.608 2.458 . . . . 0.0 115.992 172.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -93.9 -7.7 42.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 118.799 -2.438 . . . . 0.0 113.381 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 54.1 t -118.95 -25.36 2.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 127.456 2.972 . . . . 0.0 113.905 -175.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 68.5 mt -103.57 -39.34 6.76 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 118.587 -2.571 . . . . 0.0 116.308 167.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.2 mt -88.57 -33.61 17.64 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 119.84 -1.787 . . . . 0.0 115.318 -175.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -66.77 -9.96 42.34 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.448 -1.263 . . . . 0.0 113.73 -166.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.5 p -71.54 -24.01 61.87 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 118.703 2.853 . . . . 0.0 118.703 166.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.357 1.4 m-20 . . . . . 0 C--O 1.248 1.018 0 O-C-N 119.217 -2.177 . . . . 0.0 109.537 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.1 -46.52 80.73 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 118.048 -2.907 . . . . 0.0 112.282 -165.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -76.32 7.6 4.18 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 113.57 -1.65 . . . . 0.0 111.035 176.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 61.7 tp60 -122.28 -48.08 2.1 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 117.425 -3.297 . . . . 0.0 109.865 -171.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 40.6 m -81.57 135.41 49.67 Favored Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-O 117.14 -1.409 . . . . 0.0 111.493 -170.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -55.39 -30.43 72.97 Favored 'Trans proline' 0 N--CA 1.448 -1.185 0 C-N-CA 123.349 2.699 . . . . 0.0 113.394 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -109.06 133.35 53.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 118.136 -2.853 . . . . 0.0 112.231 164.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.2 t -134.2 144.09 48.25 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.602 1.334 . . . . 0.0 114.602 161.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.18 -30.14 67.2 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.438 -2.038 . . . . 0.0 112.147 165.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.307 . . -61.42 -49.32 77.32 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 126.275 1.83 . . . . 0.0 108.96 170.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 16.5 mmt -74.85 -28.22 60.58 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -174.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.19 75.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 168.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.8 -39.52 66.62 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.787 2.835 . . . . 0.0 114.537 165.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 8.9 tp60 -57.47 -44.03 84.52 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 119.938 -1.726 . . . . 0.0 112.313 171.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 51.7 mmt-85 -74.42 -29.0 61.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 120.926 1.694 . . . . 0.0 112.336 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -75.27 -39.64 59.57 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 117.991 -2.943 . . . . 0.0 113.943 170.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -64.72 -38.81 92.27 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 129.216 3.006 . . . . 0.0 109.384 169.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -70.19 -36.67 74.78 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 119.108 -2.245 . . . . 0.0 111.591 178.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -63.65 -50.15 70.42 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 116.567 -1.683 . . . . 0.0 109.105 170.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 82.6 mt -64.66 -14.2 57.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 122.131 2.241 . . . . 0.0 113.525 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -56.41 -54.17 48.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 128.56 2.744 . . . . 0.0 108.33 171.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -65.39 -52.24 54.91 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.528 0.731 . . . . 0.0 111.692 -178.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . 0.256 4.2 t -44.19 -48.98 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 126.221 1.808 . . . . 0.0 111.642 178.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -73.44 -41.8 62.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 128.448 3.592 . . . . 0.0 109.282 -171.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 33.8 tp -64.53 -43.7 93.17 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.37 176.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 41.1 tp -65.02 -32.88 74.82 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 120.694 -1.254 . . . . 0.0 114.008 171.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . 0.486 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 57.7 tttt -64.14 -41.48 97.18 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.486 -2.009 . . . . 0.0 112.43 171.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -58.35 -39.15 78.75 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 123.015 2.643 . . . . 0.0 112.811 166.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.8 -33.4 62.22 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.539 -1.35 . . . . 0.0 113.281 -176.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -54.75 -47.7 73.54 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.94 2.096 . . . . 0.0 112.732 169.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -70.77 -6.31 36.65 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.286 1.834 . . . . 0.0 114.426 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -119.86 23.64 10.97 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.556 1.942 . . . . 0.0 113.004 170.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 34.79 48.18 0.3 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 128.372 2.669 . . . . 0.0 110.277 -173.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 33.9 mt -121.63 16.61 11.16 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.445 -1.252 . . . . 0.0 113.098 174.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -71.8 -37.95 70.31 Favored 'General case' 0 N--CA 1.452 -0.357 1 O-C-N 115.444 -4.535 . . . . 0.0 111.144 -176.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 43.0 tp -62.13 -55.75 37.71 Favored Pre-proline 0 N--CA 1.449 -0.518 0 CA-C-O 114.587 -2.625 . . . . 0.0 111.454 177.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -65.23 -20.52 62.51 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 CA-C-N 122.707 2.002 . . . . 0.0 111.696 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 27.7 tp -79.1 -32.85 44.76 Favored 'General case' 0 N--CA 1.451 -0.417 1 CA-C-O 111.56 -4.067 . . . . 0.0 113.047 172.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 59.1 mt -71.08 -32.87 69.64 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 125.603 1.814 . . . . 0.0 107.756 173.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -80.31 -10.2 59.75 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 117.38 2.363 . . . . 0.0 117.38 176.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.3 tp -91.58 -33.42 15.14 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 118.097 -2.877 . . . . 0.0 111.31 160.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 16.2 mmt -85.0 -18.18 35.24 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 128.548 3.655 . . . . 0.0 116.226 -175.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 6.2 mp -126.97 147.77 50.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.21 1.804 . . . . 0.0 112.312 176.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 18.5 p -75.82 165.52 52.63 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-O 112.305 -3.712 . . . . 0.0 116.44 176.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -58.65 -14.57 22.07 Favored 'Trans proline' 0 N--CA 1.45 -1.042 0 O-C-N 126.371 2.774 . . . . 0.0 116.385 174.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -90.19 -46.37 8.48 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 126.195 1.798 . . . . 0.0 113.218 175.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -67.43 -26.59 66.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 117.115 -1.421 . . . . 0.0 114.448 -178.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -60.12 -42.55 94.99 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 125.656 1.848 . . . . 0.0 110.81 172.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -65.35 -27.75 68.8 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 112.141 -2.3 . . . . 0.0 116.148 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.5 -45.97 12.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 118.256 -2.778 . . . . 0.0 110.748 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.99 -34.22 77.28 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.511 -1.993 . . . . 0.0 110.176 -179.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.79 -23.78 72.59 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 118.361 2.104 . . . . 0.0 118.361 170.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 74.7 m -87.9 -25.6 23.16 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.799 2.04 . . . . 0.0 112.803 174.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 42.4 mtt180 -64.5 -24.99 67.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 117.711 2.485 . . . . 0.0 117.711 161.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.02 -41.97 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 120.179 1.354 . . . . 0.0 107.671 175.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 -59.61 -43.84 93.64 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 112.897 -3.43 . . . . 0.0 110.502 176.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 56.5 mt -61.57 -47.76 91.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 123.116 2.689 . . . . 0.0 107.129 -177.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.298 69.2 t -62.18 -33.31 58.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 120.156 1.344 . . . . 0.0 111.766 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -69.45 -43.23 73.7 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 118.654 -2.529 . . . . 0.0 113.176 173.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -72.4 -36.82 68.74 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 119.417 -2.052 . . . . 0.0 114.118 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 12.7 mt -52.18 -28.06 16.79 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.352 0.596 . . . . 0.0 112.568 165.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 23.4 mt -92.18 -21.94 20.1 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 117.831 -3.043 . . . . 0.0 118.381 174.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . 0.497 HH21 ' CG ' ' B' ' 108' ' ' ASP . 5.1 ttm105 -88.89 -43.58 11.08 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.833 2.053 . . . . 0.0 105.516 -166.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.99 49.95 31.74 Favored Glycine 0 CA--C 1.524 0.632 0 CA-C-O 117.422 -1.765 . . . . 0.0 116.294 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -116.75 -36.13 3.98 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 119.811 1.805 . . . . 0.0 108.746 -177.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 27.0 mtt -73.33 139.56 46.13 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 126.357 2.98 . . . . 0.0 111.43 -175.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -81.79 170.65 15.46 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 118.973 -2.329 . . . . 0.0 109.438 163.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -59.97 -17.43 38.1 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 117.135 -3.478 . . . . 0.0 110.446 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 48.1 ttt-85 -82.04 -48.39 11.47 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.676 2.39 . . . . 0.0 106.94 -173.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -71.24 -49.28 44.94 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 114.157 -2.83 . . . . 0.0 112.162 178.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 83.0 mt -47.66 -43.27 26.1 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 121.296 1.862 . . . . 0.0 109.279 173.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -61.14 -20.11 62.31 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 119.271 -2.143 . . . . 0.0 113.229 178.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -118.21 -54.22 2.31 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 124.907 3.503 . . . . 0.0 116.785 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.03 -24.56 64.61 Favored 'General case' 0 N--CA 1.446 -0.653 1 C-N-CA 132.142 4.177 . . . . 0.0 113.371 -177.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 60.0 mt -131.28 -3.96 3.86 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 113.274 -1.784 . . . . 0.0 113.258 172.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.9 21.28 67.45 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 126.558 2.028 . . . . 0.0 116.603 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.55 110.85 22.43 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 118.608 -2.701 . . . . 0.0 108.959 -163.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.19 176.53 48.7 Favored Glycine 0 CA--C 1.523 0.565 0 O-C-N 118.811 -2.431 . . . . 0.0 117.289 168.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 14.4 mm -53.51 -48.32 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.725 0 CA-C-O 117.751 -1.118 . . . . 0.0 111.869 -166.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.82 -33.98 69.18 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 122.059 2.209 . . . . 0.0 112.977 -177.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 54.1 m -75.93 -48.52 20.9 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.38 3.072 . . . . 0.0 111.213 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 18.9 mm -53.96 -35.94 29.65 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 O-C-N 118.366 -2.709 . . . . 0.0 108.385 167.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 5.3 m -75.64 -27.61 58.46 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 117.17 -1.395 . . . . 0.0 112.917 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -63.69 -48.89 75.31 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 122.7 2.5 . . . . 0.0 110.321 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -76.94 -32.07 50.89 Favored Glycine 0 CA--C 1.525 0.682 0 CA-C-O 118.132 -1.371 . . . . 0.0 112.701 -167.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 89.1 p -68.46 -40.58 81.01 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -61.45 -41.46 97.24 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 118.826 -2.421 . . . . 0.0 110.185 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.6 m -77.94 -24.69 48.12 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 112.391 -3.671 . . . . 0.0 110.127 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.57 -36.66 44.22 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 127.113 2.758 . . . . 0.0 116.917 170.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -60.71 -45.44 94.22 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 125.26 2.457 . . . . 0.0 111.46 169.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . 0.31 . . -71.2 -17.21 62.53 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 118.222 -2.799 . . . . 0.0 117.62 173.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.56 160.17 83.49 Favored Pre-proline 0 N--CA 1.45 -0.451 0 O-C-N 119.906 -1.746 . . . . 0.0 112.548 172.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -67.32 155.75 69.17 Favored 'Trans proline' 0 N--CA 1.447 -1.222 1 C-N-CA 127.942 5.761 . . . . 0.0 118.436 175.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.277 12.9 m -65.81 -36.3 77.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 119.262 0.937 . . . . 0.0 113.452 -177.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.332 7.8 pm0 -59.57 -27.75 66.52 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 -177.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 24.7 tp -83.16 -46.6 12.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.569 1.548 . . . . 0.0 109.41 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 64.8 mtp85 -57.47 -27.3 62.37 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 175.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -99.32 -8.75 24.47 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 174.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -75.01 -62.59 1.5 Allowed 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 127.968 2.507 . . . . 0.0 105.78 168.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 83.2 mt -57.77 -31.74 66.81 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 131.391 3.876 . . . . 0.0 109.029 -169.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -69.62 -43.13 73.34 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 124.267 3.212 . . . . 0.0 111.326 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -71.85 -48.15 48.08 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 124.871 2.272 . . . . 0.0 108.565 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 65.2 t -60.31 -50.03 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 113.481 -1.691 . . . . 0.0 111.455 -170.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 13.5 mt -76.16 -54.56 6.63 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 127.862 3.696 . . . . 0.0 115.399 176.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 60.6 mt -76.6 -36.6 57.42 Favored 'General case' 0 N--CA 1.45 -0.44 1 O-C-N 114.431 -5.168 . . . . 0.0 116.907 -165.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -80.19 -5.88 56.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 112.518 -3.611 . . . . 0.0 108.408 177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 70.6 m -105.73 -10.25 16.85 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 128.398 2.679 . . . . 0.0 109.701 -178.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . 0.497 ' CG ' HH21 ' B' ' 63' ' ' ARG . 9.8 t70 . . . . . 0 C--O 1.25 1.11 0 C-N-CA 129.834 3.253 . . . . 0.0 115.346 -173.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 15.7 mtt . . . . . 0 N--CA 1.472 0.639 0 CA-C-O 123.816 1.769 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.42 147.4 30.99 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 112.587 -2.097 . . . . 0.0 114.747 -178.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -140.67 156.91 46.11 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.854 2.461 . . . . 0.0 113.204 165.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -122.21 164.8 17.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.995 1.718 . . . . 0.0 108.885 175.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 42.9 p -127.99 153.97 78.38 Favored Pre-proline 0 N--CA 1.451 -0.398 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.94 -38.21 93.07 Favored 'Trans proline' 0 N--CA 1.447 -1.261 0 O-C-N 125.69 2.416 . . . . 0.0 116.976 172.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -149.82 148.59 29.36 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 124.72 2.2 . . . . 0.0 110.605 175.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.1 t -145.46 133.79 21.78 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.286 -2.759 . . . . 0.0 114.556 170.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.64 -26.43 59.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 112.95 -3.405 . . . . 0.0 107.806 175.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.33 -34.63 78.77 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 125.853 3.933 . . . . 0.0 110.044 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 18.4 mtt -82.32 -34.48 28.55 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 125.338 1.649 . . . . 0.0 114.84 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.62 -38.82 82.36 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 125.576 1.551 . . . . 0.0 114.337 164.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -67.29 -33.13 74.65 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.619 1.568 . . . . 0.0 112.659 167.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -59.08 -40.98 86.93 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 119.206 -2.184 . . . . 0.0 111.46 167.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -21.52 65.1 Favored 'General case' 0 N--CA 1.449 -0.506 1 O-C-N 114.635 -5.041 . . . . 0.0 117.792 169.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -76.82 -46.56 24.4 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 120.888 -1.132 . . . . 0.0 113.205 177.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -53.92 -23.15 11.91 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 119.191 3.034 . . . . 0.0 119.191 159.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -81.75 -45.13 16.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 127.329 2.251 . . . . 0.0 106.375 171.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 23.8 t-105 -66.9 -37.11 83.75 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 118.072 -2.893 . . . . 0.0 112.406 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mp -73.03 -27.6 61.86 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 127.11 2.756 . . . . 0.0 111.281 -176.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 27.1 ttt180 -75.38 -35.23 61.12 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 119.33 -2.106 . . . . 0.0 113.151 172.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -61.06 -42.38 98.38 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 169.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.368 76.0 t -54.81 -61.99 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 CA-C-O 117.097 -1.43 . . . . 0.0 108.921 167.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -53.24 -43.35 67.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 117.834 2.531 . . . . 0.0 117.834 178.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 60.9 tp -45.17 -55.07 6.11 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 127.721 2.408 . . . . 0.0 112.268 176.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 25.6 tp -67.25 -27.01 66.86 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 119.641 -1.912 . . . . 0.0 114.825 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -56.43 -50.56 71.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 119.398 -2.064 . . . . 0.0 110.302 166.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -68.65 -8.73 44.94 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 119.821 -1.799 . . . . 0.0 112.086 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.17 -20.77 17.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 -178.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -76.0 -22.89 55.34 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-O 125.796 2.712 . . . . 0.0 115.123 164.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . 0.305 45.7 tt0 -62.07 -16.37 51.66 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 129.598 3.159 . . . . 0.0 116.582 169.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -147.24 6.01 0.85 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.263 3.6 m-20 59.16 29.98 19.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 118.228 2.677 . . . . 0.0 118.228 -173.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 96.9 mt -82.31 7.52 13.72 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 118.679 -2.513 . . . . 0.0 114.536 162.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 7.0 p-80 -59.33 -44.99 92.56 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 119.121 3.008 . . . . 0.0 119.121 173.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.323 6.5 mt -60.25 -55.44 45.29 Favored Pre-proline 0 N--CA 1.452 -0.352 0 O-C-N 125.085 1.491 . . . . 0.0 110.312 175.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -54.35 -50.62 12.86 Favored 'Trans proline' 0 N--CA 1.445 -1.329 0 C-N-CA 123.488 2.792 . . . . 0.0 113.12 174.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 56.6 tp -55.4 -30.53 60.58 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 173.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.387 15.3 mt -94.92 -18.48 21.08 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 122.496 2.407 . . . . 0.0 114.187 177.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -67.24 -26.18 66.46 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.596 -1.192 . . . . 0.0 111.635 161.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 19.9 tp -77.5 -52.54 8.9 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.638 2.375 . . . . 0.0 114.708 170.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 49.2 mmm -78.72 -15.8 58.01 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 117.117 -1.421 . . . . 0.0 113.752 -164.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 7.8 mp -121.29 144.45 48.62 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 130.669 3.588 . . . . 0.0 113.523 -175.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 55.7 p -75.42 157.13 84.94 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-N 122.26 2.3 . . . . 0.0 113.356 164.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -57.88 -34.1 97.88 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 CA-C-N 121.52 1.578 . . . . 0.0 110.872 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.74 -41.18 94.84 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.868 172.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -67.83 -31.49 71.38 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.652 1.181 . . . . 0.0 112.309 176.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . 0.435 ' HD2' ' CE2' ' D' ' 19' ' ' TRP . 85.8 mtm-85 -69.75 -44.08 70.94 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.067 2.147 . . . . 0.0 110.888 175.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . 0.254 40.5 tt0 -68.89 -22.65 64.17 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 127.967 2.507 . . . . 0.0 114.34 168.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.51 -28.76 64.13 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 121.62 2.009 . . . . 0.0 110.704 173.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 57.2 mt -74.75 -46.11 39.47 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 118.424 2.75 . . . . 0.0 118.424 177.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.49 -43.8 36.26 Favored Glycine 0 CA--C 1.526 0.766 0 O-C-N 126.482 2.364 . . . . 0.0 110.532 169.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 99.6 m -59.59 -55.92 28.45 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.576 1.95 . . . . 0.0 109.958 178.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -57.69 -42.03 82.86 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 115.5 -2.19 . . . . 0.0 113.504 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 50.2 t -58.59 -36.02 57.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 CA-C-N 124.464 3.302 . . . . 0.0 114.671 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -80.82 -30.91 35.73 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 113.536 -1.666 . . . . 0.0 110.788 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . 0.325 7.9 mt -60.16 -51.67 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 1 O-C-N 115.6 -4.438 . . . . 0.0 110.755 165.039 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . 0.267 62.5 t -49.08 -55.81 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 C-N-CA 125.488 1.515 . . . . 0.0 113.484 174.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -49.05 -45.71 43.31 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.338 1.855 . . . . 0.0 114.672 174.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . 0.265 29.9 mm-40 -78.83 -11.01 59.98 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 123.179 1.466 . . . . 0.0 114.882 -174.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 46.2 mt -101.53 -4.5 26.63 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 115.21 -2.329 . . . . 0.0 108.847 168.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.53 -39.95 11.08 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 114.362 -2.732 . . . . 0.0 113.222 166.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 7.9 ttm105 -67.38 -31.62 71.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 126.139 2.15 . . . . 0.0 113.664 167.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.84 17.23 73.12 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-N 113.71 -1.587 . . . . 0.0 116.746 171.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -97.94 -2.02 41.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 121.644 2.722 . . . . 0.0 112.03 -160.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 19.1 mmt -79.38 136.7 37.05 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 124.851 1.344 . . . . 0.0 108.547 -177.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 65.7 p -90.33 174.8 7.38 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 129.274 3.029 . . . . 0.0 113.001 166.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -57.93 -40.49 80.56 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -173.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 39.0 ttp-105 -57.17 -46.25 82.97 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 126.155 1.782 . . . . 0.0 109.417 173.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -80.42 -22.29 41.34 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 119.724 -1.86 . . . . 0.0 111.279 -170.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 16.3 mt -73.25 -21.14 60.69 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.038 -2.914 . . . . 0.0 110.799 172.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -89.06 -54.64 4.02 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.894 -2.379 . . . . 0.0 112.382 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -72.55 -49.04 35.32 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 125.191 1.557 . . . . 0.0 111.835 -172.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -73.31 -38.87 65.69 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 115.909 -1.996 . . . . 0.0 115.993 177.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 8.0 mp -97.0 -30.86 12.83 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 120.77 3.618 . . . . 0.0 120.77 -171.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.18 -160.37 31.38 Favored Glycine 0 C--N 1.337 0.608 0 CA-C-O 124.021 1.901 . . . . 0.0 114.844 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.84 -21.58 59.18 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 116.998 2.221 . . . . 0.0 116.998 -175.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.53 -12.71 9.83 Favored Glycine 0 CA--C 1.522 0.531 0 C-N-CA 128.858 3.123 . . . . 0.0 117.204 173.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 16.8 tt -54.11 -38.09 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 161.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.86 -46.35 89.58 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 113.915 -2.945 . . . . 0.0 110.858 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 40.6 m -50.68 -32.54 19.57 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 129.603 3.161 . . . . 0.0 115.669 166.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.298 52.0 mm -89.18 -10.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 119.441 -2.037 . . . . 0.0 114.073 177.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 39.8 p -136.67 5.1 2.87 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 118.285 -1.366 . . . . 0.0 114.215 -161.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 52.5 mtp85 -126.43 158.98 34.58 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 123.433 1.587 . . . . 0.0 110.723 169.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.64 163.37 31.36 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-O 117.155 -1.914 . . . . 0.0 115.118 -178.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . 0.317 20.0 m -67.55 -12.88 61.39 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 127.334 2.432 . . . . 0.0 117.048 -167.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . 0.268 63.2 m-80 -99.83 -1.81 36.59 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 112.013 -2.358 . . . . 0.0 114.153 -179.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 52.7 p -70.06 167.0 18.58 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 121.101 1.773 . . . . 0.0 110.395 -174.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 27.2 tp -56.45 -29.53 61.78 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -161.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 45.3 mttt -99.54 -4.8 30.39 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 118.786 -2.446 . . . . 0.0 116.164 170.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.33 -23.9 22.14 Favored 'General case' 0 N--CA 1.452 -0.355 1 O-C-N 115.536 -4.478 . . . . 0.0 115.38 166.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.45 156.61 30.06 Favored Pre-proline 0 N--CA 1.449 -0.514 0 C-N-CA 124.849 1.26 . . . . 0.0 112.938 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -63.72 147.26 92.65 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 O-C-N 116.667 -2.333 . . . . 0.0 110.584 -177.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 68.3 t -62.58 -31.08 50.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 127.751 2.421 . . . . 0.0 111.671 -172.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . 0.275 22.6 pm0 -65.24 -28.27 69.24 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.566 1.547 . . . . 0.0 114.213 175.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 13.7 tp -82.97 -42.5 17.52 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.395 -0.812 . . . . 0.0 108.891 177.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 -61.1 -54.39 45.2 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 127.927 2.491 . . . . 0.0 110.566 -175.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -52.71 -53.5 46.82 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 127.787 3.18 . . . . 0.0 112.665 172.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 66.9 t90 -64.08 -39.17 93.48 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -177.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' C' ' 100' ' ' LEU . 13.3 mt -60.1 -39.28 85.59 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 116.948 -1.901 . . . . 0.0 114.642 172.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -64.23 -30.64 71.69 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.271 1.028 . . . . 0.0 112.711 175.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -67.86 -37.52 81.95 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 128.724 2.81 . . . . 0.0 116.751 173.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 61.6 t -86.42 -51.17 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 129.757 3.223 . . . . 0.0 113.315 -176.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 70.4 mt -77.76 -19.12 55.67 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 113.852 -2.975 . . . . 0.0 108.13 -174.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 35.1 mt -124.5 49.3 1.83 Allowed 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 122.564 2.438 . . . . 0.0 111.224 176.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 4.5 pttp -74.32 155.13 38.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 114.908 -2.472 . . . . 0.0 116.142 -172.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 27.6 m -132.88 -32.99 1.2 Allowed 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 128.03 3.331 . . . . 0.0 111.838 -166.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 35.3 t70 . . . . . 0 C--O 1.251 1.134 0 O-C-N 118.403 -2.686 . . . . 0.0 117.983 -163.935 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 14.6 ttt . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 116.346 -1.787 . . . . 0.0 109.876 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.56 152.29 36.55 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 127.644 2.378 . . . . 0.0 112.075 -176.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -122.89 159.79 27.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 111.059 -2.791 . . . . 0.0 109.689 164.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -142.06 142.14 32.83 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 126.619 1.968 . . . . 0.0 115.909 158.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 55.0 p -83.62 157.49 64.2 Favored Pre-proline 0 N--CA 1.447 -0.596 0 O-C-N 116.712 -3.742 . . . . 0.0 110.84 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -63.62 -20.7 69.7 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 115.089 -2.807 . . . . 0.0 111.405 169.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -161.29 137.43 8.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 172.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 18.1 t -78.72 132.91 37.15 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 126.896 2.623 . . . . 0.0 111.602 -167.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.02 -34.54 74.99 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 116.615 -1.659 . . . . 0.0 114.209 169.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.69 -38.99 57.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 125.277 2.465 . . . . 0.0 114.722 166.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 12.8 mmt -81.91 -22.95 36.52 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 115.635 -2.126 . . . . 0.0 114.879 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.56 -17.93 57.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 118.59 2.811 . . . . 0.0 118.59 165.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . 0.336 40.0 tp10 -76.97 -45.04 28.94 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 116.96 -1.495 . . . . 0.0 110.622 156.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -65.64 -31.66 72.81 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 117.687 2.477 . . . . 0.0 117.687 -173.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.95 -21.05 63.3 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 176.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -86.1 -24.09 26.41 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 165.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -81.66 -30.33 32.77 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.206 -1.559 . . . . 0.0 108.677 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -70.76 -22.41 62.4 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 117.901 -3.0 . . . . 0.0 111.881 169.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . 0.435 ' CE2' ' HD2' ' C' ' 48' ' ' ARG . 6.7 t-105 -87.39 -48.44 7.97 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 114.806 -2.521 . . . . 0.0 110.932 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 46.3 mt -57.13 -34.27 68.21 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 126.925 2.09 . . . . 0.0 109.504 167.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -63.11 -35.54 80.61 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 116.729 -3.732 . . . . 0.0 114.377 169.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -69.68 -36.71 76.22 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 121.255 1.843 . . . . 0.0 110.037 167.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 97.9 t -68.46 -35.86 72.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-N 122.455 2.389 . . . . 0.0 110.739 -177.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.91 -42.35 94.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 128.188 2.595 . . . . 0.0 114.158 168.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.89 -47.8 73.62 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 116.27 -1.824 . . . . 0.0 109.236 177.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 39.5 tp -64.44 -38.31 90.59 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 125.537 1.773 . . . . 0.0 114.844 177.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -49.67 -58.06 6.02 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 123.846 0.858 . . . . 0.0 111.878 166.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -74.41 -12.87 60.63 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.133 -1.413 . . . . 0.0 113.127 -176.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.396 . . -77.08 -27.41 54.24 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.691 2.478 . . . . 0.0 117.691 157.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -68.0 -29.99 69.14 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.362 -3.336 . . . . 0.0 113.101 171.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -73.21 -36.95 66.58 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 129.187 2.995 . . . . 0.0 116.254 -172.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 40.7 p30 -105.92 9.91 32.55 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 125.259 1.599 . . . . 0.0 113.571 171.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 64.95 30.7 11.81 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 131.391 3.876 . . . . 0.0 115.287 -176.114 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 34.9 mt -96.39 12.91 29.57 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 118.713 -2.492 . . . . 0.0 116.228 174.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -53.77 51.67 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 128.07 2.548 . . . . 0.0 110.15 178.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.27 1.1 mt -63.1 -50.88 73.88 Favored Pre-proline 0 N--CA 1.448 -0.534 0 O-C-N 121.246 -0.909 . . . . 0.0 111.679 -171.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -53.09 -27.35 36.31 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 N-CA-C 118.606 2.502 . . . . 0.0 118.606 166.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 27.2 tp -83.45 -43.2 16.09 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 120.084 1.311 . . . . 0.0 111.971 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 93.1 mt -62.35 -37.36 85.37 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 119.991 1.269 . . . . 0.0 110.425 170.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -81.9 -30.72 31.78 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 116.734 -1.603 . . . . 0.0 113.769 -174.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 13.8 tp -58.52 -58.64 7.64 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 129.389 3.076 . . . . 0.0 111.166 157.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.9 mmt -56.04 -35.97 67.5 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.167 2.187 . . . . 0.0 112.677 -178.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 70.0 mt -121.7 124.98 45.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 117.576 -3.202 . . . . 0.0 106.365 -161.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 81.4 p -60.42 153.49 59.56 Favored Pre-proline 0 N--CA 1.453 -0.313 0 C-N-CA 127.665 2.386 . . . . 0.0 109.927 162.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -74.61 -27.12 11.09 Favored 'Trans proline' 0 N--CA 1.449 -1.133 0 CA-C-O 116.606 -1.498 . . . . 0.0 115.513 -158.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -15.08 63.04 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 113.988 -2.91 . . . . 0.0 114.711 165.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -76.99 -29.72 55.63 Favored 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 125.544 1.777 . . . . 0.0 115.294 167.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 28.9 mtm-85 -77.06 -37.97 53.58 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.833 1.653 . . . . 0.0 112.022 175.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -56.82 -41.44 77.8 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 123.728 1.728 . . . . 0.0 114.414 166.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.319 . . -64.32 -42.22 96.42 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.76 -1.838 . . . . 0.0 113.877 175.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 20.0 mt -72.05 -38.72 69.43 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.12 -28.58 73.79 Favored Glycine 0 C--N 1.336 0.545 0 CA-C-N 120.034 1.288 . . . . 0.0 110.724 167.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 91.2 m -70.5 -23.08 62.6 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 119.164 -2.374 . . . . 0.0 110.928 170.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -81.6 -23.86 36.8 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 116.622 -3.799 . . . . 0.0 110.329 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 69.5 t -58.33 -39.14 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 120.594 1.543 . . . . 0.0 113.859 164.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -84.4 -19.44 33.53 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.839 -1.788 . . . . 0.0 115.747 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 80.4 mt -66.8 -51.57 54.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 C-N-CA 127.315 2.246 . . . . 0.0 110.353 160.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . 0.278 67.9 t -55.7 -52.35 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 O-C-N 126.352 2.282 . . . . 0.0 109.099 169.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -56.2 -42.55 77.36 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 120.065 1.302 . . . . 0.0 112.289 -168.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -76.16 -35.33 59.23 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 119.007 2.965 . . . . 0.0 119.007 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 54.4 mt -53.66 -37.32 63.03 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 115.562 -2.161 . . . . 0.0 113.22 167.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 94.1 mt -80.74 -36.2 32.36 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 127.984 2.514 . . . . 0.0 107.358 177.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -68.53 -50.49 51.58 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 122.488 2.404 . . . . 0.0 110.261 -177.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.63 48.15 8.2 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-O 114.933 -3.148 . . . . 0.0 106.651 161.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -130.74 -54.5 1.07 Allowed 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 126.385 1.874 . . . . 0.0 107.081 179.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 15.7 mmt -80.28 49.91 1.19 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.766 2.426 . . . . 0.0 108.679 -176.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 23.6 p -82.4 -166.02 1.17 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 119.977 3.325 . . . . 0.0 119.977 -175.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 50.59 -95.47 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 126.124 1.77 . . . . 0.0 113.761 169.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -70.58 -39.14 74.03 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 117.498 -3.251 . . . . 0.0 113.025 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -79.01 -38.71 35.96 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 112.885 -1.961 . . . . 0.0 110.656 -161.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . 0.3 3.8 mt -56.65 -34.76 67.62 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.415 170.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -78.45 -29.85 47.14 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 177.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -116.65 -16.81 10.68 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 128.177 2.591 . . . . 0.0 116.207 -162.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . 0.27 15.8 tp10 -122.14 -44.93 2.26 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 130.971 3.708 . . . . 0.0 107.821 -173.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -82.17 -47.15 12.85 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 113.282 -3.247 . . . . 0.0 114.879 165.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 99.53 -164.14 19.93 Favored Glycine 0 CA--C 1.523 0.592 0 CA-C-N 121.144 1.793 . . . . 0.0 113.415 155.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.69 -22.49 66.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 125.808 1.534 . . . . 0.0 113.947 -159.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.94 -15.81 22.26 Favored Glycine 0 C--N 1.337 0.6 1 CA-C-O 112.483 -4.509 . . . . 0.0 112.099 171.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 10.0 tt -49.8 -22.11 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 1 CA-C-N 124.211 4.006 . . . . 0.0 114.926 172.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -102.19 -15.21 16.73 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 131.356 3.862 . . . . 0.0 112.649 -171.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 57.1 m -64.78 -32.4 74.07 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 116.264 -1.827 . . . . 0.0 113.341 153.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 28.0 mm -98.18 -23.55 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 126.817 2.047 . . . . 0.0 113.388 -173.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 44.8 p -118.17 0.56 11.79 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 118.836 -2.415 . . . . 0.0 115.118 177.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -120.22 -177.53 3.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.308 1.843 . . . . 0.0 108.083 154.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.14 166.3 35.51 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-O 117.183 -1.898 . . . . 0.0 112.127 -144.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 53.3 p -77.83 -32.31 52.13 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 118.872 2.916 . . . . 0.0 118.872 -166.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -131.57 101.71 5.61 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.014 -1.448 . . . . 0.0 112.485 161.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 69.1 p -101.33 -177.28 3.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 124.273 1.987 . . . . 0.0 112.433 -172.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 tp -63.34 -22.5 66.91 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.165 -1.38 . . . . 0.0 113.371 168.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 46.5 tttt -75.17 -15.48 60.57 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.453 -2.03 . . . . 0.0 111.306 170.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -110.1 -15.36 14.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 115.874 -2.013 . . . . 0.0 115.263 -170.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 38.68 92.43 0.05 OUTLIER Pre-proline 0 N--CA 1.45 -0.45 0 O-C-N 126.539 2.399 . . . . 0.0 115.886 172.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.365 15.2 Cg_exo 24.43 38.49 0.0 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.342 0 CA-C-O 116.319 -1.617 . . . . 0.0 115.948 50.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 15.4 t -51.8 -33.34 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 126.137 1.775 . . . . 0.0 107.45 -176.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.332 0.0 OUTLIER -76.38 -43.27 41.36 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -174.36 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 14.7 tp -59.51 -46.85 87.66 Favored 'General case' 0 N--CA 1.447 -0.606 1 O-C-N 129.263 4.102 . . . . 0.0 105.805 174.201 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 45.2 ttp180 -65.94 -55.1 18.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.62 0.768 . . . . 0.0 110.43 -171.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -45.22 -37.64 4.76 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 126.638 2.461 . . . . 0.0 113.564 173.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . 0.272 90.4 t90 -74.03 -52.67 11.99 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 172.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 97.0 mt -51.39 -29.65 16.39 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 118.519 -2.613 . . . . 0.0 112.579 169.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -82.73 -16.22 48.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 120.049 -1.657 . . . . 0.0 110.933 -175.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -116.38 6.07 13.61 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 117.0 -3.562 . . . . 0.0 115.875 175.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 44.1 t -109.88 -38.14 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 128.122 2.569 . . . . 0.0 108.87 170.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 31.3 mt -99.34 -20.62 16.42 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 121.965 2.166 . . . . 0.0 112.198 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 4.3 mp -116.6 44.49 2.01 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 126.928 3.251 . . . . 0.0 112.677 171.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 17.1 pttp -71.64 -179.89 2.78 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 112.136 -2.302 . . . . 0.0 113.704 -174.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 69.2 m -50.97 -31.8 18.99 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.619 -1.173 . . . . 0.0 112.636 -173.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 . . . . . 0 C--O 1.251 1.157 1 O-C-N 116.297 -4.002 . . . . 0.0 114.487 -175.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.3 mmt . . . . . 0 N--CA 1.472 0.63 0 CA-C-O 116.101 -1.904 . . . . 0.0 114.123 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -43.7 -33.4 1.23 Allowed 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 119.82 3.267 . . . . 0.0 119.82 -174.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -88.05 -35.82 17.32 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -178.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -69.12 -58.85 3.52 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 127.086 2.154 . . . . 0.0 113.959 170.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . 0.277 36.9 m -86.52 119.99 71.75 Favored Pre-proline 0 N--CA 1.453 -0.307 0 CA-C-N 111.422 -2.626 . . . . 0.0 114.858 -175.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . 0.297 41.8 Cg_endo -75.93 6.64 3.66 Favored 'Trans proline' 0 N--CA 1.448 -1.165 1 C-N-CA 125.833 4.356 . . . . 0.0 120.066 -176.487 . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -152.96 156.8 39.57 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 129.423 3.089 . . . . 0.0 112.725 -171.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.1 p -154.28 153.11 31.13 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 125.352 2.501 . . . . 0.0 105.497 153.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . 0.352 . . -66.65 -43.88 83.41 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 113.136 -3.316 . . . . 0.0 114.146 176.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.29 -31.31 43.25 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 113.865 -2.969 . . . . 0.0 111.723 167.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 16.9 tpt -85.26 -30.41 23.83 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 120.944 1.702 . . . . 0.0 108.247 177.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.07 -37.0 85.44 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 118.426 -1.31 . . . . 0.0 113.583 174.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -62.91 -39.29 94.09 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 118.981 -2.324 . . . . 0.0 112.884 171.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -72.04 -30.43 65.17 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.134 -1.394 . . . . 0.0 112.473 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 37.4 mmt-85 -75.16 -28.08 59.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 162.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -64.95 -42.33 94.71 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 117.036 -1.459 . . . . 0.0 110.543 171.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -79.68 -18.15 52.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 125.049 1.468 . . . . 0.0 112.276 -175.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -74.28 -36.55 63.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.734 2.814 . . . . 0.0 107.334 173.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 11.1 t-105 -71.17 -62.08 1.53 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 124.914 2.292 . . . . 0.0 110.697 172.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.3 mt -57.05 -13.81 3.17 Favored 'General case' 0 N--CA 1.447 -0.604 1 O-C-N 115.535 -4.478 . . . . 0.0 117.422 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -52.37 -44.95 65.55 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 118.732 -2.48 . . . . 0.0 113.798 160.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -72.4 -35.66 68.45 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 118.034 -2.916 . . . . 0.0 114.221 179.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.8 t -62.65 -34.72 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 124.141 1.924 . . . . 0.0 110.226 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -76.5 -31.49 57.75 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.47 -2.643 . . . . 0.0 114.352 171.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 27.3 tp -68.13 -66.23 0.59 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.695 1.198 . . . . 0.0 111.588 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.0 tp -46.37 -29.45 1.69 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 117.514 2.413 . . . . 0.0 117.514 167.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -62.8 -49.39 75.12 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 116.329 -3.982 . . . . 0.0 110.924 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -70.94 -17.86 62.66 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 116.501 -1.714 . . . . 0.0 112.563 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . 0.301 . . -84.28 -28.68 26.99 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 114.482 1.289 . . . . 0.0 114.482 176.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -56.33 -49.67 73.69 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.094 1.758 . . . . 0.0 110.435 163.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -62.08 -7.16 3.61 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 118.404 2.742 . . . . 0.0 118.404 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -126.66 8.66 6.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 129.625 3.17 . . . . 0.0 112.29 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 42.41 21.64 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 118.282 2.697 . . . . 0.0 118.282 -168.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 mt -84.06 2.86 37.19 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.466 1.906 . . . . 0.0 111.898 172.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -66.35 -45.38 80.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 -178.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 9.1 mt -64.57 -40.47 50.1 Favored Pre-proline 0 N--CA 1.451 -0.423 0 C-N-CA 116.44 -2.104 . . . . 0.0 112.333 174.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 83.0 Cg_exo -60.69 -39.65 61.77 Favored 'Trans proline' 0 N--CA 1.449 -1.119 1 C-N-CA 126.791 4.994 . . . . 0.0 112.584 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.9 tp -63.32 -47.66 81.31 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 125.427 2.537 . . . . 0.0 114.925 169.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 62.5 mt -70.41 -37.31 74.43 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 118.384 -2.698 . . . . 0.0 112.105 -169.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -68.34 -9.42 47.81 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 119.836 -1.79 . . . . 0.0 114.035 171.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.293 1.0 OUTLIER -86.34 -56.56 3.38 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 118.263 -2.773 . . . . 0.0 106.89 178.902 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.3 mmt -66.17 -22.77 66.37 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.367 48.5 mt -123.56 131.28 53.58 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.276 2.63 . . . . 0.0 112.946 -170.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.8 p -87.56 152.74 52.41 Favored Pre-proline 0 N--CA 1.447 -0.575 0 CA-C-O 117.229 -1.367 . . . . 0.0 111.899 177.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -49.69 -48.24 19.96 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 123.709 2.939 . . . . 0.0 118.619 -175.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -65.66 -35.77 81.74 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 116.693 -1.622 . . . . 0.0 110.365 175.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -60.69 -40.14 91.06 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 123.887 3.04 . . . . 0.0 112.71 169.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 46.0 mtm-85 -65.86 -54.36 27.66 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -50.45 -45.76 56.23 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.391 1.476 . . . . 0.0 108.377 170.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.37 -33.97 77.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 117.638 -3.164 . . . . 0.0 109.983 -178.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.8 mt -75.75 -27.5 58.11 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 125.262 1.602 . . . . 0.0 113.554 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -64.27 -47.14 87.79 Favored Glycine 0 CA--C 1.521 0.447 0 CA-C-O 115.436 -2.869 . . . . 0.0 108.229 172.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 m -57.79 -36.31 72.01 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 120.419 2.11 . . . . 0.0 114.321 174.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 82.2 mtt180 -59.54 -19.85 51.36 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 117.4 2.37 . . . . 0.0 117.4 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.9 t -64.86 -45.74 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 CA-C-O 117.25 -1.357 . . . . 0.0 113.932 167.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 46.6 ttt180 -71.35 -26.57 62.87 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 125.759 1.912 . . . . 0.0 116.142 171.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.304 34.5 mt -61.66 -53.34 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 128.047 3.342 . . . . 0.0 115.679 165.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.0 t -67.55 -30.76 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 O-C-N 126.558 2.411 . . . . 0.0 110.544 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -50.97 -55.16 18.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 116.397 -3.939 . . . . 0.0 115.369 172.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -76.05 -29.28 57.97 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.158 1.783 . . . . 0.0 106.393 -174.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -80.56 -18.61 47.86 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 113.087 -3.34 . . . . 0.0 112.077 178.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.5 tp -87.18 -35.47 18.56 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 113.131 -3.319 . . . . 0.0 109.18 167.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -66.66 -45.41 79.0 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 123.294 2.77 . . . . 0.0 109.448 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.65 20.42 44.21 Favored Glycine 0 CA--C 1.525 0.673 0 CA-C-O 125.689 2.827 . . . . 0.0 113.183 158.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -105.06 -43.46 5.04 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.919 1.688 . . . . 0.0 113.531 -170.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 24.6 mtp -79.49 145.32 33.3 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.796 -3.065 . . . . 0.0 109.448 178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.55 165.17 21.38 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 126.091 2.12 . . . . 0.0 113.494 170.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -67.68 -27.99 67.31 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 126.481 2.363 . . . . 0.0 108.662 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -78.45 -33.34 48.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.823 1.249 . . . . 0.0 113.542 173.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -67.24 -40.32 86.28 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 124.223 1.963 . . . . 0.0 109.533 172.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.4 mt -68.68 -22.38 64.38 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 118.51 -2.619 . . . . 0.0 110.822 -175.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -61.6 -46.05 91.48 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 116.816 -1.564 . . . . 0.0 114.852 167.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -60.73 -15.72 32.25 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 120.22 1.373 . . . . 0.0 113.27 172.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -91.05 -50.8 5.66 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 124.937 2.303 . . . . 0.0 113.821 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.6 mt -100.4 -20.26 15.89 Favored 'General case' 0 N--CA 1.451 -0.381 1 N-CA-C 121.895 4.035 . . . . 0.0 121.895 -172.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 61.07 -4.85 0.25 Allowed Glycine 0 CA--C 1.521 0.418 0 N-CA-C 118.608 2.203 . . . . 0.0 118.608 -164.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.71 154.08 39.95 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 125.189 2.423 . . . . 0.0 112.827 -178.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.75 136.97 50.75 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 126.45 1.976 . . . . 0.0 117.021 171.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 26.8 mt -74.91 -25.92 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 O-C-N 118.014 -3.051 . . . . 0.0 113.464 -175.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . 0.298 . . -58.3 -33.97 70.05 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 120.159 3.392 . . . . 0.0 120.159 167.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . 0.277 33.4 p -83.12 -26.38 31.05 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 114.582 -2.627 . . . . 0.0 113.971 174.048 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 13.7 mm -68.66 -38.01 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 162.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.2 m -64.91 -44.75 88.53 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 118.633 -2.542 . . . . 0.0 112.856 176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -60.68 -49.13 78.73 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 113.732 -1.576 . . . . 0.0 111.85 172.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -50.17 -38.55 32.9 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 117.071 1.588 . . . . 0.0 117.071 171.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.4 m -63.58 -41.79 98.34 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 128.877 2.871 . . . . 0.0 114.347 174.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 49.4 m-20 -77.67 -38.98 46.41 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.065 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 70.3 m -54.51 -33.24 59.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 126.426 1.89 . . . . 0.0 114.247 166.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 37.3 tp -69.89 -49.27 53.87 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.862 1.665 . . . . 0.0 111.857 172.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -56.28 -37.82 70.37 Favored 'General case' 0 N--CA 1.446 -0.658 0 O-C-N 117.157 -3.464 . . . . 0.0 107.728 172.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.89 5.05 26.77 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 121.434 1.925 . . . . 0.0 114.579 -173.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.86 147.65 94.27 Favored Pre-proline 0 N--CA 1.452 -0.367 0 C-N-CA 127.959 2.504 . . . . 0.0 113.131 166.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -59.43 150.14 77.15 Favored 'Trans proline' 0 N--CA 1.446 -1.285 0 C-N-CA 125.094 3.863 . . . . 0.0 112.925 165.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.2 m -59.1 -36.91 65.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 O-C-N 126.116 2.135 . . . . 0.0 105.725 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -73.88 -37.89 64.57 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 123.498 2.863 . . . . 0.0 109.584 -168.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 21.8 tp -61.12 -43.82 98.3 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 117.365 -3.334 . . . . 0.0 111.479 168.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 50.7 mtm-85 -67.31 -40.01 85.98 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 121.477 1.944 . . . . 0.0 113.322 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.37 -43.12 83.3 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 126.842 2.057 . . . . 0.0 115.266 166.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -63.39 -53.56 50.59 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 116.299 -1.81 . . . . 0.0 115.831 164.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 51.4 mt -59.72 -25.05 64.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 127.44 2.296 . . . . 0.0 112.488 -177.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -67.73 -35.23 78.38 Favored 'General case' 0 N--CA 1.452 -0.332 1 O-C-N 116.257 -4.027 . . . . 0.0 111.895 170.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -80.11 -24.72 40.32 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 120.529 -1.357 . . . . 0.0 111.83 178.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.4 t -66.72 -61.04 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 O-C-N 117.314 -3.366 . . . . 0.0 114.291 164.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.2 mt -87.5 -31.66 19.84 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 117.375 2.361 . . . . 0.0 117.375 -166.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 24.4 mt -109.14 -4.64 16.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 -163.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.8 tttt -87.73 -33.8 18.58 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -164.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 17.0 p -78.07 -26.06 47.99 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 116.94 2.2 . . . . 0.0 116.94 -171.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.15 0 CA-C-O 124.045 1.878 . . . . 0.0 113.474 -178.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.683 0 CA-C-O 116.082 -1.913 . . . . 0.0 107.966 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.62 -23.49 56.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 114.815 -2.517 . . . . 0.0 114.547 -142.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -98.75 5.32 47.63 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 123.892 3.042 . . . . 0.0 109.447 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . 0.337 27.0 tp60 -113.66 -55.35 2.52 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.476 1.91 . . . . 0.0 107.895 -172.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' SER . . . . . 0.411 ' HA ' ' HD3' ' B' ' 6' ' ' PRO . 61.0 m -67.86 123.64 87.52 Favored Pre-proline 0 N--CA 1.451 -0.411 0 O-C-N 126.556 2.41 . . . . 0.0 110.515 179.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' B' ' 5' ' ' SER . 79.0 Cg_exo -75.94 -21.69 13.93 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 124.304 3.336 . . . . 0.0 110.261 -170.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -101.59 136.87 40.71 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.853 1.206 . . . . 0.0 110.598 158.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 26.3 t -165.43 136.25 3.82 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 130.216 3.406 . . . . 0.0 115.637 171.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.99 -29.43 64.22 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 112.418 -2.174 . . . . 0.0 114.027 171.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.16 -36.45 77.39 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 118.744 -1.182 . . . . 0.0 109.262 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -34.72 67.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 117.182 2.29 . . . . 0.0 117.182 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.02 -45.23 91.24 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 123.41 1.576 . . . . 0.0 109.711 173.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . 0.302 48.3 tp10 -61.73 -38.09 86.65 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.501 2.72 . . . . 0.0 110.628 174.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -70.3 -42.36 72.1 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 122.232 2.287 . . . . 0.0 109.39 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -80.8 -2.81 48.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 115.004 -2.427 . . . . 0.0 112.266 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -82.58 -44.97 15.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 119.933 3.308 . . . . 0.0 119.933 152.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -65.14 -21.38 66.78 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 170.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -64.95 -37.04 86.33 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 117.88 2.548 . . . . 0.0 117.88 161.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 15.9 t-105 -68.44 -41.42 80.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 117.143 -1.408 . . . . 0.0 108.815 -177.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 59.7 mt -65.92 -27.79 68.45 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 127.346 2.904 . . . . 0.0 110.739 -176.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -63.31 -31.66 72.88 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 125.251 1.595 . . . . 0.0 114.677 -178.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -74.48 -49.36 22.5 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 124.814 1.321 . . . . 0.0 109.847 171.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.18 -37.41 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.774 1.63 . . . . 0.0 108.48 -173.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.45 -35.01 63.32 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 127.846 2.458 . . . . 0.0 113.601 175.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 16.8 tp -57.79 -50.09 74.42 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 116.879 -3.638 . . . . 0.0 110.597 166.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 22.4 tp -63.52 -45.45 90.54 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.844 178.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -56.73 -44.94 82.13 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.812 2.045 . . . . 0.0 113.419 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -66.55 -43.94 83.73 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 172.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.44 -49.35 55.18 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 119.214 -2.179 . . . . 0.0 114.238 173.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . 0.49 ' C ' ' H ' ' B' ' 32' ' ' ASN . 1.6 m-85 -64.65 -37.69 88.45 Favored 'General case' 0 N--CA 1.45 -0.457 1 CA-C-O 111.37 -4.157 . . . . 0.0 105.206 -176.166 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -57.26 -4.94 0.24 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 123.639 2.927 . . . . 0.0 116.47 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . 0.49 ' H ' ' C ' ' B' ' 30' ' ' TYR . 49.0 m-80 -141.48 3.18 1.69 Allowed 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 129.002 2.921 . . . . 0.0 114.61 -167.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 65.79 19.43 11.35 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 129.503 3.121 . . . . 0.0 118.298 170.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 26.2 mt -87.81 0.69 55.45 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 113.367 -1.742 . . . . 0.0 114.843 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -59.19 -40.92 87.24 Favored 'General case' 0 N--CA 1.45 -0.425 1 O-C-N 115.573 -4.454 . . . . 0.0 113.286 -170.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 29.4 tp -66.89 -47.61 53.46 Favored Pre-proline 0 N--CA 1.451 -0.41 0 CA-C-O 113.51 -3.138 . . . . 0.0 110.109 -178.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.22 -49.07 18.27 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 124.934 3.756 . . . . 0.0 116.567 167.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 21.8 tp -56.08 -40.78 74.13 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 119.201 3.037 . . . . 0.0 119.201 168.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 82.4 mt -73.61 -16.55 61.23 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 113.986 -2.912 . . . . 0.0 109.338 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . 0.344 33.6 m-20 -78.8 -40.46 32.95 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 123.025 2.648 . . . . 0.0 110.945 169.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 56.4 tp -65.88 -30.13 70.69 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 117.336 2.347 . . . . 0.0 117.336 169.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.2 mmt -105.82 -8.27 17.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 121.535 1.97 . . . . 0.0 109.039 -169.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 19.5 mt -134.94 135.23 41.34 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 120.501 1.5 . . . . 0.0 109.298 176.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 59.0 p -75.42 159.32 82.21 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-O 114.037 -2.887 . . . . 0.0 112.879 170.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -67.97 -20.56 44.64 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 CA-C-O 113.025 -2.99 . . . . 0.0 112.885 -172.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.78 -35.65 73.13 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 128.153 3.408 . . . . 0.0 112.372 166.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -86.8 -36.57 18.46 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 126.078 2.111 . . . . 0.0 112.28 -176.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 16.3 mtm-85 -68.19 -30.21 69.25 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.069 -1.423 . . . . 0.0 114.157 170.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -71.38 -25.91 62.56 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 114.651 -2.595 . . . . 0.0 114.135 167.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.81 -53.02 62.41 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 124.592 2.139 . . . . 0.0 114.915 158.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.292 30.7 mt -62.12 -42.78 99.57 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 116.63 -1.653 . . . . 0.0 114.849 -175.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.32 -31.67 79.69 Favored Glycine 0 CA--C 1.522 0.519 0 C-N-CA 118.096 -2.002 . . . . 0.0 113.798 174.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . 0.258 25.8 m -64.01 -45.05 90.67 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.638 2.375 . . . . 0.0 111.303 170.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -73.08 -27.51 61.76 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 118.891 -2.38 . . . . 0.0 112.385 -171.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 23.8 t -56.85 -38.28 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 1 O-C-N 115.01 -4.807 . . . . 0.0 112.889 163.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -76.97 -33.06 57.66 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 120.656 1.571 . . . . 0.0 110.38 -176.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 45.0 mt -64.3 -56.08 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 128.383 2.673 . . . . 0.0 113.536 173.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.267 94.0 t -44.69 -48.16 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 119.136 3.013 . . . . 0.0 119.136 167.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -58.75 -54.72 43.89 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 126.99 2.681 . . . . 0.0 110.924 173.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -59.93 -33.29 71.69 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.831 -1.793 . . . . 0.0 109.437 -175.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 42.6 mt -60.89 -42.59 98.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 116.308 -1.805 . . . . 0.0 108.901 178.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 47.8 mt -72.64 -24.55 61.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.753 1.908 . . . . 0.0 114.995 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 31.9 ttm105 -87.08 -50.12 6.85 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.421 -1.276 . . . . 0.0 112.208 -176.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.02 37.91 36.85 Favored Glycine 0 CA--C 1.525 0.687 0 CA-C-N 121.249 1.841 . . . . 0.0 116.865 177.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -113.23 -28.94 7.44 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 118.237 -2.92 . . . . 0.0 114.14 -175.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 24.5 mtt -82.72 131.17 35.21 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 -168.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 29.6 p -62.61 166.25 5.53 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 128.338 2.655 . . . . 0.0 113.066 170.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -72.15 -25.04 61.55 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 123.921 3.055 . . . . 0.0 112.428 -177.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -63.33 -48.06 79.58 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 131.437 3.895 . . . . 0.0 109.202 169.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -67.06 -38.93 86.65 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 78.0 mt -54.68 -42.05 70.92 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 124.471 1.107 . . . . 0.0 112.133 168.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -71.33 -21.51 62.04 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 115.09 -2.386 . . . . 0.0 113.595 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -130.41 -39.37 1.31 Allowed 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 124.758 3.435 . . . . 0.0 110.159 -163.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -71.38 -49.39 42.62 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 124.874 2.273 . . . . 0.0 112.091 173.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 16.9 mt -96.53 3.86 52.4 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 112.766 -2.016 . . . . 0.0 115.977 170.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 56.79 33.39 63.17 Favored Glycine 0 C--N 1.337 0.593 0 O-C-N 118.037 -2.914 . . . . 0.0 115.387 172.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.71 139.94 52.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 120.952 2.376 . . . . 0.0 115.389 -168.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.23 153.86 36.18 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 127.889 2.661 . . . . 0.0 114.006 169.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . 0.251 23.8 mm -62.85 -23.18 32.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 120.557 2.179 . . . . 0.0 112.148 -172.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.67 -41.89 95.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 119.728 -1.857 . . . . 0.0 112.504 167.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -69.16 -19.18 64.0 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 116.722 -3.736 . . . . 0.0 114.188 174.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 mm -81.35 -54.16 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-O 123.969 1.842 . . . . 0.0 113.591 172.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 25.7 m -55.71 -35.17 65.79 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 118.573 -2.579 . . . . 0.0 114.86 174.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -56.81 -50.65 71.74 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 118.746 -2.471 . . . . 0.0 114.409 168.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -57.25 -42.99 93.73 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 128.402 2.905 . . . . 0.0 118.927 173.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 4.0 p -72.39 -42.41 65.22 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 175.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -47.57 -37.59 12.64 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 158.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 13.8 m -75.32 -28.75 59.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 120.086 1.312 . . . . 0.0 112.487 -176.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 mt -84.68 -43.73 14.07 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 128.179 2.591 . . . . 0.0 106.448 -178.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 18.5 tttm -54.13 -40.8 67.7 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 121.858 2.117 . . . . 0.0 110.711 176.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.05 4.55 44.77 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 117.606 2.447 . . . . 0.0 117.606 -179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.07 135.62 93.95 Favored Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 117.539 2.422 . . . . 0.0 117.539 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -51.83 128.76 27.69 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 N-CA-C 106.755 -2.056 . . . . 0.0 106.755 176.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 34.5 m -65.32 -23.21 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -163.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -62.24 -31.58 72.16 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 170.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 13.7 tp -80.28 -36.54 34.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 126.588 1.955 . . . . 0.0 112.674 171.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 58.0 mtp85 -61.92 -43.96 97.76 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 177.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.69 -37.66 85.19 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.06 1.344 . . . . 0.0 110.415 177.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 79.1 t90 -67.15 -45.62 76.51 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 124.765 2.222 . . . . 0.0 108.906 -172.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 70.2 mt -67.98 -27.26 66.43 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 111.835 -3.936 . . . . 0.0 110.378 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -68.99 -37.09 78.53 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 125.191 3.632 . . . . 0.0 109.266 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -82.04 -30.2 31.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.435 2.294 . . . . 0.0 114.852 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 76.9 t -62.17 -55.3 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 O-C-N 121.327 -0.858 . . . . 0.0 108.859 167.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . 0.29 33.2 mt -82.17 -55.2 4.69 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 124.345 2.021 . . . . 0.0 111.73 -156.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 32.1 mt -79.59 -2.78 44.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 118.087 -2.883 . . . . 0.0 114.13 -163.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -123.33 4.03 9.13 Favored 'General case' 0 N--CA 1.454 -0.268 1 C-N-CA 132.765 4.426 . . . . 0.0 110.926 -177.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 16.5 m -114.43 -35.95 4.78 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 115.532 -2.175 . . . . 0.0 110.949 162.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 33.0 t70 . . . . . 0 C--O 1.25 1.091 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 169.395 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . 0.296 61.9 mtp . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.428 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.294 . . -87.78 132.58 34.11 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 126.327 1.851 . . . . 0.0 110.054 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -109.05 132.75 53.81 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 119.513 1.051 . . . . 0.0 110.899 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -103.59 149.85 24.52 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 166.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 5' ' ' SER . . . . . 0.415 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 32.7 p -125.03 150.45 66.61 Favored Pre-proline 0 N--CA 1.45 -0.446 0 O-C-N 126.682 2.489 . . . . 0.0 109.545 177.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' C' ' 5' ' ' SER . 63.6 Cg_exo -66.32 -9.85 25.37 Favored 'Trans proline' 0 N--CA 1.446 -1.282 0 C-N-CA 124.573 3.515 . . . . 0.0 116.388 -174.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -155.08 158.08 38.52 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 118.082 -2.886 . . . . 0.0 107.589 176.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 10.6 t -150.06 121.89 8.14 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 131.311 3.844 . . . . 0.0 112.065 157.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.34 -40.9 78.98 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 116.845 -3.66 . . . . 0.0 114.579 171.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.57 -41.41 73.26 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 120.78 1.627 . . . . 0.0 115.355 172.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 25.3 mtt -56.67 -40.73 76.05 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.651 1.58 . . . . 0.0 108.694 178.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.94 -37.79 79.09 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 119.305 -2.122 . . . . 0.0 112.94 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -68.95 -16.8 63.83 Favored 'General case' 0 N--CA 1.448 -0.541 1 CA-C-O 109.224 -5.179 . . . . 0.0 116.79 165.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -84.66 -31.1 24.35 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 125.04 3.563 . . . . 0.0 110.868 163.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -33.27 75.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 124.677 1.236 . . . . 0.0 113.114 170.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . 0.265 84.7 t60 -78.59 -30.83 46.9 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 126.019 2.075 . . . . 0.0 109.62 -177.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -69.18 -23.93 63.99 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 117.413 -1.715 . . . . 0.0 114.863 171.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -77.6 -32.82 53.82 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 124.502 1.121 . . . . 0.0 111.84 -179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -64.9 -43.04 94.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 130.899 3.68 . . . . 0.0 114.225 165.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mp -66.86 -30.04 70.1 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 116.612 -3.805 . . . . 0.0 110.279 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -74.53 -34.02 62.9 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 124.085 1.898 . . . . 0.0 110.739 -175.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -59.99 -39.33 85.36 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 115.916 -1.992 . . . . 0.0 112.622 170.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 78.7 t -68.55 -46.23 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 C-N-CA 128.284 2.633 . . . . 0.0 110.983 174.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -64.77 -41.54 95.78 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 117.723 2.49 . . . . 0.0 117.723 176.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 45.7 tp -57.11 -40.94 78.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 127.442 3.496 . . . . 0.0 110.689 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 15.8 tp -71.65 -28.39 63.73 Favored 'General case' 0 N--CA 1.447 -0.579 1 O-C-N 115.955 -4.215 . . . . 0.0 116.579 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -63.86 -44.11 94.08 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.129 -1.891 . . . . 0.0 108.728 170.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -71.69 -31.39 66.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 126.834 2.584 . . . . 0.0 111.229 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.42 83.85 Favored 'General case' 0 N--CA 1.443 -0.785 0 O-C-N 119.15 -2.219 . . . . 0.0 115.232 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -58.17 -24.74 60.06 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 126.768 3.175 . . . . 0.0 117.167 169.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -76.51 -22.99 53.73 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 111.821 -2.445 . . . . 0.0 114.092 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . 0.517 HD22 HD11 ' C' ' 34' ' ' LEU . 32.7 p-10 -135.55 19.38 3.33 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.237 2.215 . . . . 0.0 112.253 -174.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.263 1.6 m-20 60.92 24.34 14.37 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 117.362 -3.336 . . . . 0.0 115.619 178.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . 0.517 HD11 HD22 ' C' ' 32' ' ' ASN . 18.4 mt -89.2 4.46 48.56 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.642 171.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . 0.402 32.6 p-80 -53.66 -56.74 14.6 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 117.454 2.39 . . . . 0.0 117.454 175.397 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.73 -57.15 27.55 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-O 115.862 -2.018 . . . . 0.0 105.813 175.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -52.69 -37.56 75.46 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 CA-C-N 124.323 2.58 . . . . 0.0 114.507 175.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 64.4 tp -74.65 -23.28 58.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 122.927 2.603 . . . . 0.0 112.654 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 35.4 mt -90.09 -38.21 13.71 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 119.512 1.051 . . . . 0.0 112.237 174.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -43.93 -38.4 3.4 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.712 1.205 . . . . 0.0 110.446 162.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 57.6 tp -83.43 -40.15 19.68 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 118.42 -2.675 . . . . 0.0 114.004 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 42' ' ' MET . . . . . 0.452 ' SD ' ' HB3' ' D' ' 54' ' ' ARG . 26.1 mmm -96.07 -6.28 38.98 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 119.786 -1.821 . . . . 0.0 112.143 -171.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 10.1 mp -119.24 146.8 44.92 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.044 1.738 . . . . 0.0 108.158 175.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . 0.387 41.6 p -70.2 156.83 91.2 Favored Pre-proline 0 N--CA 1.449 -0.487 0 C-N-CA 127.468 2.307 . . . . 0.0 114.518 158.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -50.25 -31.46 29.39 Favored 'Trans proline' 0 N--CA 1.45 -1.063 0 C-N-CA 124.743 3.629 . . . . 0.0 112.001 165.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.66 -30.6 65.9 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 127.248 2.219 . . . . 0.0 113.419 175.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -82.21 -36.87 26.83 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 120.447 -1.408 . . . . 0.0 108.453 -174.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . 0.471 ' HD2' ' CE2' ' D' ' 19' ' ' TRP . 73.1 mtm-85 -66.04 -42.33 89.72 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 115.394 -2.241 . . . . 0.0 112.903 171.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -58.04 -52.42 65.6 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 127.901 3.251 . . . . 0.0 111.271 176.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -41.88 -59.89 1.56 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 128.37 2.668 . . . . 0.0 110.791 169.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 28.7 mt -63.78 -34.42 77.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 119.213 3.042 . . . . 0.0 119.213 178.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.84 -56.47 24.95 Favored Glycine 0 C--N 1.336 0.55 0 O-C-N 126.798 2.561 . . . . 0.0 113.124 170.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . 0.315 17.6 m -45.04 -53.77 7.43 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 159.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -59.7 -33.66 71.89 Favored 'General case' 0 N--CA 1.449 -0.498 1 O-C-N 114.756 -4.965 . . . . 0.0 117.88 172.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 17.1 t -57.38 -51.63 67.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 121.19 -0.944 . . . . 0.0 110.612 169.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 45.9 mtp180 -66.52 -26.72 67.29 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 113.396 -3.192 . . . . 0.0 113.593 -174.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . 0.251 77.8 mt -70.42 -27.17 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 105.392 -2.077 . . . . 0.0 105.392 175.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 40.1 t -78.84 -39.7 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 122.369 2.35 . . . . 0.0 112.335 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -49.83 -47.09 51.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 119.042 -2.286 . . . . 0.0 111.366 169.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . 0.403 ' HA ' ' OE1' ' C' ' 60' ' ' GLU . 29.7 mm-40 -75.79 -22.3 56.52 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 115.336 -2.269 . . . . 0.0 116.034 -179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 63.6 mt -86.39 -15.23 41.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 123.579 2.9 . . . . 0.0 108.255 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 16.7 mt -83.03 -41.71 18.35 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 123.256 2.753 . . . . 0.0 108.824 172.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.5 ttm105 -66.02 -25.93 67.29 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 116.687 2.106 . . . . 0.0 116.687 170.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.77 2.39 0.02 OUTLIER Glycine 0 C--N 1.336 0.548 0 C-N-CA 127.517 2.484 . . . . 0.0 118.469 -178.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -66.06 -39.42 90.08 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 121.815 2.807 . . . . 0.0 110.903 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 16.0 mmt -55.58 123.15 13.08 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 124.659 2.171 . . . . 0.0 113.157 175.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 92.5 p -83.91 -174.96 5.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 112.826 -1.988 . . . . 0.0 111.791 -174.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -67.5 -28.31 67.73 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 122.208 2.276 . . . . 0.0 112.112 -173.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 34.1 ttp-105 -59.48 -64.55 0.9 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 127.63 2.372 . . . . 0.0 113.872 171.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -53.69 -39.94 65.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 128.301 2.64 . . . . 0.0 112.976 176.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 77.2 mt -64.17 -12.22 38.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.375 -1.453 . . . . 0.0 114.706 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -107.08 -48.64 3.43 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.023 2.529 . . . . 0.0 112.783 171.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -88.96 10.9 19.78 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -174.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -137.85 -36.71 0.61 Allowed 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 111.929 -3.891 . . . . 0.0 110.08 166.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 7.8 mp -95.77 0.22 52.11 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 120.477 3.51 . . . . 0.0 120.477 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 44.3 -125.36 5.87 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-O 115.199 -3.0 . . . . 0.0 119.85 171.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.04 -18.85 16.07 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 120.728 2.264 . . . . 0.0 113.149 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.11 -29.3 73.98 Favored Glycine 0 CA--C 1.523 0.57 0 O-C-N 117.299 -3.375 . . . . 0.0 109.656 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tt -43.81 -34.81 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 117.733 2.494 . . . . 0.0 117.733 162.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.64 -59.22 5.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 121.126 3.75 . . . . 0.0 121.126 173.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 9.1 m -43.62 -47.13 7.51 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 115.341 -2.266 . . . . 0.0 109.849 172.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.259 44.5 mm -60.29 -30.42 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 122.213 2.279 . . . . 0.0 113.203 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 61.0 p -118.34 3.22 11.93 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 119.127 -2.233 . . . . 0.0 114.536 -163.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 67.8 mtp85 -116.76 136.67 52.78 Favored 'General case' 0 N--CA 1.45 -0.428 1 C-N-CA 131.856 4.062 . . . . 0.0 115.039 175.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 97.76 161.59 31.05 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-O 115.794 -2.67 . . . . 0.0 113.816 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 66.7 m -56.83 -12.28 1.86 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 113.465 -3.16 . . . . 0.0 117.812 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -103.84 15.01 29.7 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 122.387 2.358 . . . . 0.0 113.698 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 3.0 p -68.05 162.91 23.54 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 116.803 -1.57 . . . . 0.0 114.504 -171.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 17.3 tp -47.01 -42.64 18.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 121.979 2.172 . . . . 0.0 115.791 -172.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -91.16 -10.76 40.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 119.989 3.329 . . . . 0.0 119.989 171.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.72 -28.53 64.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 116.872 -1.537 . . . . 0.0 109.819 167.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.77 162.98 31.8 Favored Pre-proline 0 N--CA 1.453 -0.316 0 C-N-CA 129.526 3.13 . . . . 0.0 117.716 -163.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_exo -55.36 148.14 52.94 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 124.285 3.323 . . . . 0.0 111.957 172.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 18.1 t -71.13 -45.35 72.02 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 CA-C-N 110.139 -3.21 . . . . 0.0 106.991 -169.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 18.7 pm0 -65.77 -28.43 69.02 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 113.788 -3.006 . . . . 0.0 111.672 -179.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 36.6 tp -71.36 -46.27 60.85 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 125.184 2.421 . . . . 0.0 115.57 169.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -63.18 -33.73 76.12 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 112.37 -3.681 . . . . 0.0 110.022 -177.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -83.35 -31.29 26.86 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 127.618 3.074 . . . . 0.0 113.378 173.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 82.0 t90 -63.29 -54.19 40.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 170.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 78.8 mt -55.55 -29.24 58.63 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.513 1.125 . . . . 0.0 109.329 -175.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -71.52 -34.91 70.49 Favored 'General case' 0 N--CA 1.452 -0.34 1 C-N-CA 132.08 4.152 . . . . 0.0 109.825 -178.031 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -75.19 -26.26 58.88 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 111.075 -2.784 . . . . 0.0 113.117 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 54.2 t -97.42 -47.98 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-N 113.145 -1.843 . . . . 0.0 113.142 -176.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 73.4 mt -85.38 -22.7 28.29 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -169.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 64.5 mt -111.36 17.06 20.53 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 119.088 -2.258 . . . . 0.0 112.698 176.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -55.3 132.45 47.95 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 125.941 2.781 . . . . 0.0 116.69 176.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 17.5 m -106.88 -26.63 11.14 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 117.342 -3.349 . . . . 0.0 114.464 173.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 25.2 t0 . . . . . 0 C--O 1.249 1.049 0 N-CA-C 118.207 2.669 . . . . 0.0 118.207 177.134 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 9.5 ttt . . . . . 0 N--CA 1.473 0.716 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . 0.285 . . -154.97 172.57 17.88 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 128.247 2.619 . . . . 0.0 112.755 176.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -140.66 157.84 44.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 124.337 2.018 . . . . 0.0 110.723 -167.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -140.72 145.93 37.11 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 128.2 2.6 . . . . 0.0 112.539 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 1.7 p -126.81 161.29 54.26 Favored Pre-proline 0 N--CA 1.449 -0.483 0 C-N-CA 128.089 2.556 . . . . 0.0 115.802 174.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -76.09 -0.04 9.87 Favored 'Trans proline' 0 N--CA 1.444 -1.383 0 CA-C-O 117.587 -1.089 . . . . 0.0 112.615 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -162.89 120.29 1.96 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.184 2.593 . . . . 0.0 110.455 165.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 15.8 p -74.82 149.88 39.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 113.147 -3.421 . . . . 0.0 110.965 -168.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.77 -33.91 73.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 126.299 1.84 . . . . 0.0 115.347 174.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.36 -14.28 59.47 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 124.474 2.083 . . . . 0.0 112.491 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 4.8 mmt -87.15 -36.13 18.22 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 117.804 -3.06 . . . . 0.0 105.81 -175.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.98 -23.25 66.29 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 116.627 -3.796 . . . . 0.0 117.331 168.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -74.35 -40.75 61.95 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 126.927 2.642 . . . . 0.0 116.035 156.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -62.72 -36.92 84.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 119.815 1.189 . . . . 0.0 109.465 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -36.25 77.17 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 115.158 -2.353 . . . . 0.0 113.735 175.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -69.88 -24.87 63.47 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 122.564 2.438 . . . . 0.0 117.412 172.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -82.09 -39.53 23.23 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.342 1.057 . . . . 0.0 108.544 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -62.92 -29.32 70.7 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 169.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . 0.471 ' CE2' ' HD2' ' C' ' 48' ' ' ARG . 38.4 t-105 -70.69 -35.84 72.98 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 117.49 -3.256 . . . . 0.0 112.859 166.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 64.4 mt -80.19 -18.36 49.86 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 119.059 -2.276 . . . . 0.0 115.442 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 42.3 ttt180 -69.05 -29.11 67.18 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 126.535 1.934 . . . . 0.0 112.857 162.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -75.09 -48.4 24.03 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 114.409 -2.71 . . . . 0.0 112.347 166.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 46.7 t -56.67 -38.78 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 124.524 3.329 . . . . 0.0 112.272 174.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -73.05 -48.27 37.54 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 125.528 1.768 . . . . 0.0 113.081 173.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 39.0 tp -52.93 -48.61 67.18 Favored 'General case' 0 N--CA 1.448 -0.563 1 O-C-N 115.173 -4.704 . . . . 0.0 109.307 173.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.25 -46.7 87.67 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 120.364 1.438 . . . . 0.0 110.507 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -51.61 -46.83 63.74 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 116.123 1.898 . . . . 0.0 116.123 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -66.73 -27.85 67.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 119.109 -2.244 . . . . 0.0 108.578 174.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.307 . . -69.66 -23.91 63.53 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.049 2.94 . . . . 0.0 114.785 173.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -76.43 -28.26 56.54 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 120.449 -1.407 . . . . 0.0 111.031 165.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -75.44 -24.28 57.03 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 119.895 -1.753 . . . . 0.0 113.085 -175.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 55.1 p30 -116.33 9.93 14.61 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 121.134 3.753 . . . . 0.0 121.134 164.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 55.59 32.54 19.39 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 116.693 -1.622 . . . . 0.0 115.278 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 60.8 mt -80.78 -1.51 43.21 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 120.411 1.46 . . . . 0.0 112.578 164.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . 0.331 0.0 OUTLIER -38.8 -75.6 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 119.418 3.118 . . . . 0.0 119.418 -179.279 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.292 50.8 mt -46.44 -45.33 44.37 Favored Pre-proline 0 N--CA 1.446 -0.631 0 CA-C-O 113.528 -3.13 . . . . 0.0 115.298 174.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -55.0 -37.23 93.86 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 124.538 3.492 . . . . 0.0 114.063 168.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 41.3 tp -75.09 -46.94 31.28 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 176.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 61.8 mt -57.85 -31.23 66.47 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.757 2.023 . . . . 0.0 112.804 171.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -79.0 -40.61 31.05 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 117.0 -3.563 . . . . 0.0 112.31 176.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 54.9 tp -51.01 -55.92 15.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 118.954 -2.341 . . . . 0.0 111.68 164.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 22.2 mmt -83.5 -25.03 31.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 115.943 -1.98 . . . . 0.0 115.401 -172.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 31.9 mt -116.96 141.3 48.42 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 122.173 2.26 . . . . 0.0 113.2 -176.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 46.4 p -70.58 156.03 92.54 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 127.923 2.489 . . . . 0.0 109.347 170.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -65.28 -36.69 34.75 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 O-C-N 117.93 -1.668 . . . . 0.0 113.868 -168.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.255 0.1 OUTLIER -69.65 -10.82 59.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.834 -2.416 . . . . 0.0 115.477 173.894 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -78.91 -40.3 32.57 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.508 1.523 . . . . 0.0 108.982 166.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 41.0 mtm-85 -71.14 -36.44 72.09 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 119.164 -2.21 . . . . 0.0 116.829 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.19 -36.19 82.82 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 119.667 -1.896 . . . . 0.0 112.493 167.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.1 -30.38 43.8 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 117.72 -3.113 . . . . 0.0 111.421 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 56.4 mt -68.84 -52.7 27.13 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 118.625 -2.547 . . . . 0.0 113.844 167.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -48.45 -36.36 17.17 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-O 115.614 -2.77 . . . . 0.0 115.162 164.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 25.6 m -76.13 -26.55 56.46 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 121.087 2.444 . . . . 0.0 113.516 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . 0.452 ' HB3' ' SD ' ' C' ' 42' ' ' MET . 72.9 mtt180 -66.22 -34.36 77.84 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 116.928 -1.51 . . . . 0.0 109.354 171.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . 0.255 42.8 t -44.71 -49.09 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-O 126.471 3.034 . . . . 0.0 115.562 171.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -86.42 -21.98 26.81 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 112.017 -2.356 . . . . 0.0 116.507 -176.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.13 -39.05 84.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 122.35 1.071 . . . . 0.0 112.932 166.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 85.0 t -60.69 -54.44 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 C-N-CA 127.928 2.491 . . . . 0.0 112.415 165.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -67.06 -35.63 80.28 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -178.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -79.24 -18.19 53.32 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 121.922 2.147 . . . . 0.0 112.484 176.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 17.0 mt -63.43 -58.8 5.9 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 117.686 -1.149 . . . . 0.0 109.09 162.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 11.1 mt -63.55 -42.48 98.38 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.242 -2.132 . . . . 0.0 105.242 -171.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -62.46 -41.6 98.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 177.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 59.16 44.53 96.33 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 118.064 1.985 . . . . 0.0 118.064 175.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -132.16 -22.52 2.26 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 121.732 2.766 . . . . 0.0 115.966 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 25.1 mmt -92.49 56.57 2.76 Favored 'General case' 0 N--CA 1.448 -0.566 1 O-C-N 129.433 4.208 . . . . 0.0 108.019 168.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 64.4 p -93.22 176.16 6.5 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 125.603 1.814 . . . . 0.0 112.777 -148.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 51.69 -82.76 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 114.653 -2.594 . . . . 0.0 112.027 168.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -88.43 -24.57 22.99 Favored 'General case' 0 N--CA 1.451 -0.39 1 CA-C-N 126.803 4.365 . . . . 0.0 113.346 -174.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -83.79 -44.06 14.77 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 53.0 mt -45.52 -43.01 11.48 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 120.534 3.531 . . . . 0.0 120.534 163.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 30.3 mtmm -79.73 -38.84 32.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 116.564 2.061 . . . . 0.0 116.564 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -112.22 -17.62 12.73 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -162.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -107.21 -50.02 3.16 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.106 1.762 . . . . 0.0 114.398 168.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.56 -27.49 51.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.551 1.541 . . . . 0.0 112.355 170.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 84.92 -157.33 32.16 Favored Glycine 0 CA--C 1.522 0.505 1 O-C-N 113.496 -5.752 . . . . 0.0 118.206 136.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.67 -23.42 11.32 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.432 1.893 . . . . 0.0 114.11 -169.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.56 14.13 25.47 Favored Glycine 0 C--N 1.334 0.47 1 O-C-N 115.227 -4.671 . . . . 0.0 114.682 177.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . 0.435 HG12 ' HG1' ' D' ' 83' ' ' THR . 14.9 tt -93.59 -15.19 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.826 0 C-N-CA 117.9 -1.52 . . . . 0.0 108.598 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.15 -18.6 42.25 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 130.303 3.441 . . . . 0.0 108.802 176.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 95.7 m -84.62 -34.03 23.19 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 121.749 -0.594 . . . . 0.0 110.256 175.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 18.6 mm -87.07 -35.65 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 C-N-CA 127.421 2.288 . . . . 0.0 111.764 -178.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 83' ' ' THR . . . . . 0.435 ' HG1' HG12 ' D' ' 79' ' ' ILE . 11.5 p -118.39 4.46 11.82 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 116.879 -1.534 . . . . 0.0 114.386 -177.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 33.1 mtp85 -119.66 -169.68 1.81 Allowed 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 120.453 1.479 . . . . 0.0 112.246 151.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.17 171.04 40.17 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.936 -159.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 90.4 p -71.43 -35.2 70.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 120.155 3.391 . . . . 0.0 120.155 -164.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -130.35 72.36 1.49 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 126.209 2.909 . . . . 0.0 104.678 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 6.5 p -88.26 -177.96 5.8 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 129.66 3.184 . . . . 0.0 111.579 173.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.07 -15.5 61.5 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 117.528 -3.232 . . . . 0.0 113.629 167.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -70.63 -25.81 63.19 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 161.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -78.96 -34.68 44.14 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -176.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 56.85 72.64 0.92 Allowed Pre-proline 0 N--CA 1.447 -0.612 0 O-C-N 126.582 2.426 . . . . 0.0 115.48 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . 0.459 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.326 0.1 OUTLIER 24.07 33.51 0.0 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.283 0 N-CA-C 116.502 1.693 . . . . 0.0 116.502 45.509 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 63.1 t -59.14 -31.17 45.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 173.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . 0.459 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.327 0.0 OUTLIER -67.91 -35.18 78.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.528 -2.607 . . . . 0.0 115.166 176.384 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 30.6 tp -66.89 -53.08 35.79 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 126.754 2.533 . . . . 0.0 107.043 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 23.8 ttp180 -52.28 -38.52 58.54 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 120.967 3.692 . . . . 0.0 120.967 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.18 -24.95 54.75 Favored 'General case' 0 N--CA 1.444 -0.729 0 O-C-N 126.23 2.206 . . . . 0.0 109.979 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 54.8 t90 -87.72 -41.12 13.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 127.693 3.12 . . . . 0.0 110.508 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 29.6 mt -60.61 -32.05 71.2 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 114.934 -2.46 . . . . 0.0 109.655 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -58.89 -44.79 91.26 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 123.013 2.642 . . . . 0.0 114.868 177.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -91.8 -5.35 53.61 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 129.186 2.994 . . . . 0.0 113.743 -173.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 98.8 t -95.44 -41.7 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 O-C-N 118.658 -2.526 . . . . 0.0 112.611 164.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 16.9 mt -97.17 -27.71 14.43 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 121.055 0.455 . . . . 0.0 111.538 -172.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.352 3.3 mp -108.38 54.98 0.65 Allowed 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 121.22 -0.925 . . . . 0.0 112.149 167.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -78.12 176.75 8.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 126.983 3.277 . . . . 0.0 112.789 -173.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 59.7 m -61.72 -27.16 68.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 117.424 2.379 . . . . 0.0 117.424 -172.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 130.831 3.652 . . . . 0.0 110.576 176.454 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 tmt? . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 117.439 -1.267 . . . . 0.0 113.716 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.16 77.59 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 123.821 3.009 . . . . 0.0 113.7 -168.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -72.92 -34.49 66.63 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.787 1.235 . . . . 0.0 112.81 168.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.7 mp0 -80.36 -8.67 59.6 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 120.775 1.625 . . . . 0.0 113.694 -175.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.2 m -76.67 129.19 80.04 Favored Pre-proline 0 N--CA 1.45 -0.447 0 C-N-CA 126.917 2.087 . . . . 0.0 107.644 -161.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.58 -32.36 4.81 Favored 'Trans proline' 0 N--CA 1.448 -1.16 0 CA-C-O 115.798 -1.834 . . . . 0.0 112.281 -169.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -139.38 160.91 38.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.162 2.585 . . . . 0.0 114.91 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 30.6 t -139.13 122.02 16.61 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 122.321 2.328 . . . . 0.0 111.54 163.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.17 -46.21 72.26 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.691 1.71 . . . . 0.0 112.662 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.03 -36.43 84.34 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 115.833 -4.292 . . . . 0.0 117.593 177.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.8 tpt -70.23 -37.93 75.12 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 115.95 -1.976 . . . . 0.0 109.594 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.59 -25.6 68.04 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 120.329 1.422 . . . . 0.0 112.433 170.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -75.63 -38.9 58.53 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 117.682 -3.136 . . . . 0.0 109.817 175.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -66.0 -45.43 81.6 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.639 -0.696 . . . . 0.0 109.296 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -63.11 -22.2 66.7 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 128.729 2.811 . . . . 0.0 116.481 169.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -80.71 -48.91 11.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 125.543 1.777 . . . . 0.0 112.046 173.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -65.05 -20.82 66.67 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 125.526 1.53 . . . . 0.0 112.82 172.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -72.13 -48.95 39.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 170.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -62.01 -37.16 83.8 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.56 2.744 . . . . 0.0 115.535 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . 0.299 51.9 mt -63.73 -13.77 46.45 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.812 1.645 . . . . 0.0 115.247 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -75.31 -26.65 58.84 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 118.343 -2.723 . . . . 0.0 117.633 173.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -68.25 -26.8 65.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 124.655 1.182 . . . . 0.0 111.446 163.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.7 t -80.6 -23.71 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 122.061 2.21 . . . . 0.0 114.287 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -77.57 -41.3 39.34 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 128.744 2.817 . . . . 0.0 114.892 161.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.0 tp -67.17 -40.97 86.69 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 124.937 1.398 . . . . 0.0 113.02 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.9 tp -70.23 -31.54 69.0 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 119.447 -2.033 . . . . 0.0 113.613 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -71.12 -38.09 72.31 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 127.361 2.913 . . . . 0.0 110.801 178.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -64.68 -37.87 89.06 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 174.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.87 -36.5 82.46 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 120.038 1.29 . . . . 0.0 113.42 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -54.28 -35.26 62.39 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 118.074 2.62 . . . . 0.0 118.074 166.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -74.02 -25.66 60.0 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.208 -2.182 . . . . 0.0 115.539 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -98.81 0.06 43.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 128.541 2.736 . . . . 0.0 113.172 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 39.42 35.69 0.18 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 118.242 2.682 . . . . 0.0 118.242 -155.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.1 mt -89.02 2.41 54.06 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -71.38 -43.8 66.17 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 117.705 -3.122 . . . . 0.0 115.946 -161.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.44 -42.56 5.27 Favored Pre-proline 0 N--CA 1.452 -0.356 0 CA-C-N 121.626 2.012 . . . . 0.0 107.193 -177.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -42.4 -55.61 2.49 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 124.991 3.794 . . . . 0.0 111.895 162.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 52.7 tp -64.88 -33.17 75.37 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 177.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.3 mt -77.86 -30.63 51.0 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 122.136 2.244 . . . . 0.0 110.781 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -65.41 -29.67 70.39 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 122.297 2.317 . . . . 0.0 112.92 165.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.4 tp -67.09 -49.4 65.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 117.451 -3.281 . . . . 0.0 109.689 171.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 32.6 mmt -76.52 -36.11 57.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 126.421 1.889 . . . . 0.0 115.578 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 48.2 mt -111.39 132.91 54.08 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 122.149 2.25 . . . . 0.0 115.153 -175.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.9 p -61.79 166.41 6.09 Favored Pre-proline 0 N--CA 1.448 -0.527 0 CA-C-O 114.393 -2.717 . . . . 0.0 117.573 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -64.86 -23.4 62.31 Favored 'Trans proline' 0 N--CA 1.452 -0.943 0 N-CA-C 119.684 2.917 . . . . 0.0 119.684 -177.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -94.48 -24.2 17.39 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 124.465 1.103 . . . . 0.0 111.533 -174.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -75.31 -22.29 57.79 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 118.416 -1.314 . . . . 0.0 111.124 168.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.3 mtm-85 -72.94 -48.94 32.46 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 114.948 -2.454 . . . . 0.0 109.443 172.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -66.69 -32.05 73.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 127.306 2.879 . . . . 0.0 112.618 175.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.96 -48.77 75.18 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.193 2.269 . . . . 0.0 110.517 167.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.5 mt -65.16 -45.05 86.51 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 116.598 -3.814 . . . . 0.0 113.792 -175.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.16 -36.61 83.05 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 118.779 2.272 . . . . 0.0 118.779 171.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.3 m -67.27 -34.65 77.85 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 119.788 -2.007 . . . . 0.0 114.102 173.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -69.19 -16.92 63.73 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 115.937 1.829 . . . . 0.0 115.937 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 52.3 t -72.34 -38.49 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 126.273 1.829 . . . . 0.0 109.457 167.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 33.5 ttt180 -61.79 -42.62 99.23 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 121.927 2.149 . . . . 0.0 112.045 167.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.1 mt -53.84 -50.97 48.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 3.3 t -76.25 -25.21 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -172.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -70.97 -52.5 19.41 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 116.293 -1.813 . . . . 0.0 106.355 171.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -69.61 -23.48 63.52 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 123.525 2.875 . . . . 0.0 115.282 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.311 80.6 mt -69.48 -49.23 56.75 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 128.553 2.741 . . . . 0.0 116.136 171.022 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 40.7 tp -65.81 -40.2 91.62 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 128.219 2.607 . . . . 0.0 111.407 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -74.97 -48.31 24.91 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.974 2.11 . . . . 0.0 111.302 172.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.6 16.17 75.8 Favored Glycine 0 C--O 1.224 -0.47 0 C-N-CA 124.829 1.204 . . . . 0.0 113.517 167.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -70.83 -44.88 65.6 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.235 -3.509 . . . . 0.0 113.174 173.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 50.9 mtp -79.78 124.45 28.62 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 131.612 3.965 . . . . 0.0 111.212 168.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.5 p -97.21 177.34 5.6 Favored 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 127.215 2.822 . . . . 0.0 112.804 -174.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -54.0 -44.68 71.1 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 118.981 -2.324 . . . . 0.0 114.863 -178.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 50.2 tpt85 -71.43 -29.02 64.39 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 125.747 1.905 . . . . 0.0 107.281 -175.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -73.23 -44.05 60.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 117.199 -1.381 . . . . 0.0 108.967 178.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 36.2 mt -70.13 -10.8 59.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 116.005 -1.95 . . . . 0.0 114.219 -175.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -75.33 -42.16 55.01 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 113.479 -3.153 . . . . 0.0 109.182 171.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -55.05 -31.71 61.34 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 128.436 3.585 . . . . 0.0 117.219 171.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -91.04 -41.33 11.14 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 118.443 -2.66 . . . . 0.0 114.724 -166.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 44.5 mt -109.51 -9.5 14.91 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -176.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 83.38 -29.38 3.59 Favored Glycine 0 C--N 1.339 0.709 0 CA-C-O 115.139 -3.034 . . . . 0.0 116.237 170.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -85.77 -159.18 0.44 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 117.984 2.587 . . . . 0.0 117.984 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.49 154.74 40.67 Favored Glycine 0 C--N 1.337 0.599 0 CA-C-O 116.809 -2.106 . . . . 0.0 111.348 -166.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.3 mt -59.62 -30.04 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-O 116.221 -1.847 . . . . 0.0 111.034 170.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.91 -18.57 65.33 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.628 2.467 . . . . 0.0 115.544 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 44.0 p -60.35 -29.59 69.0 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 118.137 -0.935 . . . . 0.0 111.895 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.9 mm -83.69 -53.67 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 C-N-CA 127.789 2.436 . . . . 0.0 105.153 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.2 m -54.4 -56.27 20.29 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.606 1.962 . . . . 0.0 112.786 -174.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -58.79 -36.34 74.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.77 -37.18 75.73 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 114.05 -1.432 . . . . 0.0 114.533 177.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 5.4 m -63.44 -51.27 66.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 113.447 -1.377 . . . . 0.0 111.122 173.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -62.42 -43.38 98.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 127.028 2.131 . . . . 0.0 111.576 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.9 m -65.65 -26.75 67.94 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 114.635 -2.602 . . . . 0.0 116.916 169.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.7 tp -76.38 -34.15 58.88 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 127.418 2.949 . . . . 0.0 110.433 177.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -61.08 -31.75 71.41 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 118.032 2.604 . . . . 0.0 118.032 161.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -86.66 -4.76 59.22 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 124.284 1.992 . . . . 0.0 113.359 170.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.46 150.53 54.87 Favored Pre-proline 0 N--CA 1.445 -0.684 0 O-C-N 117.934 -2.979 . . . . 0.0 115.636 167.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -65.8 158.04 55.82 Favored 'Trans proline' 0 N--CA 1.448 -1.176 1 C-N-CA 125.895 4.397 . . . . 0.0 108.787 162.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.5 m -77.35 -38.54 26.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 O-C-N 122.204 -0.31 . . . . 0.0 111.752 -166.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -59.68 -24.3 63.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 119.561 -1.962 . . . . 0.0 112.33 177.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 16.4 tp -67.02 -55.87 12.55 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 119.903 1.228 . . . . 0.0 113.138 172.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 46.2 mtm-85 -57.1 -45.8 83.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 115.708 1.744 . . . . 0.0 115.708 169.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -63.09 -28.53 70.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.164 -2.835 . . . . 0.0 111.852 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 29.7 t90 -73.49 -44.67 57.32 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 169.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 70.7 mt -59.72 -27.89 66.86 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 115.449 -2.215 . . . . 0.0 109.751 174.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -74.3 -24.16 59.2 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 123.599 2.909 . . . . 0.0 115.024 175.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -86.28 -30.0 22.64 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.697 0.799 . . . . 0.0 112.666 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.4 t -84.37 -34.99 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 O-C-N 118.951 -2.343 . . . . 0.0 110.627 173.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 27.3 mt -94.02 -45.3 7.65 Favored 'General case' 0 N--CA 1.45 -0.454 1 O-C-N 114.857 -4.902 . . . . 0.0 112.287 -167.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 56.8 mt -111.5 0.69 16.58 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 120.799 3.629 . . . . 0.0 120.799 -169.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.254 67.9 tttt -82.18 -43.96 17.03 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 116.473 -3.892 . . . . 0.0 113.748 -165.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 14.4 p -76.58 -32.65 58.28 Favored 'General case' 0 N--CA 1.45 -0.463 1 O-C-N 116.209 -4.057 . . . . 0.0 115.751 -174.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 . . . . . 0 C--O 1.251 1.155 0 O-C-N 123.888 0.742 . . . . 0.0 111.07 -169.4 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tmt? . . . . . 0 N--CA 1.473 0.723 0 CA-C-O 121.678 0.751 . . . . 0.0 108.984 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.04 -51.04 17.07 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 117.015 -3.553 . . . . 0.0 116.503 -150.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -66.41 -18.21 65.23 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 167.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -85.86 -45.73 11.28 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 117.451 2.389 . . . . 0.0 117.451 178.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 66.4 m -76.1 143.44 73.72 Favored Pre-proline 0 N--CA 1.446 -0.666 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -168.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -18.5 22.77 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 C-N-CA 123.889 3.059 . . . . 0.0 113.385 173.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -142.67 162.05 36.47 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 122.123 2.238 . . . . 0.0 110.962 154.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 10.1 t -149.17 140.17 22.93 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 127.342 2.257 . . . . 0.0 111.052 174.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.44 76.7 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 116.917 -3.614 . . . . 0.0 110.511 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.09 -41.77 79.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 123.326 1.536 . . . . 0.0 110.595 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 13.1 mmt -63.01 -40.16 96.93 Favored 'General case' 0 N--CA 1.449 -0.496 1 O-C-N 115.948 -4.22 . . . . 0.0 112.885 176.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.01 -44.83 79.34 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.873 3.269 . . . . 0.0 111.545 -178.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -62.97 -30.93 71.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 120.791 1.632 . . . . 0.0 114.313 168.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -69.94 -36.56 75.39 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 114.555 -2.64 . . . . 0.0 111.314 172.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -72.71 -27.17 61.9 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 115.433 -2.222 . . . . 0.0 113.016 176.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -71.95 -36.6 69.92 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 124.822 3.465 . . . . 0.0 113.505 168.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -67.01 -37.14 83.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 117.103 -1.427 . . . . 0.0 110.302 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -72.84 -24.62 60.91 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 114.308 -2.758 . . . . 0.0 107.741 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 7.1 t-105 -69.5 -51.39 36.27 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 124.512 3.324 . . . . 0.0 108.965 169.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.65 -16.53 49.47 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 126.52 1.928 . . . . 0.0 115.441 177.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -64.03 -48.23 77.13 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.093 1.757 . . . . 0.0 110.733 173.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -56.54 -40.41 75.05 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.213 1.405 . . . . 0.0 113.185 173.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 14.0 t -80.61 -33.93 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 O-C-N 118.968 -2.332 . . . . 0.0 114.659 -178.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -66.78 -39.22 87.75 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.113 0.965 . . . . 0.0 113.067 169.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 25.4 tp -50.62 -63.38 1.14 Allowed 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 118.979 -2.326 . . . . 0.0 107.427 161.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.252 41.8 tp -59.72 -45.83 90.97 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 121.421 1.919 . . . . 0.0 115.244 -172.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -51.93 -43.17 63.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 116.828 2.159 . . . . 0.0 116.828 170.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -67.42 -37.5 83.14 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 116.677 2.103 . . . . 0.0 116.677 170.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.28 -38.37 52.39 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.498 1.919 . . . . 0.0 111.87 173.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -64.31 -48.14 76.76 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 128.176 2.591 . . . . 0.0 113.264 175.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -44.26 -31.86 1.13 Allowed 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 117.631 -3.168 . . . . 0.0 114.523 171.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -108.57 -3.84 17.68 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 129.46 3.104 . . . . 0.0 115.167 -175.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.33 4.9 m-20 60.28 10.68 2.48 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 -176.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -69.22 1.19 3.92 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 167.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -64.4 -44.7 90.46 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 115.868 -2.015 . . . . 0.0 114.97 -171.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 65.5 tp -72.58 -36.79 3.91 Favored Pre-proline 0 N--CA 1.447 -0.609 0 CA-C-N 121.631 2.014 . . . . 0.0 112.315 -173.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 0.8 OUTLIER -58.2 -29.35 87.24 Favored 'Trans proline' 0 N--CA 1.445 -1.349 0 N-CA-C 121.537 3.63 . . . . 0.0 121.537 161.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 27.2 tp -72.75 -35.29 67.47 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 172.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . 0.253 60.8 mt -73.61 -22.81 59.91 Favored 'General case' 0 N--CA 1.445 -0.677 1 O-C-N 115.717 -4.364 . . . . 0.0 114.456 176.502 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -70.04 -33.41 71.93 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.836 0.854 . . . . 0.0 108.952 171.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 48.8 tp -84.26 -46.63 11.63 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.077 1.751 . . . . 0.0 106.343 -178.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 15.7 mmt -86.12 -17.41 35.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 123.861 0.726 . . . . 0.0 112.296 -161.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mp -126.34 138.4 53.57 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 120.867 -1.146 . . . . 0.0 112.521 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 46.8 p -78.64 161.52 69.05 Favored Pre-proline 0 N--CA 1.446 -0.626 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -46.68 -45.39 20.04 Favored 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 123.012 2.475 . . . . 0.0 114.261 175.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.48 -36.08 68.7 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 126.626 3.108 . . . . 0.0 117.338 177.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -90.56 -25.17 20.34 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 112.062 -2.336 . . . . 0.0 113.22 -178.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 62.8 mtm-85 -61.09 -35.11 76.11 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 119.421 3.119 . . . . 0.0 119.421 155.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -73.05 -35.65 66.75 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 126.332 2.27 . . . . 0.0 111.826 174.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.35 -53.73 53.85 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 115.442 -2.218 . . . . 0.0 110.358 167.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.282 33.1 mt -63.93 -52.34 60.24 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 121.595 1.998 . . . . 0.0 112.609 178.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.97 -27.12 12.68 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 118.456 2.142 . . . . 0.0 118.456 173.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 32.0 m -80.87 -50.63 9.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 116.132 -1.89 . . . . 0.0 112.806 163.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -53.18 -32.48 48.09 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 122.774 2.534 . . . . 0.0 110.104 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.4 -41.05 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 O-C-N 117.253 -3.404 . . . . 0.0 107.78 176.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -80.92 -26.34 36.83 Favored 'General case' 0 N--CA 1.449 -0.497 1 O-C-N 114.898 -4.876 . . . . 0.0 112.265 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 68.7 mt -65.58 -45.18 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 O-C-N 118.918 -2.364 . . . . 0.0 108.436 173.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 65.6 t -69.66 -36.92 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 O-C-N 117.943 -2.973 . . . . 0.0 108.92 -179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -61.92 -47.34 85.38 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 124.357 2.027 . . . . 0.0 113.834 169.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -74.92 -22.02 58.86 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 116.359 -3.963 . . . . 0.0 111.94 -177.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 79.8 mt -70.3 -14.83 62.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.764 0.826 . . . . 0.0 111.601 167.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 84.2 mt -106.77 -13.81 15.16 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.421 1.088 . . . . 0.0 113.511 177.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 20.4 ttm105 -87.41 -47.57 8.67 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.162 -2.836 . . . . 0.0 111.962 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 65.37 69.9 1.23 Allowed Glycine 0 C--N 1.334 0.465 1 O-C-N 130.018 4.574 . . . . 0.0 115.201 -175.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -139.39 -30.69 0.71 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 119.745 1.773 . . . . 0.0 113.511 176.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 33.2 mtt -81.62 134.67 35.51 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.132 2.271 . . . . 0.0 117.132 -172.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 83.0 p -81.88 168.6 17.76 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 128.574 3.671 . . . . 0.0 112.218 179.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -64.22 -17.25 63.38 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 121.291 1.859 . . . . 0.0 114.658 -175.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -74.03 -51.11 16.87 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 168.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -75.11 -22.56 58.14 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 116.619 -2.032 . . . . 0.0 115.981 -175.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.66 -45.48 85.47 Favored 'General case' 0 N--CA 1.451 -0.417 1 CA-C-O 131.311 5.339 . . . . 0.0 111.79 170.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -66.33 -28.32 68.58 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 117.958 -2.964 . . . . 0.0 113.021 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -87.29 -75.56 0.4 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 121.614 2.007 . . . . 0.0 116.241 167.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -56.58 -33.56 66.3 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 120.563 3.542 . . . . 0.0 120.563 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 29.5 mt -101.11 -8.75 21.98 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 120.014 1.279 . . . . 0.0 109.726 169.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.54 7.49 40.75 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-O 118.285 -1.286 . . . . 0.0 112.421 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.36 156.89 21.73 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 -174.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.17 158.2 52.17 Favored Glycine 0 C--N 1.334 0.434 0 CA-C-N 110.737 -2.938 . . . . 0.0 113.922 167.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 37.3 mm -71.16 -31.85 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 C-N-CA 124.331 1.052 . . . . 0.0 111.634 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.76 -43.81 90.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 120.368 -1.458 . . . . 0.0 114.169 165.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 3.5 m -54.19 -36.9 63.92 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 113.319 -3.229 . . . . 0.0 111.56 169.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 19.2 mm -73.0 -40.66 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 O-C-N 126.361 2.288 . . . . 0.0 105.265 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 32.2 m -74.85 -33.87 62.19 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 115.586 1.698 . . . . 0.0 115.586 -167.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -49.43 -44.1 45.15 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 114.634 -2.603 . . . . 0.0 112.478 155.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.4 -55.34 15.78 Favored Glycine 0 C--N 1.335 0.479 0 C-N-CA 126.387 1.946 . . . . 0.0 111.789 177.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 2.4 p -50.52 -37.37 38.78 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 123.574 3.687 . . . . 0.0 114.189 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -71.31 -35.69 71.36 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 119.741 -1.85 . . . . 0.0 115.57 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 44.3 m -67.3 -27.96 67.6 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 166.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.91 -42.67 66.44 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.156 1.535 . . . . 0.0 109.977 178.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -67.53 -38.91 84.91 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 172.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.14 -4.51 39.15 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 115.423 -2.227 . . . . 0.0 113.229 177.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.41 157.8 55.46 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 120.626 1.557 . . . . 0.0 111.331 -169.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -54.91 132.94 55.05 Favored 'Trans proline' 0 N--CA 1.45 -1.082 1 C-N-CA 125.841 4.361 . . . . 0.0 110.461 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.309 16.6 m -59.8 -26.39 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 116.158 1.91 . . . . 0.0 116.158 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.309 17.5 pm0 -49.57 -52.67 28.53 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 126.681 1.993 . . . . 0.0 114.53 165.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 17.4 tp -63.32 -42.82 99.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 124.894 2.283 . . . . 0.0 108.344 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 60.5 mtp85 -63.62 -47.4 81.53 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.855 -1.778 . . . . 0.0 113.858 -175.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -61.37 -37.92 85.14 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 115.584 -2.151 . . . . 0.0 115.009 170.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 16.7 t90 -70.68 -38.13 73.71 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 119.97 1.259 . . . . 0.0 108.519 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 26.1 mt -68.58 -37.49 79.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 119.826 1.194 . . . . 0.0 111.86 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -65.56 -38.71 90.34 Favored 'General case' 0 N--CA 1.445 -0.678 1 O-C-N 115.443 -4.535 . . . . 0.0 114.841 173.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -62.18 -55.21 30.87 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 118.893 -2.379 . . . . 0.0 112.181 164.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.23 -34.5 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 C-N-CA 123.139 0.575 . . . . 0.0 110.015 -164.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 87.9 mt -90.38 -49.72 6.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 118.688 2.847 . . . . 0.0 118.688 -176.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 19.1 mt -82.59 -34.31 27.71 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.488 1.613 . . . . 0.0 112.921 -166.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -67.3 -16.69 64.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.971 164.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 48.9 m -103.05 6.12 38.51 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.935 -2.978 . . . . 0.0 118.944 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.312 33.6 t70 . . . . . 0 C--O 1.25 1.084 0 N-CA-C 120.112 3.375 . . . . 0.0 120.112 -169.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . 0.257 6.1 mtt . . . . . 0 N--CA 1.469 0.516 0 CA-C-O 123.926 1.822 . . . . 0.0 106.951 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.94 179.25 7.82 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 125.745 1.618 . . . . 0.0 112.629 179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -151.28 119.25 6.22 Favored 'General case' 0 N--CA 1.448 -0.529 1 O-C-N 116.115 -4.116 . . . . 0.0 107.519 -171.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -108.3 149.47 28.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.443 -2.036 . . . . 0.0 107.685 171.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 25.0 p -129.94 148.16 68.45 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 103.476 -2.787 . . . . 0.0 103.476 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -53.6 -38.93 84.42 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.071 2.514 . . . . 0.0 118.12 -171.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -145.98 166.27 26.53 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 117.568 -3.208 . . . . 0.0 107.021 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 3.1 t -154.55 132.15 11.35 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 105.143 -2.169 . . . . 0.0 105.143 170.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.35 -41.33 89.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.44 1.496 . . . . 0.0 112.676 168.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.25 86.84 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 119.028 -2.295 . . . . 0.0 111.384 177.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 37.4 mtt -60.61 -35.6 76.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 120.046 -1.659 . . . . 0.0 113.086 171.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.76 -25.2 63.7 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.116 1.366 . . . . 0.0 113.659 168.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -71.02 -26.57 63.17 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 122.679 1.228 . . . . 0.0 109.036 171.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -77.29 -38.61 50.33 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.247 -2.783 . . . . 0.0 108.665 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -37.1 86.32 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 124.193 1.949 . . . . 0.0 112.039 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -62.76 -41.63 99.31 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 112.813 -1.994 . . . . 0.0 105.985 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 -69.95 -24.32 63.33 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 117.828 -3.045 . . . . 0.0 112.346 178.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -62.93 -48.41 79.04 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 126.088 2.851 . . . . 0.0 114.206 169.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 54.9 t-105 -55.58 -42.44 74.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 116.453 -3.904 . . . . 0.0 118.058 160.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 3.8 mp -63.08 -15.16 55.7 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 122.019 2.19 . . . . 0.0 115.975 167.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 43.6 ttt-85 -87.43 -32.55 19.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 122.539 1.162 . . . . 0.0 111.363 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -54.48 -42.65 70.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.449 -3.282 . . . . 0.0 113.112 157.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 17.1 t -78.79 -26.93 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 126.462 1.905 . . . . 0.0 107.115 -171.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -83.02 -29.38 28.94 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.418 0.687 . . . . 0.0 112.627 172.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 33.2 tp -68.26 -47.3 68.09 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 121.078 -1.014 . . . . 0.0 111.03 172.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 67.2 tp -68.36 -32.11 71.96 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -176.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -55.46 -53.37 57.19 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.825 -2.422 . . . . 0.0 109.381 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -68.3 -22.58 64.71 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 125.976 2.048 . . . . 0.0 116.051 174.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.89 -27.34 65.7 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 116.869 -3.645 . . . . 0.0 113.454 -177.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -61.23 -30.95 70.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 117.795 2.517 . . . . 0.0 117.795 167.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -71.91 -22.24 61.51 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 118.345 2.72 . . . . 0.0 118.345 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 51.0 p-10 -114.8 24.19 11.99 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 120.264 -1.522 . . . . 0.0 112.342 161.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.331 18.3 m-20 57.21 24.42 9.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.914 2.486 . . . . 0.0 114.767 173.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 mt -85.96 -12.44 50.43 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 173.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -40.39 -56.3 2.05 Favored 'General case' 0 N--CA 1.448 -0.529 1 O-C-N 115.621 -4.425 . . . . 0.0 114.035 174.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 81.0 mt -68.53 -48.13 33.94 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-O 116.802 -1.57 . . . . 0.0 111.925 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . 0.31 30.3 Cg_endo -55.69 -25.32 50.25 Favored 'Trans proline' 0 N--CA 1.449 -1.098 1 C-N-CA 127.279 5.32 . . . . 0.0 115.216 168.666 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -73.92 -48.15 32.78 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 123.178 2.717 . . . . 0.0 107.109 172.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 84.8 mt -63.99 -25.34 68.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 125.752 1.907 . . . . 0.0 114.723 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -68.19 -27.79 66.71 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 119.352 0.978 . . . . 0.0 112.809 165.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 14.2 tp -78.59 -55.18 5.39 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 126.634 3.112 . . . . 0.0 110.969 172.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 55.3 mmm -67.76 -18.25 64.81 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 121.679 3.955 . . . . 0.0 121.679 -168.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . 0.269 8.5 mp -131.5 165.37 23.72 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 117.971 -2.956 . . . . 0.0 106.156 -178.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 29.3 p -91.51 154.54 44.29 Favored Pre-proline 0 N--CA 1.449 -0.509 0 C-N-CA 124.935 1.294 . . . . 0.0 112.226 165.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_exo -49.71 -31.26 24.94 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 N-CA-C 115.596 1.345 . . . . 0.0 115.596 167.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.65 -24.92 60.06 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 176.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -76.68 -36.33 57.34 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 120.416 -1.427 . . . . 0.0 113.929 168.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . 0.252 90.3 mtm-85 -57.82 -37.69 74.25 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 115.193 -2.337 . . . . 0.0 109.856 176.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -70.41 -53.34 16.88 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 128.954 3.909 . . . . 0.0 109.319 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . 0.343 . . -44.88 -49.87 10.7 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 116.301 -3.999 . . . . 0.0 117.715 165.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 33.6 mt -63.81 -44.14 94.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 117.102 -1.427 . . . . 0.0 112.817 177.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.45 -26.59 69.65 Favored Glycine 0 CA--C 1.523 0.54 0 O-C-N 126.409 2.318 . . . . 0.0 111.309 -177.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 6.0 m -80.65 -32.95 36.01 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.41 -2.818 . . . . 0.0 114.241 173.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.25 91.1 mtt180 -71.71 -19.77 62.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 115.801 -2.047 . . . . 0.0 113.092 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 23.7 t -69.14 -40.79 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 C-N-CA 128.045 2.538 . . . . 0.0 109.977 162.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -68.75 -37.0 79.09 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 112.158 -3.782 . . . . 0.0 110.507 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 37.7 mt -60.39 -43.11 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 O-C-N 126.576 2.422 . . . . 0.0 109.25 175.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 47.4 t -67.48 -42.36 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 120.917 1.69 . . . . 0.0 111.297 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -51.0 -49.31 60.64 Favored 'General case' 0 N--CA 1.449 -0.514 1 C-N-CA 131.707 4.003 . . . . 0.0 114.479 166.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -64.56 -38.23 90.28 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 118.193 -2.817 . . . . 0.0 114.479 173.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 20.1 mt -78.23 -30.53 48.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 122.406 2.366 . . . . 0.0 109.642 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 35.1 mt -80.4 -22.21 41.5 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.56 -3.212 . . . . 0.0 114.443 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -66.76 -37.16 84.08 Favored 'General case' 0 N--CA 1.449 -0.494 1 C-N-CA 134.502 5.121 . . . . 0.0 110.218 169.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.25 19.75 64.42 Favored Glycine 0 CA--C 1.521 0.431 0 CA-C-O 116.629 -2.206 . . . . 0.0 114.423 177.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -96.83 -30.76 12.98 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -171.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 18.8 mmt -55.3 142.75 30.68 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 118.003 2.594 . . . . 0.0 118.003 166.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 30.7 p -95.18 170.17 9.58 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 129.543 3.137 . . . . 0.0 109.005 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.57 -35.21 75.52 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 116.19 -1.862 . . . . 0.0 113.014 -172.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 32.8 ttp180 -67.47 -41.73 84.15 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 120.935 1.698 . . . . 0.0 115.456 172.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.11 -35.53 64.15 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 -175.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 24.2 mt -57.99 -21.1 42.98 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.311 3.044 . . . . 0.0 110.341 169.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -106.34 -29.64 9.64 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 123.87 3.032 . . . . 0.0 112.688 175.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -97.78 -37.33 9.9 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 115.539 1.681 . . . . 0.0 115.539 -174.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -90.04 -43.47 10.49 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 119.438 -2.039 . . . . 0.0 109.939 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mp -86.04 9.03 18.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-O 124.275 1.988 . . . . 0.0 114.922 173.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 58.97 -142.13 46.62 Favored Glycine 0 C--N 1.337 0.597 1 C-N-CA 130.834 4.064 . . . . 0.0 112.238 161.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.36 -26.8 23.18 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 119.469 -2.195 . . . . 0.0 113.413 164.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.13 2.81 3.68 Favored Glycine 0 CA--C 1.525 0.713 1 CA-C-O 112.586 -4.452 . . . . 0.0 116.41 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tt -66.67 -40.38 86.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 120.748 2.274 . . . . 0.0 115.259 165.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.49 -23.78 52.01 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.474 2.31 . . . . 0.0 115.775 171.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 1.7 m -71.75 -28.32 63.58 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 119.885 -1.76 . . . . 0.0 112.704 169.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 9.2 mm -92.65 -22.91 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 1 O-C-N 115.525 -4.485 . . . . 0.0 117.127 -171.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 73.0 p -123.32 -1.23 8.68 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 118.177 2.658 . . . . 0.0 118.177 -164.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 69.1 mtp85 -125.8 158.93 33.74 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 129.021 2.929 . . . . 0.0 111.575 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 76.96 164.08 19.64 Favored Glycine 0 C--O 1.224 -0.497 0 O-C-N 121.168 -0.957 . . . . 0.0 112.807 -177.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 66.7 m -67.96 -7.98 33.25 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 112.205 -3.76 . . . . 0.0 117.016 -163.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -117.82 18.62 14.01 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 131.078 3.751 . . . . 0.0 112.697 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 17.0 p -68.38 178.19 2.07 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 20.4 tp -59.86 -38.59 82.56 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 118.468 -1.293 . . . . 0.0 112.338 -173.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.346 94.1 mttt -101.75 6.41 41.74 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 127.537 2.335 . . . . 0.0 117.027 -176.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -120.61 -9.07 9.44 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 125.189 1.396 . . . . 0.0 112.135 167.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.19 160.21 18.13 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-O 125.743 2.687 . . . . 0.0 112.276 164.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -58.57 125.68 19.06 Favored 'Trans proline' 0 N--CA 1.447 -1.217 1 C-N-CA 126.221 4.614 . . . . 0.0 110.5 -177.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 50.7 t -37.64 -41.08 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 125.851 1.66 . . . . 0.0 110.711 178.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.9 pm0 -74.88 -18.3 60.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 116.285 -1.817 . . . . 0.0 110.83 -174.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -81.43 -38.42 26.48 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 122.596 2.453 . . . . 0.0 110.694 165.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 68.0 mtp180 -59.37 -52.42 65.72 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 118.605 -2.559 . . . . 0.0 110.096 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -47.6 -54.23 12.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 126.241 2.213 . . . . 0.0 114.521 166.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -66.12 -42.1 89.66 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.316 -1.311 . . . . 0.0 114.046 -173.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 61.0 mt -61.49 -48.53 80.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.449 1.9 . . . . 0.0 108.984 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -45.67 -41.42 10.37 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 116.721 -3.737 . . . . 0.0 118.823 164.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -73.95 -32.62 63.57 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.607 1.163 . . . . 0.0 109.529 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 38.9 t -88.38 -46.42 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 -175.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 51.0 mt -82.84 -18.55 40.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 117.63 -3.169 . . . . 0.0 113.028 -158.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 35.0 mt -118.33 3.31 11.92 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 120.573 1.533 . . . . 0.0 114.797 -173.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.352 21.6 pttp -48.37 117.28 1.9 Allowed 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 129.771 3.228 . . . . 0.0 111.53 -170.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 3.7 m -112.63 24.78 12.11 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.919 2.888 . . . . 0.0 117.288 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t0 . . . . . 0 C--O 1.252 1.193 0 CA-C-O 115.33 -2.271 . . . . 0.0 111.685 -171.651 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 16.2 ttt . . . . . 0 N--CA 1.472 0.644 0 CA-C-O 115.404 -2.236 . . . . 0.0 109.022 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.46 149.44 49.57 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 120.575 1.534 . . . . 0.0 112.965 -173.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -128.01 128.41 44.94 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 128.233 2.613 . . . . 0.0 108.485 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -99.83 123.06 43.69 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.084 -1.417 . . . . 0.0 111.396 -175.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 98.1 p -98.86 179.8 0.99 Allowed Pre-proline 0 N--CA 1.448 -0.539 0 C-N-CA 125.89 1.676 . . . . 0.0 114.648 162.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -92.24 -23.35 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.927 0 N-CA-C 116.717 1.776 . . . . 0.0 116.717 175.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -151.12 129.56 12.11 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.63 3.172 . . . . 0.0 106.377 -169.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.83 137.64 42.0 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 112.444 -2.162 . . . . 0.0 110.854 176.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.24 -30.98 69.77 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 120.255 -1.528 . . . . 0.0 111.377 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.56 -14.89 59.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 114.897 -2.478 . . . . 0.0 111.695 175.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 7.2 mmt -70.25 -27.37 64.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 121.782 2.083 . . . . 0.0 113.73 169.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.45 -41.66 72.54 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 120.622 -1.299 . . . . 0.0 112.291 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 21.4 tp10 -63.4 -36.22 83.0 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 113.591 -3.1 . . . . 0.0 107.014 170.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -73.92 -34.84 64.51 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 121.533 1.969 . . . . 0.0 107.797 -174.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.298 0.0 OUTLIER -65.63 -29.37 69.94 Favored 'General case' 0 N--CA 1.447 -0.62 1 O-C-N 114.432 -5.168 . . . . 0.0 113.728 -176.997 . . . . . . . . 4 3 . 1 . 015 nuclear orig full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -77.63 -29.72 51.89 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 167.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -73.87 -28.4 61.55 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 123.003 1.382 . . . . 0.0 111.04 -178.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -89.56 -18.1 27.25 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 120.325 -1.484 . . . . 0.0 107.652 -176.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 -76.06 -47.35 24.99 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 116.914 -1.517 . . . . 0.0 111.251 162.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.48 -35.38 80.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.196 2.295 . . . . 0.0 117.196 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -63.94 -26.31 68.53 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 118.143 -1.423 . . . . 0.0 113.982 170.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -62.85 -53.46 53.79 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 113.844 -2.979 . . . . 0.0 111.142 166.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.62 -35.09 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 121.179 1.809 . . . . 0.0 110.716 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.33 -41.3 81.0 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 170.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 13.4 tp -63.73 -48.66 76.13 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 53.7 tp -51.67 -48.12 63.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 115.36 -2.257 . . . . 0.0 116.402 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 19.5 ttpp -59.32 -52.32 66.17 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 125.397 1.685 . . . . 0.0 110.078 174.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -61.62 -33.83 74.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.713 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.75 -38.75 89.97 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 123.674 2.943 . . . . 0.0 114.975 171.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 30' ' ' TYR . . . . . 0.412 ' CD2' ' HD2' ' D' ' 35' ' ' HIS . 13.9 m-85 -61.65 -29.89 70.36 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 123.769 1.747 . . . . 0.0 115.535 172.033 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -81.28 -25.18 36.75 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -177.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . 0.329 54.3 p30 -102.74 3.74 37.24 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 120.56 -1.338 . . . . 0.0 114.011 164.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.254 1.7 m-20 63.72 26.5 14.51 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 128.744 2.818 . . . . 0.0 113.337 177.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 43.9 mt -93.71 16.86 12.94 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 165.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 35' ' ' HIS . . . . . 0.412 ' HD2' ' CD2' ' D' ' 30' ' ' TYR . 0.0 OUTLIER -52.22 -58.42 6.67 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 126.972 2.109 . . . . 0.0 110.152 174.254 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.415 22.6 mt -41.87 -63.86 0.78 Allowed Pre-proline 0 N--CA 1.448 -0.549 0 C-N-CA 128.05 2.54 . . . . 0.0 110.964 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -58.87 -36.65 96.6 Favored 'Trans proline' 0 N--CA 1.451 -0.992 0 CA-C-O 114.81 -2.246 . . . . 0.0 115.916 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 33.1 tp -56.0 -54.41 45.16 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 125.226 3.648 . . . . 0.0 112.292 171.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 88.6 mt -62.55 -31.63 72.45 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 115.846 -2.026 . . . . 0.0 110.652 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -74.71 -28.35 60.76 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 117.236 -1.786 . . . . 0.0 114.474 170.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -74.07 -51.9 14.31 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 118.44 -2.662 . . . . 0.0 108.615 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 24.8 mmt -63.36 -43.63 97.11 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 113.827 -2.987 . . . . 0.0 116.664 173.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 61.4 mt -121.26 142.58 49.79 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 124.81 3.459 . . . . 0.0 107.144 -166.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 38.9 p -77.65 159.26 77.19 Favored Pre-proline 0 N--CA 1.444 -0.738 0 C-N-CA 129.848 3.259 . . . . 0.0 115.729 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -41.84 -50.35 5.08 Favored 'Trans proline' 0 N--CA 1.451 -0.99 0 O-C-N 125.052 2.08 . . . . 0.0 114.341 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -73.53 -20.63 60.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 122.285 2.311 . . . . 0.0 116.288 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -70.32 -38.27 74.87 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 123.321 2.782 . . . . 0.0 109.946 170.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 26.0 mtm-85 -74.16 -36.6 64.11 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 118.36 2.726 . . . . 0.0 118.36 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.44 -45.62 84.5 Favored 'General case' 0 N--CA 1.447 -0.62 0 O-C-N 128.672 3.732 . . . . 0.0 114.018 161.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.77 -36.68 62.56 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 117.174 2.287 . . . . 0.0 117.174 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 47.4 mt -62.18 -32.02 72.6 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 120.063 -1.648 . . . . 0.0 107.671 171.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.93 -41.69 71.39 Favored Glycine 0 C--N 1.338 0.677 0 O-C-N 119.109 -2.244 . . . . 0.0 112.365 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 24.8 m -62.77 -31.52 72.5 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.05 2.14 . . . . 0.0 112.971 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -71.6 -24.68 61.94 Favored 'General case' 0 N--CA 1.448 -0.544 1 O-C-N 116.134 -4.104 . . . . 0.0 111.834 -177.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.66 -43.26 98.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 O-C-N 118.694 -2.504 . . . . 0.0 111.044 170.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.357 3.7 ptm180 -81.92 -25.63 34.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 172.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 54.0 mt -67.0 -32.84 59.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 122.024 0.129 . . . . 0.0 110.775 170.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 57.9 t -68.94 -48.25 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.69 165.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -70.15 -27.1 64.27 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 117.721 -1.592 . . . . 0.0 115.095 -174.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -74.96 -7.93 55.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 116.242 -1.837 . . . . 0.0 113.898 165.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.13 -7.75 55.1 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 121.691 2.041 . . . . 0.0 114.288 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 44.0 mt -97.65 -35.75 10.49 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 165.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -75.33 -32.41 60.9 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 112.08 -3.819 . . . . 0.0 111.768 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 47.03 55.4 8.57 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 121.042 3.177 . . . . 0.0 121.042 168.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -130.73 -30.19 1.86 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.082 1.353 . . . . 0.0 107.579 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 22.5 mmt -94.88 51.83 1.42 Allowed 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.844 2.458 . . . . 0.0 106.18 172.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 59.1 p -66.34 171.01 5.21 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 112.194 -2.276 . . . . 0.0 115.277 -169.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.303 6.6 tp-100 49.86 -89.28 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.73 1.612 . . . . 0.0 114.774 166.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -80.82 -35.14 33.3 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.273 -2.767 . . . . 0.0 110.238 -172.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -78.24 -31.69 49.37 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 126.459 1.904 . . . . 0.0 112.294 -172.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mt -51.67 -31.1 24.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.82 1.648 . . . . 0.0 113.566 168.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -104.63 -38.65 6.65 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 128.055 2.542 . . . . 0.0 108.43 -172.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -111.33 -14.32 13.8 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 121.982 2.174 . . . . 0.0 113.141 -164.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -118.32 -24.66 6.82 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 113.346 -3.216 . . . . 0.0 115.555 167.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -83.86 -27.55 28.61 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.332 2.333 . . . . 0.0 110.752 162.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 95.13 -175.34 33.44 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 129.64 3.495 . . . . 0.0 115.647 169.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.293 . . -68.64 -10.73 57.9 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 119.887 -1.949 . . . . 0.0 115.803 -164.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.39 -23.82 43.35 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 127.415 2.436 . . . . 0.0 111.094 169.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -46.5 -33.56 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 175.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -100.67 -4.56 28.08 Favored 'General case' 0 N--CA 1.45 -0.452 1 O-C-N 116.085 -4.135 . . . . 0.0 114.678 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 53.3 m -67.86 -33.45 74.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 120.19 1.359 . . . . 0.0 109.75 148.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.389 41.1 mm -85.85 -24.32 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 C-N-CA 131.449 3.899 . . . . 0.0 112.597 -168.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 66.7 p -129.55 6.68 5.23 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 112.106 -2.315 . . . . 0.0 115.203 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -134.16 177.21 7.92 Favored 'General case' 0 N--CA 1.452 -0.354 1 O-C-N 114.616 -5.053 . . . . 0.0 108.318 165.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 84.03 157.59 25.92 Favored Glycine 0 C--N 1.337 0.587 0 O-C-N 117.043 -3.536 . . . . 0.0 111.634 -147.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 38.7 p -72.09 -26.78 62.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 118.888 2.922 . . . . 0.0 118.888 -166.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -133.54 85.81 2.24 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 124.925 2.298 . . . . 0.0 109.62 -170.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 59.5 p -131.25 -169.28 2.15 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.644 2.778 . . . . 0.0 109.301 175.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.392 5.4 mp -87.85 27.85 1.1 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 124.091 1.9 . . . . 0.0 109.886 -177.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -107.17 10.59 30.0 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 119.879 -1.763 . . . . 0.0 115.006 147.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -144.65 -3.81 0.79 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 112.414 -3.66 . . . . 0.0 109.818 -162.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 92' ' ' ALA . . . . . 0.421 ' HA ' ' N ' ' D' ' 94' ' ' VAL . . . 66.01 85.85 0.15 Allowed Pre-proline 0 N--CA 1.448 -0.564 0 CA-C-N 124.676 3.398 . . . . 0.0 117.91 169.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.309 0.0 OUTLIER 30.42 23.23 0.0 OUTLIER 'Cis proline' 0 N--CA 1.451 -1.018 0 N-CA-C 121.107 3.464 . . . . 0.0 121.107 17.373 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' D' D ' 94' ' ' VAL . . . . . 0.421 ' N ' ' HA ' ' D' ' 92' ' ' ALA . 15.1 t -65.74 -31.91 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 119.571 1.078 . . . . 0.0 110.526 161.031 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.358 0.0 OUTLIER -78.52 -36.76 44.38 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 128.716 2.806 . . . . 0.0 109.607 -178.769 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . 0.286 16.3 tp -55.96 -57.41 12.2 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.718 168.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 26.4 ttp-105 -49.09 -40.57 32.46 Favored 'General case' 0 N--CA 1.451 -0.381 1 CA-C-O 110.793 -4.432 . . . . 0.0 115.75 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -62.35 -24.12 67.17 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 127.7 3.125 . . . . 0.0 115.183 177.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -98.22 -35.12 10.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.661 -3.149 . . . . 0.0 110.84 175.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 48.0 mt -53.46 -39.74 64.71 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 120.631 1.559 . . . . 0.0 114.839 168.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . 0.297 15.5 tt0 -80.05 -13.13 59.54 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 117.016 -1.874 . . . . 0.0 107.986 -176.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -104.59 4.76 33.18 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 119.244 -2.16 . . . . 0.0 113.611 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 2.5 t -123.49 -27.06 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 114.401 -2.714 . . . . 0.0 113.73 162.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 29.0 mt -92.99 -27.39 17.05 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 123.985 3.084 . . . . 0.0 118.261 166.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.313 74.7 mt -114.66 30.45 7.32 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 122.615 2.462 . . . . 0.0 107.628 172.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -61.49 174.71 0.7 Allowed 'General case' 0 N--CA 1.449 -0.481 1 C-N-CA 131.993 4.117 . . . . 0.0 111.626 -174.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 14.6 m -58.13 -38.1 75.89 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 112.776 -2.011 . . . . 0.0 113.655 -169.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.953 2.501 . . . . 0.0 115.423 -174.478 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.1 ttm . . . . . 0 N--CA 1.449 -0.521 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.2 -39.98 84.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.973 1.471 . . . . 0.0 114.973 171.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -74.42 -46.52 39.57 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -54.37 -52.94 60.07 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 118.968 0.804 . . . . 0.0 112.173 176.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -60.2 -37.0 78.92 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 173.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 40.5 t60 -62.71 -48.99 76.86 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 115.321 -2.276 . . . . 0.0 113.762 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -66.78 -36.57 82.71 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 121.127 1.785 . . . . 0.0 113.889 175.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -58.69 -33.47 70.19 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 117.47 -3.269 . . . . 0.0 110.963 169.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -77.74 -40.81 39.86 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 117.881 2.549 . . . . 0.0 117.881 175.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.8 mt -63.08 -17.88 62.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 117.825 2.528 . . . . 0.0 117.825 172.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -62.21 -52.28 64.42 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 115.275 -2.298 . . . . 0.0 109.991 167.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -53.47 -46.14 69.84 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 127.346 2.904 . . . . 0.0 108.358 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.8 t -72.46 -19.86 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 O-C-N 117.056 -3.527 . . . . 0.0 116.767 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -83.77 -39.02 20.57 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 117.516 -3.24 . . . . 0.0 112.543 163.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.4 tp -49.11 -52.28 26.88 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 124.466 2.079 . . . . 0.0 112.838 170.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.8 tp -81.24 -16.5 52.49 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 118.14 -2.85 . . . . 0.0 108.792 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -64.27 -49.85 70.25 Favored 'General case' 0 N--CA 1.449 -0.481 1 CA-C-N 126.014 4.006 . . . . 0.0 108.771 168.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 58.0 m-20 -71.34 -15.08 62.38 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 118.47 -2.644 . . . . 0.0 112.832 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.17 -36.8 61.45 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 115.265 -2.303 . . . . 0.0 115.457 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -63.0 -37.22 86.3 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.217 2.207 . . . . 0.0 116.003 170.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -67.16 -9.54 41.02 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 113.071 -1.877 . . . . 0.0 114.151 171.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -120.71 4.59 10.57 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.723 -2.486 . . . . 0.0 112.6 173.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.322 13.2 m-20 56.93 29.39 16.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 116.385 1.995 . . . . 0.0 116.385 -170.286 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.7 mt -102.71 0.61 33.26 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 117.802 -3.061 . . . . 0.0 115.3 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 36.5 p-80 -57.24 -45.75 83.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.927 2.091 . . . . 0.0 110.983 173.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.354 77.2 mt -55.44 -51.44 79.95 Favored Pre-proline 0 N--CA 1.445 -0.69 2 O-C-N 115.938 -4.226 . . . . 0.0 113.368 178.064 . . . . . . . . 3 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -77.73 -37.77 0.83 Allowed 'Trans proline' 0 N--CA 1.449 -1.126 0 CA-C-O 115.634 -1.903 . . . . 0.0 108.95 -176.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.6 tp -58.6 -40.79 84.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 120.035 1.289 . . . . 0.0 113.562 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.62 -36.98 73.76 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 116.031 -1.938 . . . . 0.0 113.376 174.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -62.16 -23.15 66.42 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 119.469 3.137 . . . . 0.0 119.469 166.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.0 tp -74.25 -48.3 29.56 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 125.872 1.982 . . . . 0.0 115.7 166.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 79.0 mmm -77.29 -8.78 58.19 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.384 -1.293 . . . . 0.0 113.692 -167.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 53.2 mt -144.51 128.84 17.86 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 125.245 1.591 . . . . 0.0 113.741 -166.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 62.3 p -71.78 152.38 93.31 Favored Pre-proline 0 N--CA 1.446 -0.644 0 CA-C-O 122.281 1.038 . . . . 0.0 109.528 176.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -62.38 -13.07 30.55 Favored 'Trans proline' 0 N--CA 1.446 -1.297 0 C-N-CA 122.607 2.205 . . . . 0.0 114.398 -174.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.97 -27.17 18.86 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 119.406 -2.059 . . . . 0.0 112.205 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.81 -46.39 78.81 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 158.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 60.8 mtm-85 -63.2 -40.82 98.59 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 117.971 -1.492 . . . . 0.0 111.286 -178.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -62.03 -36.69 82.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 166.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.24 -25.78 66.26 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 117.322 -3.361 . . . . 0.0 113.798 173.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.1 mt -76.81 -40.9 46.42 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 124.956 2.313 . . . . 0.0 115.348 -177.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -47.23 -56.42 7.99 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 110.85 -2.886 . . . . 0.0 117.065 161.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.1 m -71.86 -35.2 69.74 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 112.542 -1.829 . . . . 0.0 114.311 175.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 60.4 mtt180 -61.75 -34.96 76.78 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 121.229 1.831 . . . . 0.0 111.275 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.4 t -59.29 -42.13 86.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 O-C-N 117.126 -3.484 . . . . 0.0 109.241 171.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -72.73 -26.32 61.53 Favored 'General case' 0 N--CA 1.449 -0.492 1 O-C-N 115.461 -4.525 . . . . 0.0 112.033 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 52.7 mt -67.6 -47.04 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 117.126 -1.416 . . . . 0.0 107.696 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.4 t -62.99 -38.57 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-O 116.412 -1.756 . . . . 0.0 112.069 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -61.84 -49.62 75.54 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 125.127 3.603 . . . . 0.0 112.704 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -76.08 -18.07 59.35 Favored 'General case' 0 N--CA 1.448 -0.546 1 CA-C-O 111.047 -4.311 . . . . 0.0 114.18 -173.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.9 mt -77.55 -33.02 54.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 124.944 3.52 . . . . 0.0 111.795 160.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.2 mt -78.1 -26.42 48.03 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 119.566 -0.854 . . . . 0.0 112.189 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -85.42 -30.99 23.13 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 123.682 1.706 . . . . 0.0 114.855 172.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.25 25.32 61.77 Favored Glycine 0 C--N 1.339 0.718 0 O-C-N 117.203 -3.436 . . . . 0.0 115.749 161.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -110.88 -36.46 5.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 120.544 2.172 . . . . 0.0 110.047 -170.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 55.6 mtp -64.08 139.76 58.8 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 174.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 54.0 p -83.83 173.36 11.33 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 111.793 -2.458 . . . . 0.0 111.442 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -70.72 -28.61 64.86 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 177.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.46 ' NH2' HD21 ' A' ' 73' ' ' ASN . 34.7 ttt85 -80.74 -34.79 34.09 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 114.083 -2.865 . . . . 0.0 107.656 175.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -65.37 -42.93 92.2 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 120.71 1.595 . . . . 0.0 108.761 175.161 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 40.4 mt -68.13 -20.26 64.89 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 123.083 2.674 . . . . 0.0 110.02 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -87.33 -38.82 15.89 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 120.787 1.63 . . . . 0.0 108.659 -177.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.46 HD21 ' NH2' ' A' ' 69' ' ' ARG . 7.5 m120 -77.11 -30.9 55.47 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 117.002 2.223 . . . . 0.0 117.002 174.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -101.59 -37.9 8.18 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 121.265 1.848 . . . . 0.0 112.215 -170.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.8 mt -106.75 -8.55 16.77 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 130.348 3.459 . . . . 0.0 115.22 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 88.28 -15.43 56.33 Favored Glycine 0 CA--C 1.526 0.742 0 O-C-N 120.033 -1.667 . . . . 0.0 114.717 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.48 119.6 16.92 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 126.833 2.053 . . . . 0.0 115.5 -159.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.59 179.15 26.67 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 119.377 2.511 . . . . 0.0 119.377 172.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 76.1 mt -53.15 -47.86 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 117.838 -1.077 . . . . 0.0 108.141 163.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.36 -49.48 72.15 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -176.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.1 m -65.5 -48.84 71.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.814 0.816 . . . . 0.0 110.958 -167.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.6 mm -65.51 -26.8 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 124.663 2.173 . . . . 0.0 114.917 175.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 55.9 m -71.62 -40.3 69.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 119.433 -2.042 . . . . 0.0 111.075 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 60.9 ttt180 -79.17 -31.45 43.9 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 127.799 2.439 . . . . 0.0 106.15 -176.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -58.37 -55.06 32.79 Favored Glycine 0 CA--C 1.521 0.436 0 O-C-N 120.013 -1.679 . . . . 0.0 112.307 165.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.6 m -69.2 -19.61 63.98 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -81.82 -38.92 24.77 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 116.316 -3.99 . . . . 0.0 107.239 174.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.3 m -66.02 -28.61 68.99 Favored 'General case' 0 N--CA 1.451 -0.415 1 O-C-N 116.192 -4.067 . . . . 0.0 116.589 171.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.85 -42.03 22.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 117.55 -3.219 . . . . 0.0 107.997 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -62.85 -27.08 69.09 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 125.328 1.643 . . . . 0.0 114.274 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.56 -17.25 20.59 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 126.043 1.737 . . . . 0.0 112.792 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.57 153.08 11.07 Favored Pre-proline 0 N--CA 1.45 -0.443 0 O-C-N 119.032 -2.293 . . . . 0.0 113.959 165.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -76.42 155.94 36.63 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 N-CA-C 109.279 -1.085 . . . . 0.0 109.279 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.5 m -66.57 -37.32 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-O 126.397 2.999 . . . . 0.0 113.578 -175.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.4 pm0 -62.46 -19.18 63.27 Favored 'General case' 0 N--CA 1.447 -0.598 1 O-C-N 114.939 -4.851 . . . . 0.0 116.947 170.096 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 50.8 tp -83.08 -38.67 22.18 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 124.378 1.049 . . . . 0.0 111.805 169.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -73.56 -34.29 65.09 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 117.932 -1.507 . . . . 0.0 109.525 -175.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -68.43 -33.43 74.19 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 84.0 t90 -81.7 -26.83 34.31 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.871 2.068 . . . . 0.0 112.711 -176.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 75.6 mt -69.92 -44.97 68.56 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 116.609 -3.807 . . . . 0.0 115.75 164.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -64.34 -2.85 2.42 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 163.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -91.08 -62.94 1.34 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 119.584 -0.847 . . . . 0.0 109.42 154.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 77.9 t -66.98 -35.81 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-O 118.096 -0.954 . . . . 0.0 109.032 -154.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 33.1 mt -96.01 -7.02 37.5 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 117.698 -3.127 . . . . 0.0 110.794 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 50.4 mt -124.32 7.61 8.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 123.452 2.842 . . . . 0.0 111.857 -172.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.286 60.1 tttt . . . . . 0 N--CA 1.444 -0.735 0 O-C-N 117.133 -3.479 . . . . 0.0 114.635 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.448 0 N-CA-C 118.493 2.775 . . . . 0.0 118.493 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 26.2 ttm -76.68 -29.63 56.4 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 113.808 -2.996 . . . . 0.0 109.948 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . 0.295 . . -62.22 -44.15 97.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 123.364 2.802 . . . . 0.0 110.588 170.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -61.6 -56.43 19.99 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 115.976 -1.964 . . . . 0.0 112.45 170.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -45.6 -43.1 11.96 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 171.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . 0.26 39.4 mmt180 -70.13 -42.05 73.11 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 119.246 -2.159 . . . . 0.0 115.706 171.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -57.59 -41.88 82.07 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 117.326 -3.359 . . . . 0.0 112.588 171.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -75.51 -25.21 57.06 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 113.519 -3.134 . . . . 0.0 115.093 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -59.15 -45.58 90.6 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 122.682 2.492 . . . . 0.0 115.574 158.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 53.2 t-105 -64.04 -52.6 58.66 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.586 2.354 . . . . 0.0 116.811 175.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 89.1 mt -56.16 -31.67 63.6 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 117.295 -3.378 . . . . 0.0 111.625 169.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -69.84 -32.08 70.3 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 122.324 2.329 . . . . 0.0 106.748 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -65.24 -48.46 73.21 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 117.317 -1.325 . . . . 0.0 112.669 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 95.9 t -60.2 -49.84 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 CA-C-O 112.362 -3.685 . . . . 0.0 112.259 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -50.58 -45.92 57.54 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 124.892 3.496 . . . . 0.0 114.845 167.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 24.5 tp -56.92 -45.97 82.32 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 27.2 tp -73.44 -26.63 61.02 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 47.2 tttt -73.0 -43.26 62.36 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 116.763 -1.589 . . . . 0.0 110.125 176.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -62.42 -44.01 97.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 164.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.8 70.21 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 119.55 -1.969 . . . . 0.0 112.64 -175.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -68.38 -30.56 69.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.456 -2.652 . . . . 0.0 111.132 171.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -80.92 -4.34 54.6 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.118 -0.989 . . . . 0.0 113.291 174.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . 0.265 1.1 m-80 -124.67 13.27 8.65 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 116.304 -1.808 . . . . 0.0 113.237 170.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 53.76 23.43 3.73 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 117.064 2.246 . . . . 0.0 117.064 -175.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.1 mt -98.72 15.48 25.16 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 126.512 2.382 . . . . 0.0 112.313 172.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -74.4 -41.65 60.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 123.189 2.722 . . . . 0.0 113.534 -168.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 20.5 mt -69.99 -44.98 22.59 Favored Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-O 117.344 -1.312 . . . . 0.0 113.001 176.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.48 -46.21 30.56 Favored 'Trans proline' 0 N--CA 1.452 -0.968 0 CA-C-N 124.257 2.556 . . . . 0.0 113.475 170.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 61.2 tp -56.87 -52.23 65.93 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 127.187 2.195 . . . . 0.0 113.268 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 29.9 mt -60.48 -35.34 75.68 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 116.013 -1.946 . . . . 0.0 115.625 178.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -70.78 -32.3 69.37 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 128.336 2.655 . . . . 0.0 113.39 171.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 57.8 tp -67.55 -36.18 80.47 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 121.903 -0.498 . . . . 0.0 112.107 165.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 96.7 mmm -90.64 -24.77 20.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 121.553 3.909 . . . . 0.0 121.553 -178.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 10.1 mt -125.69 131.63 52.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 114.3 -2.762 . . . . 0.0 109.28 -176.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.252 73.0 p -71.55 153.69 93.54 Favored Pre-proline 0 N--CA 1.447 -0.583 0 O-C-N 128.545 3.653 . . . . 0.0 118.979 175.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_exo -44.87 -45.25 14.0 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.53 2.82 . . . . 0.0 108.568 -175.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -41.45 80.81 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.011 2.069 . . . . 0.0 114.376 -177.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.12 -39.46 90.09 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.084 2.153 . . . . 0.0 110.975 171.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 48.4 mtm-85 -71.38 -41.82 69.2 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.86 1.664 . . . . 0.0 110.891 -177.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.271 37.1 tt0 -68.88 -31.49 70.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 174.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.47 -35.91 73.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.812 -1.089 . . . . 0.0 111.527 172.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -75.06 -33.1 61.67 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 116.505 -3.872 . . . . 0.0 112.899 176.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.75 -29.8 75.26 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 117.453 -2.308 . . . . 0.0 116.32 172.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 99.3 m -80.56 -33.27 36.29 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 126.83 2.135 . . . . 0.0 109.278 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -59.65 -30.7 68.92 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 118.366 2.728 . . . . 0.0 118.366 173.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 9.4 t -65.75 -45.63 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 174.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -70.29 -31.61 69.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.108 -1.425 . . . . 0.0 112.988 177.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 68.5 mt -68.03 -39.67 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 123.311 2.778 . . . . 0.0 109.537 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.388 78.5 t -78.38 -41.07 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 128.057 2.543 . . . . 0.0 112.982 -175.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -48.57 -46.88 39.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 123.384 1.564 . . . . 0.0 109.898 167.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -76.73 -35.73 57.6 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 119.435 -2.041 . . . . 0.0 109.705 -171.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 39.5 mt -67.39 -17.38 64.71 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.801 -1.571 . . . . 0.0 111.945 174.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 70.4 mt -94.19 -29.76 14.95 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 114.429 -2.701 . . . . 0.0 114.428 168.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 26.2 ttm105 -72.23 -37.2 69.24 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 130.286 3.434 . . . . 0.0 109.745 173.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.98 18.59 64.73 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 128.52 2.962 . . . . 0.0 117.919 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -115.71 54.18 0.82 Allowed 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 129.93 3.959 . . . . 0.0 115.351 -171.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 6.8 mtt -144.71 146.62 32.3 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 129.52 3.128 . . . . 0.0 111.956 164.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 91.4 p -81.16 175.57 10.53 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 161.189 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -64.85 -38.58 91.46 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 119.487 -2.008 . . . . 0.0 112.055 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 69' ' ' ARG . . . . . 0.41 HH21 ' HD2' ' B' ' 69' ' ' ARG . 20.0 ttt85 -56.01 -54.3 46.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 122.373 1.082 . . . . 0.0 113.235 174.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -58.16 -48.86 78.97 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.486 1.915 . . . . 0.0 112.937 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.41 -34.83 77.52 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 118.338 -2.726 . . . . 0.0 116.995 166.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 tptt -66.63 -36.02 81.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 121.627 2.012 . . . . 0.0 110.507 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -102.35 -45.15 5.18 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 120.876 -1.14 . . . . 0.0 108.997 -162.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -87.36 -34.72 18.71 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -171.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 63.7 mt -109.97 -10.93 14.7 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 117.23 2.308 . . . . 0.0 117.23 173.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.04 21.79 70.08 Favored Glycine 0 CA--C 1.526 0.73 0 C-N-CA 126.837 2.161 . . . . 0.0 111.614 177.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -103.74 96.17 6.52 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 122.423 3.111 . . . . 0.0 111.006 -177.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.37 178.61 41.28 Favored Glycine 0 C--N 1.335 0.489 0 O-C-N 126.127 2.142 . . . . 0.0 110.212 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 19.8 mt -42.12 -54.87 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 114.331 -0.935 . . . . 0.0 111.639 174.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.41 -56.0 11.15 Favored 'General case' 0 N--CA 1.451 -0.378 1 N-CA-C 121.856 4.021 . . . . 0.0 121.856 177.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 17.3 m -58.71 -47.17 85.47 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 173.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 40.7 mm -52.81 -45.61 50.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 124.581 1.152 . . . . 0.0 113.279 166.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 3.5 m -61.94 -36.92 82.83 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 123.962 1.839 . . . . 0.0 112.404 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -84.3 -27.96 27.45 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 117.578 -3.201 . . . . 0.0 109.456 -174.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.17 -38.89 28.53 Favored Glycine 0 C--N 1.334 0.434 0 O-C-N 118.435 -2.666 . . . . 0.0 111.694 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 18.8 m -65.03 -49.41 70.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 129.311 3.044 . . . . 0.0 107.658 175.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -52.55 -50.02 63.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 127.558 2.343 . . . . 0.0 111.313 170.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 13.5 m -66.06 -33.45 75.83 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.961 -1.712 . . . . 0.0 114.246 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 13.4 mt -61.45 -42.56 98.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 123.798 0.839 . . . . 0.0 112.861 167.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 39.3 mttm -65.73 -38.31 88.79 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 125.509 1.755 . . . . 0.0 113.551 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.06 -25.41 62.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.954 1.701 . . . . 0.0 111.875 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.38 165.74 6.46 Favored Pre-proline 0 N--CA 1.45 -0.464 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -69.11 162.1 43.12 Favored 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.788 2.326 . . . . 0.0 112.645 168.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 m -74.67 -30.56 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 O-C-N 119.109 -2.245 . . . . 0.0 111.156 171.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -70.85 -20.02 62.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.481 2.312 . . . . 0.0 111.254 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' B' ' 96' ' ' LEU . 13.3 tp -75.88 -56.46 4.65 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 114.538 -2.649 . . . . 0.0 110.1 167.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 92.9 mtm-85 -56.51 -46.67 80.41 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 121.22 1.827 . . . . 0.0 109.893 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -59.25 -30.35 68.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.729 -176.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 80.5 t90 -96.89 -33.09 11.74 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.066 -2.271 . . . . 0.0 112.488 -173.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.55 -33.38 73.75 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 118.664 -1.214 . . . . 0.0 111.798 166.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.7 -32.49 74.08 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 117.284 2.327 . . . . 0.0 117.284 171.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -75.32 -16.59 60.4 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 112.732 -2.031 . . . . 0.0 115.319 169.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 48.7 t -103.26 -41.14 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 O-C-N 117.069 -3.519 . . . . 0.0 115.416 171.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 88.6 mt -85.07 -35.47 21.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 121.903 2.138 . . . . 0.0 115.266 -168.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 33.2 mt -101.62 -10.34 20.14 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 118.828 -2.42 . . . . 0.0 109.543 -171.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -77.88 -7.69 57.06 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.339 1.855 . . . . 0.0 112.308 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . 0.25 14.4 m -89.36 -17.68 28.38 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.67 2.388 . . . . 0.0 116.549 178.04 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.27 70.4 m-20 . . . . . 0 C--O 1.248 0.986 0 C-N-CA 129.183 2.993 . . . . 0.0 109.129 171.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 62.4 ttp . . . . . 0 N--CA 1.474 0.751 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.92 168.96 11.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 120.491 1.496 . . . . 0.0 107.051 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -133.4 149.53 51.82 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.499 -2.626 . . . . 0.0 109.789 176.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -157.22 138.71 13.9 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 105.834 -1.913 . . . . 0.0 105.834 -177.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 32.6 p -139.91 171.4 7.94 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 130.62 3.568 . . . . 0.0 111.808 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -50.05 -33.42 34.72 Favored 'Trans proline' 0 N--CA 1.446 -1.278 0 N-CA-C 119.477 2.837 . . . . 0.0 119.477 174.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -151.02 148.06 27.89 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 115.851 -2.023 . . . . 0.0 107.109 -161.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 26.0 t -150.55 131.37 14.13 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.06 -23.66 60.59 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 114.653 -2.594 . . . . 0.0 113.269 167.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.85 -35.04 78.64 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 113.026 -3.369 . . . . 0.0 114.426 169.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 53.9 mtt -68.98 -43.23 75.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 127.178 2.799 . . . . 0.0 108.635 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . 0.254 . . -57.2 -37.62 72.48 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 174.437 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -64.96 -28.31 69.43 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 117.438 -3.289 . . . . 0.0 116.61 170.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -72.84 -44.94 60.81 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 120.373 -1.454 . . . . 0.0 113.401 170.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -36.15 71.76 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 126.144 1.778 . . . . 0.0 111.994 167.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -61.92 -44.89 95.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 120.251 -1.53 . . . . 0.0 111.234 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -75.52 -22.05 57.45 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 177.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -62.39 -45.22 94.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.838 1.255 . . . . 0.0 111.931 167.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 23.6 t-105 -59.5 -52.71 64.41 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 123.459 1.6 . . . . 0.0 114.423 169.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 15.3 mt -69.14 -24.63 64.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.148 -1.387 . . . . 0.0 112.858 -171.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -78.1 -32.35 50.55 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 117.17 -1.395 . . . . 0.0 113.555 165.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -58.9 -58.77 7.16 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 117.75 -1.58 . . . . 0.0 113.576 168.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.56 -46.42 95.03 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-O 122.452 1.12 . . . . 0.0 110.451 -171.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -58.74 -42.71 89.45 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 -177.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 60.9 tp -67.67 -46.51 72.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 131.389 3.876 . . . . 0.0 107.064 172.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.75 -31.46 72.46 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 128.015 3.322 . . . . 0.0 114.819 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . 0.32 27.3 ttpp -65.21 -41.33 94.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 117.621 2.452 . . . . 0.0 117.621 162.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -58.49 -27.57 64.57 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 124.327 3.239 . . . . 0.0 114.557 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.76 -38.01 86.41 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.757 1.623 . . . . 0.0 113.765 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -60.94 -16.75 46.07 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -82.71 -21.33 34.85 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 34.1 p-10 -126.62 8.03 6.95 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.374 2.0 m-20 73.59 23.18 2.47 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 119.862 -1.774 . . . . 0.0 114.006 175.063 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.61 5.57 31.18 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 122.026 2.194 . . . . 0.0 114.626 171.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -67.85 -43.48 79.37 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.203 -2.811 . . . . 0.0 116.557 -166.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.295 82.5 mt -72.1 -43.35 10.28 Favored Pre-proline 0 N--CA 1.45 -0.435 0 O-C-N 125.245 1.591 . . . . 0.0 114.139 170.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.61 -32.03 95.86 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 CA-C-O 124.57 1.821 . . . . 0.0 113.627 172.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 19.2 tp -72.39 -33.93 67.55 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.358 -2.714 . . . . 0.0 115.837 172.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 40.4 mt -77.33 -28.27 53.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.93 0.892 . . . . 0.0 109.757 173.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -73.46 -31.17 63.63 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 131.015 3.726 . . . . 0.0 109.883 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -72.29 -51.05 22.58 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 128.206 2.603 . . . . 0.0 115.766 168.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 91.7 mmm -85.4 -29.11 24.67 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.147 -1.406 . . . . 0.0 110.632 -164.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 9.1 mp -115.61 153.26 31.57 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 119.308 0.958 . . . . 0.0 110.153 -175.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 11.9 p -75.59 159.04 82.47 Favored Pre-proline 0 N--CA 1.449 -0.477 0 C-N-CA 127.03 2.132 . . . . 0.0 112.514 163.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.61 -24.77 46.79 Favored 'Trans proline' 0 N--CA 1.451 -1.024 1 C-N-CA 126.404 4.736 . . . . 0.0 116.446 173.455 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.76 -26.85 25.59 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.029 1.332 . . . . 0.0 109.412 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -77.37 -35.24 54.66 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 118.668 0.667 . . . . 0.0 112.558 172.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 86.6 mtm-85 -55.43 -52.17 64.49 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 124.955 1.302 . . . . 0.0 111.615 166.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -69.27 -39.51 78.34 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 115.603 -2.141 . . . . 0.0 110.846 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.39 -46.37 88.88 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.629 2.013 . . . . 0.0 111.454 169.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . 0.265 28.8 mt -63.89 -27.48 69.18 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 120.273 1.397 . . . . 0.0 113.658 -174.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.85 -25.1 42.67 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 117.62 1.808 . . . . 0.0 117.62 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 24.3 m -74.2 -37.56 63.87 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 116.015 -1.945 . . . . 0.0 112.07 166.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -56.78 -38.58 72.71 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 128.973 2.909 . . . . 0.0 114.877 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 69.1 t -59.31 -43.99 91.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 115.806 -2.045 . . . . 0.0 108.997 170.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 48.9 mtp180 -68.11 -34.13 75.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 122.006 2.185 . . . . 0.0 110.487 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 57' ' ' ILE . . . . . 0.434 HG22 HG13 ' C' ' 82' ' ' ILE . 50.0 mt -72.51 -36.85 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 120.009 -1.682 . . . . 0.0 111.735 176.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 78.4 t -56.83 -47.59 82.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 N-CA-C 118.086 2.625 . . . . 0.0 118.086 160.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -53.91 -48.24 70.35 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 129.113 2.965 . . . . 0.0 115.92 175.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -69.06 -19.37 64.08 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.124 -1.417 . . . . 0.0 111.825 -177.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 95.8 mt -89.0 -30.07 19.01 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.161 -1.876 . . . . 0.0 114.666 177.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 37.8 mt -64.44 -43.86 92.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 119.357 0.981 . . . . 0.0 111.703 165.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -62.74 -51.04 68.71 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 127.405 2.282 . . . . 0.0 113.464 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.36 -5.05 79.27 Favored Glycine 0 C--N 1.338 0.644 0 CA-C-O 115.355 -2.914 . . . . 0.0 112.383 158.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -69.65 -15.16 63.13 Favored 'General case' 0 N--CA 1.447 -0.599 1 N-CA-C 121.879 4.029 . . . . 0.0 121.879 -174.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . 0.263 39.2 mtt -59.44 127.1 30.37 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 129.902 3.281 . . . . 0.0 110.199 173.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 96.4 p -81.47 168.29 18.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 125.517 1.761 . . . . 0.0 109.71 175.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -56.83 -26.28 57.89 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 117.061 -1.447 . . . . 0.0 114.248 174.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 mtp-105 -69.44 -26.21 64.49 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 126.448 1.899 . . . . 0.0 112.553 167.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -99.78 -34.31 10.21 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 128.126 2.57 . . . . 0.0 116.653 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . 0.25 24.7 mt -62.5 -22.51 66.32 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.88 -1.763 . . . . 0.0 109.251 168.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -91.11 -53.74 4.24 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 125.467 1.729 . . . . 0.0 113.689 168.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -104.87 -1.02 26.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 119.39 3.108 . . . . 0.0 119.39 -166.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 23.9 tp10 -122.74 -31.94 3.62 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 128.698 2.799 . . . . 0.0 116.502 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 tp -88.93 -31.39 18.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 121.464 -0.772 . . . . 0.0 112.583 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 93.05 -179.37 39.49 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-O 117.828 -1.54 . . . . 0.0 116.235 172.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.75 -21.13 54.69 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 125.168 2.413 . . . . 0.0 112.308 169.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.67 -15.47 18.76 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-O 124.894 2.386 . . . . 0.0 116.547 171.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 6.0 tt -70.16 -34.38 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 120.276 -1.72 . . . . 0.0 112.451 176.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.89 -27.29 68.04 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 171.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 25.2 m -72.63 -27.75 62.33 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 122.22 2.282 . . . . 0.0 110.414 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 82' ' ' ILE . . . . . 0.434 HG13 HG22 ' C' ' 57' ' ' ILE 0.317 39.2 mm -97.56 -22.8 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 126.876 2.07 . . . . 0.0 116.173 -173.893 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 39.4 p -118.39 -3.14 10.98 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 120.833 3.642 . . . . 0.0 120.833 -176.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -126.18 153.06 45.16 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 117.865 -3.022 . . . . 0.0 111.962 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 94.13 167.64 37.33 Favored Glycine 0 C--N 1.335 0.505 0 N-CA-C 117.484 1.754 . . . . 0.0 117.484 -172.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 93.9 p -80.61 2.92 23.7 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 117.854 2.539 . . . . 0.0 117.854 -174.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -117.72 -9.65 10.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.962 -1.971 . . . . 0.0 112.607 171.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 57.5 p -47.77 168.28 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 -173.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 tp -53.78 -38.96 65.01 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 120.714 3.598 . . . . 0.0 120.714 -163.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.256 57.1 mttt -88.51 -12.56 42.56 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 124.808 1.318 . . . . 0.0 114.406 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.13 -10.63 41.2 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 129.789 3.235 . . . . 0.0 112.242 169.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.05 150.59 69.56 Favored Pre-proline 0 N--CA 1.446 -0.648 0 CA-C-O 115.142 -2.361 . . . . 0.0 112.997 172.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -39.06 141.21 0.39 Allowed 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 123.794 2.996 . . . . 0.0 118.45 166.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 2.1 t -59.78 -45.28 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 CA-C-O 113.536 -3.126 . . . . 0.0 110.441 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.6 pm0 -61.12 -16.87 49.01 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 121.145 1.793 . . . . 0.0 115.414 -176.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 14.8 tp -82.64 -41.54 19.32 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 117.017 2.229 . . . . 0.0 117.017 164.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -60.82 -37.17 81.08 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 116.519 -3.863 . . . . 0.0 110.038 176.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -71.23 -35.02 71.32 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.971 1.708 . . . . 0.0 111.68 175.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -75.11 -40.27 59.99 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 31.1 mt -61.35 -36.71 80.95 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.972 1.709 . . . . 0.0 109.744 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.99 -27.92 67.84 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 170.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -79.36 -17.64 54.07 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 122.504 2.411 . . . . 0.0 111.137 174.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 92.8 t -108.93 -28.77 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 O-C-N 117.901 -2.999 . . . . 0.0 114.28 -176.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 65.9 mt -95.79 -45.9 6.8 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.079 0.942 . . . . 0.0 109.696 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 33.1 mt -92.98 16.85 11.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 120.992 -1.068 . . . . 0.0 113.271 -171.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 51.6 pttt . . . . . 0 N--CA 1.447 -0.601 0 O-C-N 118.506 -2.621 . . . . 0.0 116.813 157.169 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 21.0 p . . . . . 0 N--CA 1.447 -0.583 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 99.5 Cg_exo -53.25 -49.91 15.82 Favored 'Trans proline' 0 N--CA 1.449 -1.142 1 C-N-CA 125.651 4.234 . . . . 0.0 115.522 177.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -151.35 126.05 9.61 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.341 1.856 . . . . 0.0 114.547 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 14.5 t -47.12 113.66 0.71 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 166.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.16 -44.83 32.71 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 113.244 -1.798 . . . . 0.0 109.686 171.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.88 -26.47 62.36 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.612 2.078 . . . . 0.0 116.612 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 11' ' ' MET . . . . . 0.431 ' O ' ' HD2' ' D' ' 15' ' ' ARG . 17.8 mmt -71.32 -31.22 67.16 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 126.058 2.098 . . . . 0.0 111.244 168.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.42 -21.99 52.23 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 118.374 -2.704 . . . . 0.0 111.064 176.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -79.22 -34.87 42.43 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.817 1.189 . . . . 0.0 109.705 166.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -62.39 -43.3 99.13 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 123.666 1.698 . . . . 0.0 111.325 -177.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 15' ' ' ARG . . . . . 0.431 ' HD2' ' O ' ' D' ' 11' ' ' MET . 0.0 OUTLIER -64.57 -33.14 75.21 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 118.99 2.959 . . . . 0.0 118.99 169.719 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -72.51 -12.88 61.26 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 119.089 -2.257 . . . . 0.0 113.228 166.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -94.09 -32.54 13.73 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 118.894 2.924 . . . . 0.0 118.894 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -67.62 -26.55 66.3 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 111.248 -2.705 . . . . 0.0 109.019 169.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 8.2 t-105 -74.04 -53.44 10.0 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 123.727 1.727 . . . . 0.0 110.97 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.92 -15.64 44.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 117.926 -2.983 . . . . 0.0 112.764 173.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -75.46 -23.83 56.93 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 120.256 1.389 . . . . 0.0 113.99 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -78.51 -35.05 46.87 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.748 2.019 . . . . 0.0 109.328 174.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 91.9 t -62.2 -47.23 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 O-C-N 124.209 0.943 . . . . 0.0 109.174 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -70.87 -40.11 72.49 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.574 1.15 . . . . 0.0 112.468 174.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 20.7 tp -50.92 -45.11 60.27 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 121.129 1.786 . . . . 0.0 113.255 168.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 56.6 tp -73.87 -38.06 64.55 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 123.445 1.593 . . . . 0.0 115.187 -176.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 27' ' ' LYS . . . . . 0.46 ' HA ' ' CD2' ' D' ' 30' ' ' TYR . 27.9 ttpt -61.84 -49.29 76.86 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 120.358 -1.464 . . . . 0.0 108.163 169.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -58.84 -22.08 58.17 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.931 -2.981 . . . . 0.0 117.557 171.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 29' ' ' ALA . . . . . 0.42 ' HA ' ' OD1' ' D' ' 32' ' ' ASN . . . -85.81 -26.43 25.74 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 120.27 -1.519 . . . . 0.0 112.455 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 30' ' ' TYR . . . . . 0.46 ' CD2' ' HA ' ' D' ' 27' ' ' LYS . 16.7 m-30 -56.69 -45.42 81.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 118.941 -2.35 . . . . 0.0 110.442 166.225 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -73.16 -25.59 60.86 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.886 2.074 . . . . 0.0 108.069 -163.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 32' ' ' ASN . . . . . 0.42 ' OD1' ' HA ' ' D' ' 29' ' ' ALA . 43.2 p30 -115.22 5.35 14.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.211 1.804 . . . . 0.0 114.963 174.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 57.61 28.45 15.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 -178.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 15.3 mt -83.59 1.43 42.19 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.234 2.214 . . . . 0.0 112.067 164.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -60.08 3.73 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 118.212 2.671 . . . . 0.0 118.212 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 9.0 mt -57.37 -54.31 56.27 Favored Pre-proline 0 N--CA 1.451 -0.412 0 CA-C-O 114.396 -2.716 . . . . 0.0 109.677 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -43.68 -46.24 10.42 Favored 'Trans proline' 0 N--CA 1.447 -1.238 0 CA-C-N 124.696 2.713 . . . . 0.0 115.393 159.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 22.5 tp -74.44 -39.09 62.8 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 116.379 -3.951 . . . . 0.0 114.744 -176.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 39' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' D' ' 39' ' ' LEU . 42.4 mt -59.7 -48.44 81.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.18 -2.2 . . . . 0.0 107.185 166.427 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 33.0 m-20 -63.43 -31.57 72.76 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 121.393 1.906 . . . . 0.0 114.516 -178.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 31.4 tp -71.15 -41.78 69.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 116.175 -1.869 . . . . 0.0 106.601 172.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 8.0 mmm -83.47 -23.3 32.26 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -170.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 29.5 mt -127.45 141.74 51.59 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 104.69 -2.337 . . . . 0.0 104.69 -173.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 71.7 p -60.22 158.05 29.88 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-O 114.745 -2.55 . . . . 0.0 116.82 171.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -48.15 -50.52 11.82 Favored 'Trans proline' 0 N--CA 1.447 -1.237 1 C-N-CA 126.684 4.923 . . . . 0.0 114.386 170.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -71.82 -17.83 62.13 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 117.738 2.496 . . . . 0.0 117.738 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -73.15 -42.14 63.16 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.412 163.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -61.18 -41.89 97.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 126.815 2.046 . . . . 0.0 108.02 175.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -66.07 -38.75 89.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.528 1.131 . . . . 0.0 110.927 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.59 -33.94 23.27 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.776 2.031 . . . . 0.0 112.911 -177.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 84.0 mt -58.65 -43.54 89.84 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.065 -2.397 . . . . 0.0 116.183 160.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.7 -34.44 70.41 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-N 121.102 1.774 . . . . 0.0 113.691 170.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 17.8 m -77.07 -38.14 53.12 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 122.335 1.064 . . . . 0.0 112.929 -177.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -61.54 -31.17 71.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 112.444 -3.646 . . . . 0.0 110.852 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.71 -49.94 70.95 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 CA-C-N 123.702 2.956 . . . . 0.0 112.515 170.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.307 9.4 ptm180 -65.64 -22.18 66.63 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 118.267 2.691 . . . . 0.0 118.267 169.469 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 10.2 mt -70.93 -42.49 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 124.194 3.179 . . . . 0.0 112.484 171.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 3.2 t -61.9 -48.12 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 128.163 3.415 . . . . 0.0 111.724 169.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -63.06 -38.82 92.73 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.313 -2.742 . . . . 0.0 108.976 -174.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 60' ' ' GLU . . . . . 0.425 ' HA ' ' HB3' ' D' ' 63' ' ' ARG . 75.5 mm-40 -75.14 -26.9 59.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 115.679 -2.105 . . . . 0.0 112.305 174.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 63.4 mt -68.73 -23.62 64.36 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 116.734 -1.603 . . . . 0.0 110.389 174.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 29.8 mt -84.09 -38.72 20.43 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 170.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 63' ' ' ARG . . . . . 0.425 ' HB3' ' HA ' ' D' ' 60' ' ' GLU . 40.1 ttm180 -69.64 -29.32 66.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 127.327 2.892 . . . . 0.0 114.455 175.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.42 36.99 92.5 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-O 115.727 -2.707 . . . . 0.0 113.481 158.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -111.63 -25.17 9.67 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 114.774 -2.536 . . . . 0.0 110.157 173.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . 0.256 33.6 mtm -89.23 30.84 0.93 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 169.134 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 77.7 p -85.36 172.83 10.77 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 119.47 -2.019 . . . . 0.0 111.022 -163.07 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.268 5.5 tp60 65.15 -17.64 0.09 Allowed 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 116.598 -3.814 . . . . 0.0 119.305 169.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 35.0 ttt85 -146.96 -59.85 0.28 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 129.995 3.318 . . . . 0.0 116.169 176.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -84.38 -35.86 22.87 Favored 'General case' 0 N--CA 1.446 -0.644 1 O-C-N 115.47 -4.519 . . . . 0.0 114.16 -152.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.72 -41.99 15.96 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 116.369 -3.957 . . . . 0.0 116.05 178.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt -61.14 -38.91 88.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 112.822 -1.99 . . . . 0.0 108.997 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -84.2 -20.56 32.12 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 126.49 2.369 . . . . 0.0 114.233 -176.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -97.3 -38.88 9.49 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 127.963 2.505 . . . . 0.0 110.986 -173.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -120.9 -16.91 8.02 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 85.47 -171.23 45.4 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-O 123.707 1.726 . . . . 0.0 116.746 165.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.254 . . -43.43 -16.69 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.88 -20.47 68.6 Favored Glycine 0 C--N 1.335 0.522 0 CA-C-N 122.585 2.448 . . . . 0.0 112.537 171.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 5.0 tt -46.05 -18.06 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 C-N-CA 126.498 1.919 . . . . 0.0 114.959 168.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -103.99 -21.9 13.54 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 117.866 -1.534 . . . . 0.0 112.65 -178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 17.7 m -66.72 -39.4 87.99 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.375 1.47 . . . . 0.0 109.816 165.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 8.5 mm -87.06 -18.18 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 O-C-N 117.755 -3.09 . . . . 0.0 114.444 -172.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 31.0 p -109.25 -24.89 10.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 120.99 3.7 . . . . 0.0 120.99 168.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.8 mtp85 -83.84 162.42 20.57 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.894 -3.004 . . . . 0.0 110.827 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.31 154.73 30.95 Favored Glycine 0 N--CA 1.446 -0.66 0 O-C-N 127.247 2.842 . . . . 0.0 112.275 -177.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 24.6 m -74.38 -7.2 52.08 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 115.847 -2.025 . . . . 0.0 114.943 -168.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . 0.276 18.2 m-80 -134.36 33.38 3.31 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 123.606 2.912 . . . . 0.0 105.963 -171.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 59.9 p -77.28 -175.5 3.72 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.415 2.746 . . . . 0.0 118.415 175.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 29.7 tp -56.24 -32.12 64.19 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 118.389 -2.695 . . . . 0.0 113.951 165.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -74.46 -16.92 60.84 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.161 0.584 . . . . 0.0 110.569 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -104.49 -15.24 15.42 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 113.634 -3.079 . . . . 0.0 113.372 -166.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 92' ' ' ALA . . . . . 0.478 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 45.07 87.19 0.12 Allowed Pre-proline 0 N--CA 1.449 -0.513 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 165.218 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 93' ' ' PRO . . . . . 0.478 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 50.7 Cg_exo 34.19 42.24 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.168 0 C-N-CA 122.447 -1.897 . . . . 0.0 115.861 36.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 94' ' ' VAL . . . . . 0.45 HG22 ' HB1' ' D' ' 92' ' ' ALA . 0.2 OUTLIER -72.73 15.19 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 111.062 -2.79 . . . . 0.0 110.743 -170.68 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' D' D ' 95' ' ' GLU . . . . . 0.442 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -144.25 -30.0 0.48 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -169.066 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 58.8 tp -50.82 -55.38 17.15 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.663 157.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . 0.31 24.2 ptt180 -59.3 -37.19 77.09 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 112.685 -3.531 . . . . 0.0 112.512 -176.226 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -71.16 -23.52 62.08 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.455 2.302 . . . . 0.0 110.72 176.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . 0.255 79.3 t90 -87.28 -42.48 12.89 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.709 1.204 . . . . 0.0 111.398 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 51.6 mt -59.76 -55.02 39.49 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 129.454 3.102 . . . . 0.0 106.432 169.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -44.47 -31.36 1.07 Allowed 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 173.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -89.49 -29.34 19.04 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 69.5 t -91.15 -22.83 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 O-C-N 121.316 -0.865 . . . . 0.0 110.729 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 65.9 mt -102.84 -27.67 12.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 119.915 -1.741 . . . . 0.0 112.308 -172.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 28.5 mt -101.78 12.01 37.78 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -62.2 152.16 34.03 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 127.478 2.986 . . . . 0.0 109.77 -171.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 47.8 m -66.38 -27.3 67.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 117.751 2.5 . . . . 0.0 117.751 -168.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . 0.255 0.6 OUTLIER . . . . . 0 C--O 1.25 1.099 0 O-C-N 126.899 2.625 . . . . 0.0 116.256 169.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.4 ttp . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.87 -25.5 60.07 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 124.617 2.151 . . . . 0.0 116.691 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -64.91 -30.41 71.4 Favored 'General case' 0 N--CA 1.445 -0.698 0 O-C-N 120.07 -1.644 . . . . 0.0 113.337 165.004 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -80.65 -38.69 28.68 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 118.563 -1.255 . . . . 0.0 108.232 -170.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.7 mmt-85 -62.11 -25.03 67.48 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 125.8 1.938 . . . . 0.0 114.839 176.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.0 t60 -61.52 -46.64 89.12 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 117.836 2.532 . . . . 0.0 117.836 171.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -68.93 -26.09 64.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 171.162 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -72.13 -48.79 41.09 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.462 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG . 20.2 t-105 -60.91 -45.59 94.03 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.31 1.844 . . . . 0.0 112.22 172.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.52 -18.94 62.95 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 177.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -69.45 -29.09 66.7 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 119.003 0.819 . . . . 0.0 110.205 170.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -62.1 -46.28 89.79 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 120.315 -1.491 . . . . 0.0 112.092 165.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.8 t -84.46 -0.21 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 115.6 1.704 . . . . 0.0 115.6 -170.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -96.52 -39.07 9.73 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 113.894 -1.503 . . . . 0.0 109.485 164.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 66.0 tp -60.68 -34.52 74.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 127.121 2.168 . . . . 0.0 108.382 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.6 tp -85.18 -22.87 28.58 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 126.8 2.563 . . . . 0.0 109.741 -169.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -79.62 -31.53 41.68 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 121.399 -0.813 . . . . 0.0 112.013 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . 0.256 25.9 m-20 -82.17 -22.27 36.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 118.683 -2.511 . . . . 0.0 111.153 175.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.76 -43.54 92.94 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 169.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -55.47 -46.51 76.84 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 123.684 1.707 . . . . 0.0 111.391 172.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -66.31 -24.86 66.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.562 1.945 . . . . 0.0 112.806 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -104.96 11.13 33.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 113.855 -2.974 . . . . 0.0 114.209 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.417 1.8 m-20 61.03 22.38 12.64 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 125.64 1.838 . . . . 0.0 112.144 174.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.3 mt -109.88 4.15 21.32 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.365 1.866 . . . . 0.0 112.837 177.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -49.53 -43.55 45.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 -179.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 36' ' ' LEU 0.391 80.1 mt -58.13 -60.49 9.95 Favored Pre-proline 0 N--CA 1.45 -0.46 0 N-CA-C 116.314 1.968 . . . . 0.0 116.314 172.987 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . 0.269 27.2 Cg_endo -60.21 -39.97 63.75 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 117.225 -1.383 . . . . 0.0 112.704 -176.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 tp -55.29 -40.33 70.92 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.488 -2.633 . . . . 0.0 115.846 172.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 85.5 mt -75.12 -35.13 61.74 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.766 0.826 . . . . 0.0 109.036 178.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -62.74 -40.5 97.42 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 123.521 0.513 . . . . 0.0 111.052 176.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.9 tp -68.25 -30.39 69.41 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 115.674 -2.108 . . . . 0.0 114.088 174.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 85.3 mmm -97.64 -22.15 16.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 123.494 2.861 . . . . 0.0 112.372 -168.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mp -134.13 150.13 51.11 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 126.091 1.757 . . . . 0.0 109.661 -176.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.445 ' HB ' ' HD2' ' A' ' 45' ' ' PRO . 64.3 p -81.57 163.34 54.69 Favored Pre-proline 0 N--CA 1.451 -0.401 0 C-N-CA 126.704 2.002 . . . . 0.0 111.724 173.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.445 ' HD2' ' HB ' ' A' ' 44' ' ' THR . 24.7 Cg_endo -64.15 -32.45 63.31 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 CA-C-N 119.509 0.86 . . . . 0.0 111.998 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.19 -35.32 77.81 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 115.645 -2.121 . . . . 0.0 110.432 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.21 -24.07 60.47 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 122.955 2.616 . . . . 0.0 114.18 174.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.0 mtm-85 -84.98 -35.31 22.07 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 126.014 2.071 . . . . 0.0 115.204 171.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.3 -39.14 82.08 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.404 1.882 . . . . 0.0 110.316 170.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.47 83.86 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 130.565 3.546 . . . . 0.0 113.486 174.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.2 mt -72.33 -36.47 68.85 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 118.017 -2.927 . . . . 0.0 107.143 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.03 -51.39 54.14 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 174.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.25 8.8 m -62.99 -30.82 71.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 128.889 2.876 . . . . 0.0 113.143 175.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.7 mtt180 -80.88 -32.79 34.75 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 117.715 -1.594 . . . . 0.0 108.373 -168.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.447 ' HA ' ' HE1' ' B' ' 42' ' ' MET . 83.8 t -45.43 -46.4 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-O 115.16 -2.353 . . . . 0.0 114.738 154.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -79.51 -27.98 41.41 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.448 2.386 . . . . 0.0 108.657 -169.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.6 mt -63.53 -55.21 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 C-N-CA 125.27 1.428 . . . . 0.0 110.49 166.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.1 t -61.72 -35.16 65.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 117.019 -1.872 . . . . 0.0 113.514 -173.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . 0.256 28.8 tt0 -46.6 -60.09 2.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 118.137 -2.852 . . . . 0.0 113.136 166.04 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -58.82 -29.33 66.8 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 175.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 42.3 mt -76.09 -28.75 57.68 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 118.701 -1.2 . . . . 0.0 112.427 173.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.3 mt -74.28 -31.32 62.47 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 119.117 -2.239 . . . . 0.0 113.196 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 43.3 ttm105 -71.95 -41.48 67.73 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 129.805 3.242 . . . . 0.0 112.918 173.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.54 35.15 21.56 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 120.065 2.786 . . . . 0.0 120.065 -174.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -98.2 -37.43 9.7 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 119.863 1.831 . . . . 0.0 113.096 168.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 42.5 mtt -75.28 127.19 32.6 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 118.939 -1.105 . . . . 0.0 109.568 -177.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 54.0 p -47.94 165.75 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 127.227 2.211 . . . . 0.0 114.59 151.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -68.58 -33.65 74.43 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 127.407 2.283 . . . . 0.0 109.63 170.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.3 tpt85 -55.3 -54.35 44.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.248 1.019 . . . . 0.0 111.247 168.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -58.49 -48.58 80.34 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 175.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.5 mt -54.53 -29.09 49.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 115.463 1.653 . . . . 0.0 115.463 171.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -77.52 -50.03 13.48 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 118.305 -2.747 . . . . 0.0 109.084 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -64.18 -41.82 96.94 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 119.606 3.187 . . . . 0.0 119.606 172.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -81.06 -42.24 21.34 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 125.539 2.59 . . . . 0.0 114.072 -171.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.8 mt -120.9 -5.41 9.6 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 117.984 -2.948 . . . . 0.0 114.12 -172.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 82.32 -12.18 46.5 Favored Glycine 0 CA--C 1.523 0.577 0 O-C-N 116.664 -3.772 . . . . 0.0 115.686 175.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.45 ' HB1' HG12 ' A' ' 82' ' ' ILE . . . -71.55 120.69 17.49 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 125.498 1.352 . . . . 0.0 111.242 -174.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.8 -172.26 41.33 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-N 113.407 -1.724 . . . . 0.0 115.815 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.7 mt -55.37 -46.86 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-O 114.395 -2.717 . . . . 0.0 110.427 165.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.12 86.7 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 122.091 2.223 . . . . 0.0 115.228 -171.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 62.5 p -94.19 -25.57 17.03 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 124.003 1.859 . . . . 0.0 115.957 -174.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.45 HG12 ' HB1' ' A' ' 77' ' ' ALA . 31.1 mm -74.28 -34.2 36.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 O-C-N 118.446 -2.659 . . . . 0.0 107.717 171.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.1 m -62.39 -52.78 62.21 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 121.889 2.132 . . . . 0.0 109.071 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.6 ttt180 -63.17 -57.92 8.94 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 117.706 -1.14 . . . . 0.0 109.688 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.09 -31.42 4.38 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-O 123.19 1.439 . . . . 0.0 116.244 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.2 m -69.33 -50.79 43.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 119.998 -1.883 . . . . 0.0 111.108 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -56.82 -39.6 74.47 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 119.927 -1.733 . . . . 0.0 114.378 175.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.4 m -72.17 -41.32 67.17 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 115.018 -2.42 . . . . 0.0 112.263 176.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.7 tt -67.21 -40.91 86.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 122.844 2.566 . . . . 0.0 114.374 173.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -67.6 -23.3 65.36 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 118.121 2.637 . . . . 0.0 118.121 177.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.47 -13.66 25.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.848 1.659 . . . . 0.0 113.467 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.97 154.25 92.77 Favored Pre-proline 0 N--CA 1.452 -0.348 0 O-C-N 118.941 -2.349 . . . . 0.0 111.223 -177.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -64.99 141.52 70.9 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 125.008 3.805 . . . . 0.0 113.36 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.8 m -54.4 -32.04 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 O-C-N 126.877 2.611 . . . . 0.0 113.687 -177.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.5 pm0 -75.53 -22.91 56.69 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.559 -1.655 . . . . 0.0 113.739 -177.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 20.1 tp -76.76 -42.15 42.05 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 119.033 -2.292 . . . . 0.0 106.475 174.158 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . 0.331 22.9 mtm180 -67.76 -54.94 15.22 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 123.714 1.721 . . . . 0.0 114.415 -164.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -59.29 -13.96 9.7 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 129.983 3.313 . . . . 0.0 115.026 169.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 37.4 t90 -96.47 -28.49 14.4 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 115.092 -2.385 . . . . 0.0 109.675 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 84.9 mt -77.99 -35.79 49.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 123.834 3.015 . . . . 0.0 113.916 173.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.08 -30.5 71.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 116.551 -2.059 . . . . 0.0 115.305 170.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -65.79 -55.02 19.39 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 118.282 2.697 . . . . 0.0 118.282 162.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 84.9 t -80.83 -26.74 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 O-C-N 120.477 -1.389 . . . . 0.0 110.203 -167.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.9 mt -96.59 -32.53 12.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -175.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 44.2 mt -98.59 -11.27 22.31 Favored 'General case' 0 N--CA 1.446 -0.658 0 O-C-N 117.785 -3.072 . . . . 0.0 114.36 -171.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt . . . . . 0 N--CA 1.449 -0.521 0 O-C-N 124.089 0.868 . . . . 0.0 112.182 -176.017 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.643 0 N-CA-C 110.771 -0.085 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 12.3 ttm -70.86 -32.79 69.92 Favored 'General case' 0 N--CA 1.45 -0.448 1 O-C-N 116.047 -4.158 . . . . 0.0 108.654 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.56 -37.99 80.39 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.738 1.732 . . . . 0.0 111.825 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -61.76 -53.37 56.91 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.247 -2.158 . . . . 0.0 109.45 175.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -55.56 -20.37 13.11 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 117.497 2.406 . . . . 0.0 117.497 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 14.1 mmm180 -84.38 -33.51 23.79 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 170.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -66.35 -34.07 77.15 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 115.439 -2.22 . . . . 0.0 112.764 166.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -79.59 -27.52 41.1 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 115.808 -2.044 . . . . 0.0 109.838 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -65.29 -30.29 71.14 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 120.929 1.695 . . . . 0.0 114.96 164.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 18.6 t-105 -74.84 -45.68 41.6 Favored 'General case' 0 N--CA 1.445 -0.685 1 O-C-N 114.806 -4.934 . . . . 0.0 112.903 173.354 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 8.9 mt -60.72 -23.36 64.85 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 113.15 -3.309 . . . . 0.0 114.038 166.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 53.6 ttt180 -72.31 -34.37 68.07 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 125.325 3.693 . . . . 0.0 111.55 173.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -55.82 -50.69 69.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 119.649 1.113 . . . . 0.0 112.416 167.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 87.3 t -74.08 -33.58 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 O-C-N 127.159 2.787 . . . . 0.0 108.874 -171.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.82 -45.76 93.18 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 119.878 -1.764 . . . . 0.0 115.384 167.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 23.0 tp -62.75 -46.75 86.59 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.14 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 59.7 tp -69.32 -25.7 64.35 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 118.353 -2.717 . . . . 0.0 117.178 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -59.02 -61.28 2.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 118.265 -2.772 . . . . 0.0 110.011 162.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -60.32 -29.52 68.92 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.179 -3.451 . . . . 0.0 111.82 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.67 -32.28 69.49 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 130.766 3.626 . . . . 0.0 115.034 175.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -66.05 -52.46 48.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.962 1.305 . . . . 0.0 110.653 172.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -50.57 -43.38 56.35 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 115.94 -1.981 . . . . 0.0 115.511 167.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -91.18 3.68 54.2 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 130.27 3.428 . . . . 0.0 108.775 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.365 6.1 m-20 62.57 21.06 12.42 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 118.922 2.934 . . . . 0.0 118.922 -177.051 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -104.11 12.68 33.67 Favored 'General case' 0 N--CA 1.446 -0.636 1 O-C-N 114.46 -5.15 . . . . 0.0 114.651 -175.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 11.5 p-80 -57.86 -49.13 77.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 128.001 2.52 . . . . 0.0 116.151 -170.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 15.6 mt -66.21 -39.44 28.09 Favored Pre-proline 0 N--CA 1.449 -0.494 0 C-N-CA 126.881 2.072 . . . . 0.0 116.418 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.301 26.5 Cg_exo -59.03 -45.34 28.72 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 N-CA-C 115.193 1.19 . . . . 0.0 115.193 164.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 29.5 tp -56.62 -54.09 50.1 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 119.963 -1.711 . . . . 0.0 112.166 176.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 63.1 mt -54.58 -34.76 62.46 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 119.524 -1.985 . . . . 0.0 113.537 170.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -71.27 -29.44 65.08 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 117.796 -1.097 . . . . 0.0 110.685 173.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . 0.408 16.1 tp -75.04 -43.42 53.59 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 116.238 -1.839 . . . . 0.0 114.544 174.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' MET . . . . . 0.447 ' HE1' ' HA ' ' A' ' 55' ' ' VAL . 19.5 mmt -94.84 -20.92 19.04 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 125.283 1.614 . . . . 0.0 112.272 -168.259 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -114.28 133.93 55.3 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 121.077 1.762 . . . . 0.0 111.122 173.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 73.2 p -72.98 152.95 90.93 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 122.038 2.199 . . . . 0.0 110.971 170.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 99.4 Cg_exo -28.3 -54.87 0.14 Allowed 'Trans proline' 0 N--CA 1.449 -1.105 1 C-N-CA 126.325 4.683 . . . . 0.0 112.559 166.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -62.3 -43.02 99.79 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 127.627 3.08 . . . . 0.0 115.847 -175.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -64.19 -39.23 93.56 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 119.611 3.189 . . . . 0.0 119.611 166.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' ARG . . . . . 0.462 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 37.8 mtm-85 -61.42 -40.34 94.05 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 115.006 -2.426 . . . . 0.0 107.209 169.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -66.5 -31.36 72.05 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 124.25 3.205 . . . . 0.0 113.151 175.116 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.2 -47.55 82.12 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 118.38 -2.7 . . . . 0.0 114.323 168.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.12 -37.57 83.28 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 120.007 3.336 . . . . 0.0 120.007 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.09 -18.76 76.72 Favored Glycine 0 C--N 1.34 0.767 0 C-N-CA 117.705 -2.188 . . . . 0.0 112.009 176.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -85.06 -36.31 21.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 119.243 -2.328 . . . . 0.0 109.82 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 85.9 mtt180 -60.3 -25.9 66.11 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.327 1.451 . . . . 0.0 114.216 171.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . 0.319 16.6 t -59.37 -56.96 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 C-N-CA 126.085 1.754 . . . . 0.0 111.025 164.113 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -72.25 -32.49 66.73 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 120.369 1.44 . . . . 0.0 112.422 -176.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 9.1 mt -59.6 -56.14 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 121.221 1.828 . . . . 0.0 113.214 162.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.261 29.6 t -66.7 -36.24 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 O-C-N 117.818 -3.051 . . . . 0.0 112.759 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -45.19 -59.49 2.61 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 128.972 2.909 . . . . 0.0 112.248 159.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -69.2 -21.07 63.98 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 119.024 -2.297 . . . . 0.0 114.852 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 12.2 mt -67.03 -19.03 65.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 116.705 -3.747 . . . . 0.0 110.468 167.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mt -96.02 -40.56 9.2 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 122.694 2.497 . . . . 0.0 109.874 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 27.6 ttm180 -58.79 -59.24 5.75 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 125.006 1.441 . . . . 0.0 113.25 174.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.49 48.48 23.4 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 115.983 -3.008 . . . . 0.0 115.347 -179.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -126.49 -27.71 3.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 126.568 1.981 . . . . 0.0 114.371 -178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 16.9 mtt -62.77 141.52 58.56 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 115.44 1.645 . . . . 0.0 115.44 177.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.7 p -72.65 157.97 36.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 162.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -64.29 -16.12 61.54 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 115.719 -2.086 . . . . 0.0 113.894 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -67.3 -48.48 67.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.708 1.203 . . . . 0.0 113.788 166.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -67.43 -34.06 76.44 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 128.506 2.723 . . . . 0.0 110.314 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.541 HD22 HD11 ' B' ' 82' ' ' ILE 0.252 79.4 mt -61.07 -55.14 36.07 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 123.501 1.62 . . . . 0.0 112.194 175.517 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -63.73 -44.79 92.52 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 119.844 -1.785 . . . . 0.0 110.56 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -97.23 -24.65 15.6 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 116.356 -1.783 . . . . 0.0 113.402 -160.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -117.1 -35.39 4.09 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 116.826 -1.95 . . . . 0.0 112.373 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 45.0 mt -92.43 -7.3 47.97 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 129.018 2.927 . . . . 0.0 115.38 177.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 55.31 41.17 78.85 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-O 118.893 -0.948 . . . . 0.0 115.156 -176.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.28 101.37 7.93 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 117.003 -1.475 . . . . 0.0 111.599 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.8 171.28 30.99 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 119.966 2.746 . . . . 0.0 119.966 161.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . 0.251 55.0 mt -40.9 -41.33 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 175.237 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . 0.334 . . -58.73 -37.87 77.12 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.639 1.175 . . . . 0.0 113.136 176.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.2 m -79.76 -35.01 39.32 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 120.785 -1.197 . . . . 0.0 113.161 178.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 82' ' ' ILE . . . . . 0.541 HD11 HD22 ' B' ' 71' ' ' LEU . 16.3 mm -70.76 -39.66 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-O 118.011 -0.995 . . . . 0.0 109.943 174.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 93.1 m -59.68 -59.18 5.85 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.715 2.406 . . . . 0.0 112.41 171.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -70.91 -33.53 70.63 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -173.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.25 -34.52 85.92 Favored Glycine 0 CA--C 1.524 0.649 0 O-C-N 116.68 -3.762 . . . . 0.0 115.116 169.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 75.1 m -76.16 -34.39 59.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -67.52 -27.58 67.1 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 119.478 -2.014 . . . . 0.0 112.135 172.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 22.4 m -76.64 -32.91 58.3 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 126.842 2.057 . . . . 0.0 113.593 176.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.4 mt -65.4 -48.62 72.23 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 116.54 -1.695 . . . . 0.0 112.991 168.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -71.27 -25.98 62.69 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 126.987 2.68 . . . . 0.0 112.874 -178.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . 0.367 . . -84.47 4.62 30.88 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 116.943 -3.598 . . . . 0.0 114.969 170.166 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.53 167.47 29.88 Favored Pre-proline 0 N--CA 1.448 -0.555 0 CA-C-N 119.595 1.089 . . . . 0.0 113.77 166.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -74.21 155.54 46.79 Favored 'Trans proline' 0 N--CA 1.448 -1.191 0 N-CA-C 117.068 1.911 . . . . 0.0 117.068 169.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 m -61.58 -39.55 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 115.918 -1.991 . . . . 0.0 115.15 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 12.3 pm0 -66.78 -25.33 66.42 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 126.27 2.231 . . . . 0.0 110.636 173.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.5 tp -73.51 -39.76 64.57 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.408 -3.308 . . . . 0.0 111.458 174.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 89.5 mtm-85 -68.12 -33.2 74.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 114.029 -2.891 . . . . 0.0 115.163 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -66.05 -30.25 70.75 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 128.371 3.544 . . . . 0.0 105.593 168.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -84.69 -45.74 12.16 Favored 'General case' 0 N--CA 1.45 -0.465 1 O-C-N 115.882 -4.262 . . . . 0.0 105.63 -169.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 22.4 mt -70.8 -35.82 72.7 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 124.96 1.412 . . . . 0.0 114.661 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -61.85 -17.65 57.18 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 170.255 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -102.92 -19.77 14.5 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 177.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 92.6 t -95.02 -38.91 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 CA-C-O 124.115 1.912 . . . . 0.0 112.754 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 6.6 mt -86.74 -68.33 0.75 Allowed 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 117.768 -3.083 . . . . 0.0 111.13 -174.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 79.9 mt -64.01 -33.61 76.14 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 126.888 3.233 . . . . 0.0 113.459 -165.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -55.17 -17.23 3.96 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.11 2.964 . . . . 0.0 114.175 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 3.4 m -71.47 -20.75 62.04 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 170.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.695 2.798 . . . . 0.0 113.266 171.105 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.47 0.539 0 N-CA-C 104.908 -2.256 . . . . 0.0 104.908 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -51.26 134.65 27.46 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 124.783 2.23 . . . . 0.0 114.751 -175.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -109.11 148.72 30.4 Favored 'General case' 0 N--CA 1.445 -0.724 1 N-CA-C 121.97 4.063 . . . . 0.0 121.97 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -165.13 152.53 11.01 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 121.166 1.803 . . . . 0.0 109.062 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 12.6 p -152.71 162.67 25.83 Favored Pre-proline 0 N--CA 1.448 -0.55 0 C-N-CA 128.176 2.59 . . . . 0.0 108.896 164.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -47.73 -25.25 5.55 Favored 'Trans proline' 0 N--CA 1.449 -1.091 1 N-CA-C 124.069 4.603 . . . . 0.0 124.069 -158.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -142.81 160.72 39.79 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.288 178.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 13.6 t -157.32 125.94 5.7 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 127.095 2.158 . . . . 0.0 110.297 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.39 -27.73 59.2 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 119.412 -2.055 . . . . 0.0 112.697 175.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.15 -36.54 83.39 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 -170.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 34.0 mtt -77.82 -31.25 51.56 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 117.534 -3.229 . . . . 0.0 115.539 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.76 95.16 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.811 1.244 . . . . 0.0 112.248 174.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 tp10 -72.54 -29.46 63.59 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 126.648 2.468 . . . . 0.0 111.54 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . 0.301 50.9 tt0 -72.26 -36.01 68.92 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.652 0.739 . . . . 0.0 111.991 164.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -31.53 71.74 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 118.061 -2.9 . . . . 0.0 114.88 177.089 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -64.58 -51.43 62.76 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.417 2.287 . . . . 0.0 112.869 170.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.376 80.8 mm-40 -55.97 -42.53 76.43 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 114.877 -2.487 . . . . 0.0 112.621 170.128 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 68.2 mt-10 -66.74 -52.47 44.0 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 125.777 1.923 . . . . 0.0 112.44 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -55.93 -37.75 69.38 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 170.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.66 -29.64 68.98 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 117.849 -3.032 . . . . 0.0 115.165 167.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 37.5 ttt-85 -71.74 -27.26 62.87 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 127.126 2.766 . . . . 0.0 109.548 170.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -66.62 -54.13 26.71 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.894 -2.379 . . . . 0.0 111.397 171.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 88.7 t -57.7 -39.64 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 123.618 1.675 . . . . 0.0 112.429 -174.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -61.13 -58.5 8.11 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.712 2.005 . . . . 0.0 108.215 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 58.8 tp -50.78 -39.37 52.36 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 129.768 3.227 . . . . 0.0 112.321 175.023 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 26' ' ' LEU . . . . . 0.476 HD11 HD21 ' C' ' 39' ' ' LEU . 46.6 tp -68.03 -50.04 57.77 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.726 2.41 . . . . 0.0 105.602 179.009 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -70.95 -29.39 65.4 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 120.23 -1.544 . . . . 0.0 114.868 -175.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -63.49 -32.09 73.44 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.848 -1.549 . . . . 0.0 113.85 166.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.99 -23.35 60.63 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.78 1.632 . . . . 0.0 112.852 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -69.88 -11.21 60.7 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 116.699 -3.75 . . . . 0.0 117.205 171.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -87.54 -25.61 23.56 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 128.955 2.902 . . . . 0.0 111.812 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -124.74 17.71 8.71 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 124.144 3.156 . . . . 0.0 111.44 -178.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 61.23 31.18 19.5 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 116.135 -1.888 . . . . 0.0 114.629 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 mt -103.36 13.99 32.48 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 175.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -78.39 -26.82 46.64 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 -170.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.4 83.8 mt -69.42 -48.11 25.63 Favored Pre-proline 0 N--CA 1.448 -0.553 0 O-C-N 126.691 2.494 . . . . 0.0 114.772 168.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -55.51 -38.96 93.55 Favored 'Trans proline' 0 N--CA 1.447 -1.261 1 C-N-CA 127.576 5.518 . . . . 0.0 111.995 171.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 40.2 tp -77.35 -37.64 51.92 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 119.524 -1.985 . . . . 0.0 112.323 -176.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 39' ' ' LEU . . . . . 0.476 HD21 HD11 ' C' ' 26' ' ' LEU . 34.2 mt -74.42 -31.29 62.26 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 122.19 2.268 . . . . 0.0 107.344 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -70.16 -35.6 74.13 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 167.331 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 30.5 tp -63.52 -43.72 96.34 Favored 'General case' 0 N--CA 1.448 -0.543 1 O-C-N 115.969 -4.207 . . . . 0.0 111.136 170.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 12.9 mmt -74.01 -49.93 22.12 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.931 2.892 . . . . 0.0 116.374 -174.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.7 mp -106.5 130.0 54.36 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 129.948 3.299 . . . . 0.0 112.276 -176.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 71.0 p -56.35 153.45 19.65 Favored Pre-proline 0 N--CA 1.448 -0.555 0 O-C-N 127.241 2.838 . . . . 0.0 117.867 157.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . 0.271 13.5 Cg_exo -49.92 -39.96 49.18 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 C-N-CA 115.803 -2.331 . . . . 0.0 115.418 171.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.95 -31.6 71.15 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.706 1.602 . . . . 0.0 114.979 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -77.42 -30.94 53.73 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 113.666 -3.064 . . . . 0.0 111.429 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 46.4 mtm-85 -81.33 -27.68 34.85 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 126.478 2.361 . . . . 0.0 111.859 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -68.63 -43.38 76.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 119.261 -2.15 . . . . 0.0 113.199 163.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.29 86.5 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 116.845 -1.55 . . . . 0.0 112.5 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 19.4 mt -78.37 -25.66 46.36 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 117.876 2.547 . . . . 0.0 117.876 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.18 -35.72 70.74 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 119.07 -1.538 . . . . 0.0 114.157 169.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 7.0 m -54.55 -49.09 71.15 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 118.528 -2.748 . . . . 0.0 114.966 163.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -58.14 -24.14 57.76 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 126.014 2.071 . . . . 0.0 113.322 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 40.6 t -71.72 -37.27 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 115.541 -2.171 . . . . 0.0 110.003 170.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -73.29 -16.38 61.38 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 122.49 2.404 . . . . 0.0 113.429 174.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 11.6 mt -73.62 -35.27 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 121.271 -0.893 . . . . 0.0 111.354 170.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 47.6 t -70.78 -43.86 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 O-C-N 120.728 -1.233 . . . . 0.0 109.865 170.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.05 -42.22 98.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 117.671 -3.143 . . . . 0.0 115.852 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -68.71 -25.65 64.87 Favored 'General case' 0 N--CA 1.449 -0.508 1 O-C-N 115.741 -4.349 . . . . 0.0 113.822 174.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 86.7 mt -87.91 8.95 23.83 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 116.843 -3.661 . . . . 0.0 112.525 172.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 62.5 mt -112.99 -20.25 11.61 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 120.152 1.342 . . . . 0.0 111.935 162.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 39.0 ttm105 -78.15 -38.08 44.46 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 127.836 2.455 . . . . 0.0 112.978 171.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.58 25.71 67.52 Favored Glycine 0 CA--C 1.524 0.653 0 CA-C-O 126.22 3.122 . . . . 0.0 115.449 161.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -92.83 -33.9 14.07 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 112.306 -1.947 . . . . 0.0 113.989 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 53.9 mtt -62.87 142.74 58.14 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 127.356 2.91 . . . . 0.0 112.007 178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 61.0 p -71.54 159.31 34.69 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.91 1.284 . . . . 0.0 113.15 160.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -59.8 -28.47 67.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 166.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . 0.254 23.6 ttp-105 -53.13 -49.18 67.08 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 127.772 2.429 . . . . 0.0 113.366 162.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -68.39 -59.38 3.22 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.108 1.763 . . . . 0.0 111.13 170.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mt -44.23 -38.85 4.04 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.991 -2.943 . . . . 0.0 116.481 176.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -53.15 -43.45 67.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 126.761 2.024 . . . . 0.0 115.374 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -112.21 -41.98 3.82 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 120.637 1.562 . . . . 0.0 112.479 -171.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -90.54 -33.1 16.05 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 120.176 -1.578 . . . . 0.0 109.157 -166.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 6.2 tp -84.24 -21.88 31.0 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 119.447 -2.033 . . . . 0.0 114.778 168.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.95 -174.77 28.8 Favored Glycine 0 C--N 1.335 0.508 0 N-CA-C 121.393 3.317 . . . . 0.0 121.393 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.21 68.26 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 111.895 -2.153 . . . . 0.0 115.87 -168.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.58 -13.17 2.77 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 121.191 3.236 . . . . 0.0 121.191 169.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 9.3 tt -60.22 -20.57 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.82 -27.78 58.04 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 120.532 -1.355 . . . . 0.0 111.356 -179.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 81' ' ' THR . . . . . 0.64 HG23 HG23 ' D' ' 44' ' ' THR . 93.2 m -64.83 -29.88 70.86 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 127.103 2.161 . . . . 0.0 110.2 172.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 7.5 mm -96.38 -31.17 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 115.835 -2.031 . . . . 0.0 110.98 -174.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 29.7 p -117.57 -0.86 11.78 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 125.425 1.703 . . . . 0.0 113.597 -163.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -124.06 148.94 46.68 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 120.998 -1.064 . . . . 0.0 113.007 172.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 98.79 169.74 31.18 Favored Glycine 0 C--N 1.338 0.639 0 CA-C-O 123.713 1.73 . . . . 0.0 112.19 -171.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 92.7 p -66.63 -34.52 78.06 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -177.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -89.34 10.69 21.48 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 115.195 -2.336 . . . . 0.0 112.022 -176.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 60.4 p -79.3 169.8 17.57 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 126.443 2.339 . . . . 0.0 114.542 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 21.0 tp -51.25 -42.76 61.25 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 116.822 -3.673 . . . . 0.0 113.922 -165.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -97.18 24.17 6.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 124.016 3.098 . . . . 0.0 111.791 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -141.43 -19.99 0.77 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 115.648 -2.12 . . . . 0.0 112.304 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.04 150.87 1.26 Allowed Pre-proline 0 N--CA 1.449 -0.495 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 164.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.54 156.1 62.71 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 CA-C-N 121.886 1.709 . . . . 0.0 113.475 -174.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 70.6 t -77.22 -27.5 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-O 112.757 -3.496 . . . . 0.0 108.338 -161.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -68.79 -29.32 67.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 124.849 3.477 . . . . 0.0 113.509 173.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 18.3 tp -78.75 -45.7 20.53 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 120.472 1.487 . . . . 0.0 108.547 176.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -50.38 -39.31 46.43 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 170.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -74.24 -35.88 63.87 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.235 -1.364 . . . . 0.0 108.347 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 36.2 t90 -81.55 -22.3 37.93 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 118.334 2.716 . . . . 0.0 118.334 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.15 -32.26 70.16 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.971 -0.456 . . . . 0.0 111.709 171.014 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.98 -35.18 80.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 115.0 1.482 . . . . 0.0 115.0 171.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -83.3 -29.29 28.47 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 118.512 -2.617 . . . . 0.0 115.258 -173.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 t -85.46 -41.24 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 171.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 7.0 mt -88.38 -5.02 58.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 121.771 3.989 . . . . 0.0 121.771 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . 0.286 99.3 mt -129.56 50.6 2.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 125.972 2.045 . . . . 0.0 112.11 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 16.8 pttt . . . . . 0 N--CA 1.448 -0.559 0 O-C-N 117.925 -2.984 . . . . 0.0 113.07 -166.887 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 3.4 p . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 118.235 -0.888 . . . . 0.0 108.991 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.64 -52.3 2.51 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-N 123.763 2.38 . . . . 0.0 110.808 177.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -141.73 128.87 20.91 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 128.905 2.882 . . . . 0.0 113.295 167.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.6 t -61.21 137.41 58.24 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 118.682 2.845 . . . . 0.0 118.682 -175.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.61 -35.49 72.54 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 131.047 3.739 . . . . 0.0 110.272 170.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.56 -14.23 59.71 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.494 -2.629 . . . . 0.0 112.21 175.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 11.3 mmt -87.14 -31.85 20.18 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.588 1.995 . . . . 0.0 115.381 168.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . 0.303 . . -62.88 -33.69 75.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.369 -2.253 . . . . 0.0 116.324 167.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -61.54 -38.26 86.78 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 128.382 3.551 . . . . 0.0 113.935 168.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -81.56 -35.47 30.2 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 114.179 -2.82 . . . . 0.0 109.534 -169.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 15' ' ' ARG . . . . . 0.45 HH11 ' HD3' ' D' ' 15' ' ' ARG . 0.0 OUTLIER -63.62 -21.5 66.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 117.392 2.367 . . . . 0.0 117.392 174.2 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -84.57 -37.16 21.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.995 2.118 . . . . 0.0 113.312 173.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -76.86 -37.23 55.96 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 125.08 1.487 . . . . 0.0 111.579 176.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -63.85 -18.99 64.71 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 116.072 -2.251 . . . . 0.0 112.422 166.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 -79.89 -47.61 14.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.835 1.254 . . . . 0.0 110.986 175.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 63.2 mt -52.52 -32.84 42.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.2 -2.333 . . . . 0.0 113.972 170.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 41.5 ttt180 -76.73 -19.49 57.6 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 114.867 -2.492 . . . . 0.0 110.265 173.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -75.56 -41.94 53.56 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 123.91 3.05 . . . . 0.0 114.836 155.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 77.8 t -60.19 -38.24 76.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 121.557 1.98 . . . . 0.0 111.826 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -74.44 -32.12 62.52 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 120.778 3.621 . . . . 0.0 120.778 168.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 21.4 tp -63.1 -44.08 96.69 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 165.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 26' ' ' LEU . . . . . 0.419 HD11 ' CE1' ' D' ' 30' ' ' TYR . 26.2 tp -67.71 -43.16 80.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 120.462 1.483 . . . . 0.0 109.377 178.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 27' ' ' LYS . . . . . 0.472 ' HE2' ' HB3' ' D' ' 27' ' ' LYS . 35.9 ttpt -57.34 -41.43 79.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 118.479 -2.638 . . . . 0.0 115.397 175.652 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -69.7 -32.49 71.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 116.674 -1.631 . . . . 0.0 110.243 171.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.263 . . -68.7 -20.93 64.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 121.419 1.918 . . . . 0.0 115.239 168.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 30' ' ' TYR . . . . . 0.419 ' CE1' HD11 ' D' ' 26' ' ' LEU . 15.2 m-85 -66.42 -45.61 79.32 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 123.236 2.744 . . . . 0.0 108.686 170.457 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -67.33 -5.79 15.88 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.628 -1.92 . . . . 0.0 114.644 -166.072 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 39.4 p-10 -137.25 16.08 2.99 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 125.428 1.705 . . . . 0.0 112.442 165.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 60.92 33.91 19.7 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 115.927 1.825 . . . . 0.0 115.927 172.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 48.1 mt -93.18 3.1 56.25 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 111.169 -2.741 . . . . 0.0 115.984 161.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.28 -60.68 2.99 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 130.753 3.621 . . . . 0.0 113.741 -178.612 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.13 -47.89 89.35 Favored Pre-proline 0 N--CA 1.451 -0.421 0 O-C-N 117.376 -3.327 . . . . 0.0 113.866 -174.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -64.01 -18.61 64.34 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 CA-C-N 123.035 2.119 . . . . 0.0 111.0 174.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . 0.315 38.1 tp -64.64 -70.81 0.21 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 123.353 2.797 . . . . 0.0 110.148 167.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 39' ' ' LEU . . . . . 0.427 ' H ' ' HG ' ' D' ' 39' ' ' LEU . 3.9 mt -36.09 -53.32 0.79 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 116.469 -1.729 . . . . 0.0 115.289 170.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . 0.291 26.8 m-20 -74.89 -22.27 58.74 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 116.998 -1.881 . . . . 0.0 111.194 -176.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 35.9 tp -65.65 -38.5 89.54 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 121.723 2.056 . . . . 0.0 112.84 166.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 72.1 mmm -89.85 -32.74 16.76 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 126.191 2.182 . . . . 0.0 114.223 -165.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 73.4 mt -105.61 122.3 45.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 118.041 -2.912 . . . . 0.0 112.888 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 44' ' ' THR . . . . . 0.64 HG23 HG23 ' C' ' 81' ' ' THR 0.323 73.1 p -57.23 151.82 34.35 Favored Pre-proline 0 N--CA 1.45 -0.47 0 N-CA-C 119.223 3.046 . . . . 0.0 119.223 160.206 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -42.26 -53.3 3.7 Favored 'Trans proline' 0 N--CA 1.448 -1.201 0 C-N-CA 124.816 3.677 . . . . 0.0 116.864 -175.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.299 0.9 OUTLIER -84.22 -3.93 58.5 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 115.762 -2.066 . . . . 0.0 112.045 -169.704 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -75.41 -44.1 46.44 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 125.863 1.665 . . . . 0.0 109.199 162.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 36.9 mtm-85 -67.61 -33.58 75.27 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 115.318 -2.277 . . . . 0.0 111.781 171.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -67.59 -44.83 77.19 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 175.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.25 . . -56.31 -48.07 77.44 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 121.446 1.93 . . . . 0.0 113.289 176.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 mt -65.78 -39.38 90.94 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.877 -1.765 . . . . 0.0 114.429 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.33 -36.74 53.78 Favored Glycine 0 N--CA 1.448 -0.504 0 O-C-N 119.526 -1.984 . . . . 0.0 113.601 167.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 29.5 m -94.73 -31.83 13.61 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 120.203 -1.763 . . . . 0.0 109.438 -171.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -52.37 -33.84 45.09 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 119.273 3.064 . . . . 0.0 119.273 170.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.46 -39.47 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 N-CA-C 115.932 1.827 . . . . 0.0 115.932 173.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -80.25 -25.08 39.69 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 174.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 78.8 mt -56.22 -50.21 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 O-C-N 120.631 -1.293 . . . . 0.0 112.34 158.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 41.9 t -64.47 -50.54 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 O-C-N 125.338 1.649 . . . . 0.0 114.349 176.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -51.67 -42.28 62.01 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 125.165 2.412 . . . . 0.0 109.823 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -72.78 -19.3 61.38 Favored 'General case' 0 N--CA 1.451 -0.409 1 O-C-N 115.051 -4.78 . . . . 0.0 117.193 178.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 62.8 mt -79.49 -18.93 50.92 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 126.449 2.343 . . . . 0.0 115.425 166.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 10.4 mt -94.83 -25.99 16.39 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.956 2.102 . . . . 0.0 108.548 175.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 31.4 ttm105 -77.23 -38.47 51.17 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 122.627 2.467 . . . . 0.0 110.822 163.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.37 17.63 74.51 Favored Glycine 0 C--N 1.339 0.696 0 CA-C-N 123.441 2.837 . . . . 0.0 116.869 169.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -92.93 -40.49 10.55 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 119.034 1.417 . . . . 0.0 110.841 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 49.5 mtm -75.15 44.51 0.25 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.094 2.558 . . . . 0.0 108.154 173.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 85.5 p -87.24 175.45 8.03 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 119.673 3.212 . . . . 0.0 119.673 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 63.92 -33.33 0.13 Allowed 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 129.918 3.287 . . . . 0.0 112.797 174.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -146.75 -46.13 0.18 Allowed 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 129.119 2.968 . . . . 0.0 108.771 -176.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -75.39 -40.79 57.56 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 117.738 -3.101 . . . . 0.0 118.537 -149.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 tt -62.83 -43.0 99.96 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.81 0.844 . . . . 0.0 109.575 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -54.0 -22.51 10.68 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.133 0.973 . . . . 0.0 112.434 175.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -110.78 -37.56 5.39 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 116.942 2.201 . . . . 0.0 116.942 174.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -64.6 -51.12 64.37 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.435 3.094 . . . . 0.0 115.79 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.37 1.3 mm? -99.23 -22.75 15.48 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.563 1.545 . . . . 0.0 109.884 170.465 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 77.57 -149.7 35.49 Favored Glycine 0 CA--C 1.523 0.593 1 N-CA-C 123.949 4.34 . . . . 0.0 123.949 166.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -45.51 -24.1 0.29 Allowed 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 128.031 2.842 . . . . 0.0 118.154 -164.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.05 -20.43 79.97 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-O 125.72 2.845 . . . . 0.0 118.984 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . 0.308 2.1 tt -44.31 -39.13 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 111.846 -2.177 . . . . 0.0 114.739 176.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.79 -17.43 44.15 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 129.548 3.139 . . . . 0.0 110.414 -175.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 1.7 m -74.73 -39.61 61.76 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 125.473 2.558 . . . . 0.0 112.598 164.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 15.2 mm -73.62 -19.87 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 120.991 3.7 . . . . 0.0 120.991 173.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 72.5 p -111.54 -40.98 4.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 117.565 -3.209 . . . . 0.0 105.826 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.279 35.0 mtp85 -70.79 169.53 14.39 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 122.765 2.53 . . . . 0.0 114.28 171.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 100.73 133.37 8.11 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 104.763 -3.335 . . . . 0.0 104.763 -174.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -49.68 -24.79 2.44 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -145.11 42.89 1.31 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 127.688 2.395 . . . . 0.0 112.847 -169.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 60.2 p -75.95 -177.93 4.1 Favored 'General case' 0 N--CA 1.45 -0.464 1 O-C-N 129.252 4.095 . . . . 0.0 107.918 174.029 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.285 3.0 tt -52.98 -31.67 42.05 Favored 'General case' 0 N--CA 1.45 -0.44 1 N-CA-C 122.356 4.206 . . . . 0.0 122.356 160.152 . . . . . . . . 3 2 . 1 . 002 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -72.09 -24.59 61.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.418 1.887 . . . . 0.0 112.214 172.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.69 -19.57 16.0 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.614 -1.66 . . . . 0.0 114.728 -175.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 41.5 84.5 0.18 Allowed Pre-proline 0 N--CA 1.449 -0.489 0 C-N-CA 128.736 2.814 . . . . 0.0 113.581 163.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 93' ' ' PRO . . . . . 0.473 ' C ' ' H ' ' D' ' 95' ' ' GLU . 50.2 Cg_exo 22.82 54.07 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 O-C-N 115.231 -3.089 . . . . 0.0 112.933 58.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 4.7 t -74.03 31.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 CA-C-O 122.612 1.196 . . . . 0.0 110.325 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 95' ' ' GLU . . . . . 0.473 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -137.18 -37.42 0.64 Allowed 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 116.199 -1.858 . . . . 0.0 114.788 174.597 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . 0.259 26.4 tp -55.68 -46.46 77.57 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.588 -1.672 . . . . 0.0 109.204 163.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 26.2 ptt180 -65.38 -35.04 79.76 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 117.0 -1.88 . . . . 0.0 114.217 -176.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -71.08 -35.54 71.89 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 115.038 1.495 . . . . 0.0 115.038 -172.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 29.9 t90 -63.65 -46.91 83.48 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 160.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 21.2 mt -63.22 -38.79 92.57 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 122.776 1.274 . . . . 0.0 113.234 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -47.38 -42.71 22.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 117.797 2.517 . . . . 0.0 117.797 163.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -95.15 -20.59 19.13 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 118.349 -2.719 . . . . 0.0 108.352 -166.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 89.8 t -85.61 -32.79 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 128.532 2.733 . . . . 0.0 114.185 165.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 64.9 mt -102.26 -6.09 23.54 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -171.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 51.9 mt -120.54 21.33 11.62 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 119.992 -1.692 . . . . 0.0 108.465 170.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 14.1 pttp -59.59 159.89 7.86 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 116.648 2.092 . . . . 0.0 116.648 -173.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.8 m -71.46 5.64 2.23 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 119.881 3.289 . . . . 0.0 119.881 -172.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 C--O 1.248 0.992 0 C-N-CA 127.167 2.187 . . . . 0.0 112.68 150.33 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.5 ttp . . . . . 0 N--CA 1.445 -0.691 0 CA-C-O 125.254 2.454 . . . . 0.0 114.685 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.78 -26.43 67.25 Favored 'General case' 0 N--CA 1.452 -0.346 1 O-C-N 114.173 -5.329 . . . . 0.0 111.616 166.383 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -88.19 -27.21 21.97 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 127.077 2.151 . . . . 0.0 114.485 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -85.15 -44.01 13.33 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 103.447 -2.797 . . . . 0.0 103.447 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.414 ' HD3' ' HA ' ' A' ' 15' ' ' ARG . 9.8 mmt180 -67.18 -45.63 76.38 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 104.054 -2.573 . . . . 0.0 104.054 -175.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -59.09 -46.29 88.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 117.737 -1.585 . . . . 0.0 114.349 175.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.11 -24.18 67.36 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 120.318 -1.488 . . . . 0.0 108.42 178.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.54 -28.83 61.13 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.969 -2.957 . . . . 0.0 109.569 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -94.52 -33.8 12.93 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 125.53 2.586 . . . . 0.0 112.583 -172.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.7 mt -60.75 -15.06 25.43 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 116.943 -3.598 . . . . 0.0 119.699 163.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -68.87 -48.32 63.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 130.472 3.509 . . . . 0.0 105.39 173.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -71.93 -37.29 70.04 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.549 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.3 t -65.45 -41.19 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-O 124.453 2.073 . . . . 0.0 112.264 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -69.96 -34.66 73.69 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 119.634 -1.916 . . . . 0.0 110.202 172.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 24.5 tp -73.96 -45.72 48.42 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 117.847 -3.033 . . . . 0.0 109.579 -173.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 tp -59.09 -36.59 75.38 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.432 ' HB2' ' CE1' ' B' ' 30' ' ' TYR . 69.8 tttt -62.62 -46.65 87.29 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 112.434 -2.166 . . . . 0.0 115.47 170.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -57.21 -39.19 74.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 126.205 1.802 . . . . 0.0 106.963 172.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.98 -31.27 56.39 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 114.395 -2.716 . . . . 0.0 108.597 -177.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -58.24 -42.2 85.86 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 173.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -75.68 -15.09 60.35 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 127.536 2.334 . . . . 0.0 110.553 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -131.78 16.69 4.76 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.34 3.4 m-20 73.3 1.75 4.1 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 168.007 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.2 mt -75.29 6.0 4.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.529 1.157 . . . . 0.0 113.562 168.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . 0.341 17.2 p-80 -67.47 -62.39 1.44 Allowed 'General case' 0 N--CA 1.451 -0.416 1 O-C-N 113.847 -5.533 . . . . 0.0 111.564 -166.436 . . . . . . . . 3 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.262 26.7 mt -49.1 -46.79 76.12 Favored Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-O 114.115 -2.85 . . . . 0.0 117.338 167.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -58.96 -42.88 47.71 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 124.665 3.577 . . . . 0.0 113.089 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 17.7 tp -69.69 -46.83 65.14 Favored 'General case' 0 N--CA 1.452 -0.372 1 O-C-N 115.025 -4.797 . . . . 0.0 110.726 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 74.7 mt -55.16 -42.46 73.15 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 126.416 2.323 . . . . 0.0 115.577 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -77.82 -4.6 47.35 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.084 1.353 . . . . 0.0 113.388 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 23.6 tp -99.36 -29.13 12.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 114.144 -2.836 . . . . 0.0 113.276 169.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 59.8 mmm -107.72 -9.48 15.81 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.076 2.11 . . . . 0.0 116.543 -177.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.5 mp -118.36 152.11 36.46 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 118.839 -2.413 . . . . 0.0 109.339 159.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.8 p -110.46 165.45 12.66 Favored Pre-proline 0 N--CA 1.452 -0.343 0 C-N-CA 124.972 1.309 . . . . 0.0 107.79 -170.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -61.34 -40.68 47.2 Favored 'Trans proline' 0 N--CA 1.446 -1.315 0 C-N-CA 124.307 3.338 . . . . 0.0 117.994 -163.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -22.56 62.56 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 116.632 -1.651 . . . . 0.0 109.969 176.316 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -72.0 -41.86 67.1 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 121.219 1.827 . . . . 0.0 112.517 175.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 20.6 mtm180 -65.23 -49.82 68.2 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 123.946 0.899 . . . . 0.0 110.944 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -55.92 -39.3 71.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 171.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.43 -37.15 84.56 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 117.261 -1.352 . . . . 0.0 110.14 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 30.2 mt -74.88 -27.88 60.42 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 124.664 3.393 . . . . 0.0 110.571 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.41 -44.39 98.09 Favored Glycine 0 CA--C 1.522 0.517 0 O-C-N 119.757 -1.839 . . . . 0.0 113.67 171.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -60.66 -32.13 71.33 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.288 1.435 . . . . 0.0 114.131 171.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.262 93.9 mtt180 -68.67 -34.42 75.66 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.545 -0.74 . . . . 0.0 111.232 -177.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.96 -48.21 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 168.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -55.01 -39.43 69.07 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 112.624 -3.56 . . . . 0.0 114.473 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 52.8 mt -63.43 -49.13 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 123.285 2.766 . . . . 0.0 111.849 167.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.0 -35.33 71.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 O-C-N 117.772 -3.08 . . . . 0.0 108.541 -174.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -60.45 -54.53 44.4 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 118.824 -2.423 . . . . 0.0 108.686 174.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -60.5 -27.6 67.72 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 171.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.5 mt -76.28 -25.31 54.77 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 117.456 -3.277 . . . . 0.0 111.149 176.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.9 mt -92.35 -40.06 11.12 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 127.725 2.41 . . . . 0.0 112.226 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.6 ttm105 -46.73 -56.49 6.11 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 117.044 -3.535 . . . . 0.0 112.454 148.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.67 44.94 61.12 Favored Glycine 0 C--N 1.337 0.611 0 C-N-CA 117.602 -2.237 . . . . 0.0 112.702 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -121.04 -52.08 2.09 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 127.653 2.381 . . . . 0.0 114.762 178.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.0 mtt -67.7 130.81 44.17 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 119.101 -2.249 . . . . 0.0 114.516 175.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.1 p -83.54 178.32 8.05 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 120.459 1.481 . . . . 0.0 110.033 -178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -63.87 -46.45 84.92 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 116.507 -2.077 . . . . 0.0 112.855 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.9 tpt85 -63.01 -10.07 12.46 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 119.792 3.256 . . . . 0.0 119.792 170.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -86.66 -42.89 13.05 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 120.938 1.699 . . . . 0.0 110.668 165.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 19.8 mt -63.83 -26.32 68.57 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.963 -1.71 . . . . 0.0 111.259 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -63.45 -21.81 66.52 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.356 1.062 . . . . 0.0 111.427 -176.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -102.08 -53.03 3.02 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 129.36 3.064 . . . . 0.0 111.125 166.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -74.59 -27.06 60.32 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 124.011 3.096 . . . . 0.0 115.523 -168.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.4 mt -121.83 -5.23 9.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 118.707 2.854 . . . . 0.0 118.707 170.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 82.35 5.15 89.83 Favored Glycine 0 CA--C 1.523 0.555 0 CA-C-O 116.137 -2.48 . . . . 0.0 115.027 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.67 138.78 43.08 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 117.438 2.384 . . . . 0.0 117.438 -170.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.73 171.53 55.13 Favored Glycine 0 C--N 1.34 0.779 0 CA-C-O 124.552 2.196 . . . . 0.0 116.159 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.8 mt -54.31 -59.29 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 1 O-C-N 115.096 -4.767 . . . . 0.0 112.656 173.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.11 -34.96 75.79 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.99 1.716 . . . . 0.0 113.842 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.15 -36.2 66.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 124.121 0.968 . . . . 0.0 110.538 177.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.39 49.7 mm -69.33 -45.15 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 O-C-N 118.465 -2.647 . . . . 0.0 114.338 164.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.1 m -65.36 -52.35 54.26 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.629 -177.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -74.55 -32.86 62.57 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 121.201 1.818 . . . . 0.0 110.462 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.12 -34.97 90.75 Favored Glycine 0 C--N 1.338 0.668 0 O-C-N 120.142 -1.599 . . . . 0.0 111.566 169.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.0 m -68.67 -45.0 72.87 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.126 -2.985 . . . . 0.0 111.036 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -57.94 -40.87 81.57 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 172.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 75.8 m -72.16 -25.94 61.89 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 113.656 -1.611 . . . . 0.0 113.848 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.6 tp -71.0 -33.09 70.06 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 166.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -69.04 -32.51 72.07 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 113.491 -3.147 . . . . 0.0 112.193 169.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.91 -5.68 40.09 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 128.109 3.381 . . . . 0.0 114.892 170.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.4 143.0 87.33 Favored Pre-proline 0 N--CA 1.448 -0.538 1 O-C-N 115.679 -4.388 . . . . 0.0 108.692 172.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -73.2 149.15 45.31 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 123.574 2.849 . . . . 0.0 110.202 175.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.2 m -65.98 -32.47 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 116.873 -3.642 . . . . 0.0 107.953 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.265 18.2 pm0 -65.07 -26.24 68.15 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 119.92 1.236 . . . . 0.0 111.192 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 48.2 tp -80.99 -41.9 22.02 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 116.757 -1.592 . . . . 0.0 110.853 177.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -68.59 -38.09 80.37 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 121.89 2.132 . . . . 0.0 111.79 176.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -53.79 -37.27 63.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 129.534 3.133 . . . . 0.0 111.815 168.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 34.2 t90 -77.19 -49.69 14.61 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.891 1.276 . . . . 0.0 109.098 176.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 79.1 mt -68.64 -33.42 73.99 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 -174.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.21 -36.18 81.16 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 121.64 2.018 . . . . 0.0 113.855 169.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -74.55 -34.43 62.94 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 118.959 -2.338 . . . . 0.0 114.548 170.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.4 t -70.55 -44.07 77.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 O-C-N 119.589 -1.944 . . . . 0.0 110.184 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . 0.286 12.0 mt -97.34 -27.98 14.24 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -172.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.6 mt -103.82 19.81 19.26 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 117.162 -3.461 . . . . 0.0 114.991 -167.011 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt . . . . . 0 N--CA 1.447 -0.579 0 O-C-N 119.848 -1.783 . . . . 0.0 115.417 -170.309 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.586 0 CA-C-O 115.556 -2.164 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 4.0 mtt -87.61 -43.0 12.3 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 103.95 -2.611 . . . . 0.0 103.95 -176.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.65 -37.36 63.05 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 128.114 2.566 . . . . 0.0 116.183 170.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -66.23 -57.27 7.94 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 130.559 3.544 . . . . 0.0 107.724 -178.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -47.93 -46.14 31.71 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 129.397 3.079 . . . . 0.0 115.394 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -74.7 -43.27 55.99 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 126.407 1.883 . . . . 0.0 109.837 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -62.9 -26.66 68.9 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.179 1.354 . . . . 0.0 114.393 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -73.81 -50.72 19.14 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 116.278 -1.82 . . . . 0.0 110.581 174.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -43.12 -51.84 5.72 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 127.718 3.136 . . . . 0.0 114.26 163.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 -57.09 -49.84 74.64 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.934 1.694 . . . . 0.0 115.028 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 38.7 mt -63.46 -23.34 67.36 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 119.751 -1.843 . . . . 0.0 112.009 -176.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . 0.259 67.5 ttt180 -67.93 -30.19 69.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.788 2.035 . . . . 0.0 112.301 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -79.77 -36.83 36.59 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 115.899 -2.0 . . . . 0.0 111.358 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 20.9 t -59.28 -39.69 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 O-C-N 126.402 2.314 . . . . 0.0 112.914 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -80.1 -35.23 37.17 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 116.464 -1.732 . . . . 0.0 114.872 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 25.8 tp -58.74 -47.43 84.66 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 126.175 2.893 . . . . 0.0 114.63 168.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 28.8 tp -70.53 -32.93 70.58 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 116.863 -3.648 . . . . 0.0 112.526 -177.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . 0.317 59.2 tttt -49.7 -50.59 43.21 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 126.318 2.961 . . . . 0.0 110.854 165.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -81.91 -20.04 39.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 116.958 -3.588 . . . . 0.0 111.51 -174.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.49 -36.32 57.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 172.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' TYR . . . . . 0.432 ' CE1' ' HB2' ' A' ' 27' ' ' LYS . 6.3 m-85 -50.53 -39.73 49.78 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 170.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -90.28 6.28 43.6 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.375 2.361 . . . . 0.0 117.375 178.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -119.67 6.21 11.01 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 119.409 -2.057 . . . . 0.0 107.93 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 57.82 43.5 21.65 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 117.231 -3.418 . . . . 0.0 112.793 -173.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 89.3 mt -125.15 5.51 7.86 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.46 -2.65 . . . . 0.0 111.523 -174.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -62.76 -39.49 94.31 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 119.197 -2.189 . . . . 0.0 113.555 -178.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' B' ' 36' ' ' LEU . 12.3 mt -66.54 -52.42 35.59 Favored Pre-proline 0 N--CA 1.446 -0.662 1 O-C-N 115.21 -4.681 . . . . 0.0 109.143 -173.281 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' B' ' 36' ' ' LEU . 38.9 Cg_endo -70.53 -26.16 24.26 Favored 'Trans proline' 0 N--CA 1.447 -1.215 0 C-N-CA 121.665 1.576 . . . . 0.0 110.833 -177.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 tp -64.76 -44.47 89.93 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.583 1.553 . . . . 0.0 114.864 174.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 83.1 mt -78.84 -32.03 45.97 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.848 2.459 . . . . 0.0 111.456 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -62.33 -28.06 69.48 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 123.567 2.894 . . . . 0.0 109.276 165.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 51.6 tp -89.36 -34.79 16.4 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.643 1.977 . . . . 0.0 113.844 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 16.6 mmt -86.99 -21.47 26.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 115.085 -2.388 . . . . 0.0 112.077 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 44.5 mt -137.81 124.55 21.08 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 128.891 2.876 . . . . 0.0 110.153 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 77.1 p -68.9 166.79 24.23 Favored Pre-proline 0 N--CA 1.451 -0.423 0 C-N-CA 124.769 1.228 . . . . 0.0 112.292 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -40.54 -52.51 3.07 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 124.65 3.567 . . . . 0.0 113.726 167.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -66.7 -24.63 66.28 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 121.719 2.054 . . . . 0.0 114.816 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -83.49 -33.79 25.49 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 127.296 2.239 . . . . 0.0 115.912 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 56.6 mtm-85 -72.71 -40.53 66.11 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 127.442 2.297 . . . . 0.0 108.848 177.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.286 38.8 tt0 -63.57 -37.47 87.45 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 126.579 2.425 . . . . 0.0 115.688 176.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.7 -53.44 58.01 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.987 174.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.0 mt -59.14 -37.48 77.37 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 121.134 3.753 . . . . 0.0 121.134 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.19 -30.73 74.6 Favored Glycine 0 CA--C 1.523 0.594 0 C-N-CA 126.638 2.066 . . . . 0.0 115.313 166.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 74.1 m -87.29 -45.08 10.92 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 112.191 -3.766 . . . . 0.0 104.221 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -51.01 -45.93 61.35 Favored 'General case' 0 N--CA 1.452 -0.359 1 CA-C-N 126.227 4.103 . . . . 0.0 109.879 176.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.0 t -50.62 -55.07 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 116.627 -1.654 . . . . 0.0 111.773 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -56.18 -35.02 66.77 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 116.116 1.895 . . . . 0.0 116.116 172.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 80.7 mt -67.55 -45.37 85.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 120.545 1.521 . . . . 0.0 113.33 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 43.7 t -83.56 -1.9 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 126.285 1.834 . . . . 0.0 114.608 -172.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . 0.292 57.4 tt0 -92.36 -28.21 17.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.062 -1.829 . . . . 0.0 106.062 171.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -78.57 -20.96 49.4 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 126.467 1.907 . . . . 0.0 115.616 177.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 91.9 mt -63.93 -33.79 76.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 160.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . 0.267 13.2 mt -77.03 -33.27 57.37 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 120.6 3.556 . . . . 0.0 120.6 174.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 37.4 ttm105 -87.42 -58.67 2.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 127.867 3.229 . . . . 0.0 108.5 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.71 39.5 20.93 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 118.98 2.352 . . . . 0.0 118.98 175.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -123.5 -6.09 8.15 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 117.705 -1.141 . . . . 0.0 111.648 -168.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 5.1 mtt -83.37 152.33 25.1 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 30.5 p -83.45 159.56 21.73 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 117.662 -3.149 . . . . 0.0 115.989 157.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -61.97 -31.15 71.48 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 119.86 -1.775 . . . . 0.0 109.119 -173.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -59.29 -39.76 84.03 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 119.275 -2.141 . . . . 0.0 114.497 171.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -72.1 -38.1 69.41 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 119.822 -1.799 . . . . 0.0 108.5 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 46.3 mt -55.98 -48.85 75.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 118.95 -2.344 . . . . 0.0 107.554 176.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -66.39 -40.3 89.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 116.505 -2.078 . . . . 0.0 114.881 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -99.38 -17.86 17.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 125.691 2.663 . . . . 0.0 117.317 -164.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -105.2 -49.62 3.42 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 128.98 2.912 . . . . 0.0 112.236 176.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 60.7 mt -95.85 -4.83 42.98 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 126.452 2.345 . . . . 0.0 113.604 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.84 19.27 60.74 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-O 118.895 -0.947 . . . . 0.0 114.14 -178.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -100.79 118.25 36.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 116.418 2.007 . . . . 0.0 116.418 -165.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.01 167.98 54.36 Favored Glycine 0 CA--C 1.523 0.556 1 CA-C-O 128.364 4.313 . . . . 0.0 110.688 174.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 80.6 mt -52.23 -39.71 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 O-C-N 116.467 -3.961 . . . . 0.0 112.399 171.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . 0.275 . . -78.65 -39.29 37.39 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 116.798 -3.689 . . . . 0.0 115.013 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 9.2 m -56.92 -36.82 70.65 Favored 'General case' 0 N--CA 1.454 -0.272 1 O-C-N 114.22 -5.3 . . . . 0.0 113.171 166.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 14.3 mm -64.1 -53.07 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 170.126 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 24.1 m -55.07 -48.28 73.74 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 121.309 1.868 . . . . 0.0 114.455 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 20.1 ttt180 -63.88 -41.37 97.76 Favored 'General case' 0 N--CA 1.451 -0.408 1 O-C-N 116.239 -4.038 . . . . 0.0 112.524 175.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.68 -46.82 66.04 Favored Glycine 0 C--N 1.334 0.46 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 172.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m -71.6 -29.66 64.93 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 117.008 -1.472 . . . . 0.0 113.953 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -61.27 -58.79 6.82 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 119.79 1.177 . . . . 0.0 111.119 169.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -60.04 -33.24 71.75 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.078 2.151 . . . . 0.0 114.225 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 20.2 mt -58.69 -36.25 73.92 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 113.59 -3.1 . . . . 0.0 114.446 162.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 58.8 mttt -70.33 1.79 4.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 122.6 2.455 . . . . 0.0 112.39 173.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -117.52 -5.79 11.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 127.897 2.479 . . . . 0.0 115.761 174.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.4 131.84 64.15 Favored Pre-proline 0 N--CA 1.448 -0.567 0 C-N-CA 124.225 1.01 . . . . 0.0 109.809 -174.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -61.69 153.27 68.51 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 117.843 -0.971 . . . . 0.0 109.839 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.0 m -55.89 -33.77 35.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 126.52 2.388 . . . . 0.0 114.084 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 -74.49 -27.89 60.76 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 117.508 2.41 . . . . 0.0 117.508 -177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 52.7 tp -66.34 -50.79 62.38 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 117.343 -3.348 . . . . 0.0 111.437 164.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 15.3 mtm180 -61.47 -45.02 96.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 -173.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -53.98 -38.8 65.43 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 118.679 -2.513 . . . . 0.0 115.651 163.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -74.16 -35.44 64.03 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.42 -31.31 72.43 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 175.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -75.54 -18.78 59.68 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 124.488 1.117 . . . . 0.0 113.035 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -84.6 -31.85 24.07 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 131.617 3.967 . . . . 0.0 115.663 170.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 84.8 t -104.68 -52.63 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 116.287 -1.816 . . . . 0.0 111.956 -170.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 79.1 mt -76.41 -50.11 14.98 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 121.446 1.93 . . . . 0.0 108.665 -173.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 45.0 mt -67.91 -30.45 69.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.226 2.204 . . . . 0.0 110.376 -173.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . 0.283 89.1 mttt -70.06 -11.69 61.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 120.038 -1.664 . . . . 0.0 114.281 172.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.3 m -82.31 -9.37 59.5 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 116.554 -3.842 . . . . 0.0 116.506 168.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 . . . . . 0 C--O 1.248 1.013 0 CA-C-N 123.608 2.913 . . . . 0.0 112.428 170.165 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 14.9 ttt . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 124.975 2.321 . . . . 0.0 108.466 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.53 159.44 31.28 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 111.867 -2.424 . . . . 0.0 114.166 -168.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -131.86 148.4 52.54 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -127.09 127.22 44.3 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 128.462 2.705 . . . . 0.0 110.943 169.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 74.5 p -119.95 167.92 11.41 Favored Pre-proline 0 N--CA 1.451 -0.382 0 O-C-N 127.735 3.147 . . . . 0.0 113.45 168.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . 0.269 87.4 Cg_exo -59.52 -31.59 94.84 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.983 3.122 . . . . 0.0 117.18 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . 0.271 68.9 t80 -148.66 141.56 24.74 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 119.346 -2.096 . . . . 0.0 108.539 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 2.7 t -141.37 120.89 13.26 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.443 -1.253 . . . . 0.0 112.328 166.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.82 -5.74 22.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 121.558 3.91 . . . . 0.0 121.558 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.91 -17.02 59.2 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 117.596 2.443 . . . . 0.0 117.596 171.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 33.1 mtt -86.58 -39.31 16.29 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 126.215 1.806 . . . . 0.0 108.015 173.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.07 -28.06 54.5 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 177.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -70.89 -28.93 64.9 Favored 'General case' 0 N--CA 1.449 -0.494 1 O-C-N 116.287 -4.008 . . . . 0.0 109.942 170.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -76.07 -31.66 58.88 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 115.86 -2.019 . . . . 0.0 113.457 171.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -35.34 79.09 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 121.535 1.97 . . . . 0.0 109.576 165.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -66.29 -49.56 66.67 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 125.92 2.012 . . . . 0.0 107.414 -174.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 71.4 mm-40 -63.9 -30.58 71.65 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -67.36 -34.31 77.03 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.199 -2.188 . . . . 0.0 109.207 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 19' ' ' TRP . . . . . 0.507 ' CE2' ' HD2' ' D' ' 48' ' ' ARG . 58.3 t-105 -82.98 -40.27 20.24 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 -175.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 21.8 mt -64.85 -37.14 86.62 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 117.463 -1.695 . . . . 0.0 112.318 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -53.59 -36.78 62.31 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 128.172 2.589 . . . . 0.0 113.627 167.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . 0.274 75.7 t80 -52.24 -59.92 3.82 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 127.239 2.216 . . . . 0.0 106.153 171.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 98.8 t -74.38 -32.48 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 125.162 1.538 . . . . 0.0 110.671 -170.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -68.4 -34.34 75.86 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 116.698 -3.751 . . . . 0.0 112.02 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 25' ' ' LEU . . . . . 0.438 ' CD1' HG11 ' D' ' 103' ' ' VAL . 35.8 tp -77.44 -28.35 52.44 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 119.095 -2.253 . . . . 0.0 109.276 174.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 26' ' ' LEU . . . . . 0.445 HD11 HD21 ' C' ' 39' ' ' LEU . 15.6 tp -70.72 -28.33 64.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 115.652 -2.118 . . . . 0.0 113.848 170.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp -88.11 -28.66 21.15 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 121.901 2.137 . . . . 0.0 110.365 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -60.98 -28.67 69.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.863 1.665 . . . . 0.0 110.952 164.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.44 -7.22 48.68 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 122.98 1.371 . . . . 0.0 111.786 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -99.64 0.75 42.66 Favored 'General case' 0 N--CA 1.451 -0.402 1 O-C-N 115.968 -4.207 . . . . 0.0 110.89 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -70.69 -36.56 73.34 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 124.474 3.306 . . . . 0.0 111.402 175.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 49.8 p-10 -124.1 17.65 9.2 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 120.408 -1.432 . . . . 0.0 108.859 -171.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.292 4.2 m-20 56.31 32.55 20.64 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 116.939 2.2 . . . . 0.0 116.939 -175.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 21.9 mt -89.2 10.04 23.51 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.105 -2.872 . . . . 0.0 107.567 173.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -58.23 -47.03 84.8 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 123.011 2.641 . . . . 0.0 110.96 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.283 62.8 mt -67.55 -44.61 45.16 Favored Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-O 113.227 -3.273 . . . . 0.0 110.466 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -70.27 -20.3 32.6 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 CA-C-N 123.731 2.368 . . . . 0.0 111.629 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 26.5 tp -81.17 -30.02 34.5 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 122.088 2.222 . . . . 0.0 115.215 167.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 39' ' ' LEU . . . . . 0.634 HD13 ' CZ2' ' D' ' 19' ' ' TRP . 75.1 mt -65.34 -27.98 68.97 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 120.452 -1.405 . . . . 0.0 111.795 165.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -92.94 -0.64 57.18 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 126.913 2.085 . . . . 0.0 109.235 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 30.7 tp -100.63 -44.41 5.84 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 127.939 3.733 . . . . 0.0 115.106 167.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . 0.252 9.1 mmt -77.57 -36.47 52.04 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 117.51 -3.244 . . . . 0.0 114.284 -175.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.53 152.6 33.77 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 125.128 1.518 . . . . 0.0 111.787 -173.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 27.8 p -76.46 162.43 70.94 Favored Pre-proline 0 N--CA 1.452 -0.347 0 C-N-CA 127.024 2.129 . . . . 0.0 115.909 163.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -56.9 -37.29 98.62 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 CA-C-N 124.241 2.55 . . . . 0.0 116.72 -176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -79.61 -4.32 51.04 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 127.985 3.303 . . . . 0.0 114.871 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -97.38 -16.58 20.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.006 -1.452 . . . . 0.0 113.39 171.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -84.5 -44.62 13.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 117.613 -1.184 . . . . 0.0 111.02 167.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -57.4 -43.9 84.08 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 104.31 -2.478 . . . . 0.0 104.31 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.05 -40.61 64.96 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 118.62 -2.55 . . . . 0.0 110.887 -169.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 51' ' ' LEU . . . . . 0.442 HD22 ' CZ ' ' D' ' 22' ' ' PHE . 3.3 mt -60.29 -45.63 92.68 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 125.427 2.537 . . . . 0.0 108.988 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.66 -43.26 96.36 Favored Glycine 0 CA--C 1.524 0.652 0 CA-C-O 116.781 -2.122 . . . . 0.0 111.667 173.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 60.6 m -60.37 -42.67 96.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.152 1.976 . . . . 0.0 112.982 173.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.309 96.0 mtt180 -57.61 -24.61 57.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 119.716 -1.865 . . . . 0.0 112.543 -172.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 98.5 t -63.8 -38.84 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 106.322 -1.732 . . . . 0.0 106.322 178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 68.2 mtp180 -83.27 -15.53 49.87 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 123.855 1.788 . . . . 0.0 112.048 -171.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 32.6 mt -74.95 -47.23 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 C-N-CA 126.272 1.829 . . . . 0.0 106.522 169.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 35.1 t -61.16 -48.98 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 122.602 1.192 . . . . 0.0 113.553 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -49.83 -42.54 47.48 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 117.44 2.385 . . . . 0.0 117.44 173.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -69.4 -50.74 43.2 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 115.149 -2.357 . . . . 0.0 109.684 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 mt -66.06 -7.22 16.17 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 123.238 2.744 . . . . 0.0 117.464 177.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 80.1 mt -93.74 -33.25 13.69 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.449 2.3 . . . . 0.0 110.387 167.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 45.5 ttm180 -80.02 -38.7 31.47 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.54 22.23 74.95 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 122.672 3.829 . . . . 0.0 122.672 170.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -83.54 -16.08 46.84 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 116.665 -3.844 . . . . 0.0 115.763 165.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 35.4 mtt -77.96 130.13 36.16 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 117.708 -1.597 . . . . 0.0 113.095 173.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 81.7 p -80.8 168.31 18.94 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 124.065 0.853 . . . . 0.0 111.992 159.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -41.37 -43.63 2.57 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 130.023 3.329 . . . . 0.0 110.52 172.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -52.77 -41.62 64.25 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 118.05 -2.906 . . . . 0.0 112.263 -176.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -90.38 -38.3 13.41 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 131.592 3.957 . . . . 0.0 109.616 -169.099 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 62.8 mt -62.23 -21.49 65.2 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 120.133 -1.604 . . . . 0.0 111.689 174.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 31.7 tttp -80.46 -46.43 15.93 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 118.133 -1.427 . . . . 0.0 113.199 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -86.59 -54.0 4.65 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 119.02 -2.3 . . . . 0.0 112.506 -176.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -71.41 -32.97 69.01 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.327 -1.483 . . . . 0.0 113.67 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 mp -101.22 -3.24 29.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 116.447 2.017 . . . . 0.0 116.447 174.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 72.23 -142.17 32.46 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-O 117.112 -1.938 . . . . 0.0 112.698 159.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -99.48 -7.04 26.56 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 131.446 3.899 . . . . 0.0 114.169 164.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.38 -32.45 52.07 Favored Glycine 0 C--N 1.337 0.595 0 C-N-CA 126.778 2.132 . . . . 0.0 112.567 172.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 13.1 tt -54.29 -40.9 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-O 114.705 -2.569 . . . . 0.0 117.161 175.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.65 -34.28 77.85 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.148 1.53 . . . . 0.0 109.972 -178.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 81' ' ' THR . . . . . 0.464 HG23 ' CG2' ' D' ' 44' ' ' THR . 31.5 m -60.25 -33.13 71.87 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 115.418 -2.229 . . . . 0.0 114.054 168.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 28.1 mm -88.97 -17.41 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 126.825 2.05 . . . . 0.0 111.492 -177.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.2 p -117.48 -19.73 9.35 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -165.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -119.23 151.03 39.1 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 118.494 -2.629 . . . . 0.0 114.609 -175.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.7 170.0 44.17 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 120.879 3.111 . . . . 0.0 120.879 -164.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 67.8 p -84.96 0.85 49.89 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 118.103 -2.998 . . . . 0.0 113.654 -168.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -117.98 5.93 12.13 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.74 2.416 . . . . 0.0 114.325 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 74.6 p -61.14 158.35 14.03 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 119.939 3.311 . . . . 0.0 119.939 175.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 15.7 tp -57.11 -28.18 62.45 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 120.016 -1.677 . . . . 0.0 115.41 -163.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -103.4 16.67 25.93 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -119.68 -7.78 10.02 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 128.181 2.592 . . . . 0.0 112.867 169.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.64 163.32 61.74 Favored Pre-proline 0 N--CA 1.451 -0.379 0 C-N-CA 128.167 2.587 . . . . 0.0 109.587 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -61.63 146.68 96.63 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.504 2.803 . . . . 0.0 110.506 -176.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 12.9 t -67.15 -42.34 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 CA-C-N 113.376 -1.738 . . . . 0.0 113.42 -178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pm0 -56.5 -12.05 1.56 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 160.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . 0.285 14.3 tp -93.36 -41.3 9.92 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.632 -3.168 . . . . 0.0 115.073 164.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -51.68 -34.1 36.87 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 129.243 3.017 . . . . 0.0 113.69 167.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -94.47 -42.13 9.01 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 116.795 -1.574 . . . . 0.0 108.148 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -58.14 -40.49 81.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 116.713 -1.613 . . . . 0.0 113.562 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 82.6 mt -62.61 -38.67 91.09 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 125.707 1.879 . . . . 0.0 110.696 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -71.68 -8.23 52.88 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 172.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -99.25 -5.72 29.35 Favored 'General case' 0 N--CA 1.447 -0.595 2 CA-C-N 127.383 4.628 . . . . 0.0 110.75 175.086 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 90.0 t -125.49 -42.97 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.675 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 8.3 mt -80.6 -15.24 57.11 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.95 -2.344 . . . . 0.0 109.786 -176.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 83.9 mt -136.42 15.76 3.19 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 116.84 2.163 . . . . 0.0 116.84 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 60.2 pttt . . . . . 0 N--CA 1.45 -0.436 0 O-C-N 118.441 -2.662 . . . . 0.0 116.409 172.779 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 79.1 p . . . . . 0 N--CA 1.449 -0.494 0 CA-C-O 113.934 -2.936 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.42 -27.97 46.68 Favored 'Trans proline' 0 N--CA 1.448 -1.148 1 C-N-CA 128.105 5.87 . . . . 0.0 113.973 -176.384 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -142.81 145.13 32.91 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 143.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 31.0 t -70.93 129.26 38.57 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 125.435 2.54 . . . . 0.0 110.829 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.45 -19.34 50.12 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 128.911 2.884 . . . . 0.0 108.485 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . 0.252 . . -67.61 -50.85 56.17 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 128.18 2.592 . . . . 0.0 110.285 167.046 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 17.1 mmt -63.27 -41.64 99.05 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 119.368 -2.082 . . . . 0.0 110.509 168.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.42 -33.62 72.77 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 120.588 1.54 . . . . 0.0 114.427 -176.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -51.89 -65.21 0.6 Allowed 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 119.157 -2.214 . . . . 0.0 114.114 158.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -52.05 -35.5 47.48 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 118.53 2.789 . . . . 0.0 118.53 -174.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -34.67 78.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 120.261 -1.524 . . . . 0.0 113.768 171.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -78.76 -25.01 44.39 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 112.394 -3.67 . . . . 0.0 108.148 165.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -72.0 -33.33 67.99 Favored 'General case' 0 N--CA 1.45 -0.465 1 CA-C-N 126.17 4.077 . . . . 0.0 115.351 177.018 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -70.03 -25.25 63.49 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.095 1.758 . . . . 0.0 112.09 174.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 19' ' ' TRP . . . . . 0.634 ' CZ2' HD13 ' C' ' 39' ' ' LEU . 24.9 t-105 -79.83 -52.34 8.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 127.264 2.852 . . . . 0.0 106.451 177.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 61.5 mt -49.77 -32.97 15.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 116.762 2.134 . . . . 0.0 116.762 167.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -73.07 -31.0 64.1 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.611 1.564 . . . . 0.0 114.011 176.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 22' ' ' PHE . . . . . 0.442 ' CZ ' HD22 ' C' ' 51' ' ' LEU . 69.3 t80 -69.07 -46.43 67.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 126.656 2.472 . . . . 0.0 115.062 165.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 77.5 t -59.07 -36.92 65.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 120.255 1.389 . . . . 0.0 110.787 175.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . 0.326 20.8 t70 -61.26 -62.98 1.45 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 127.081 2.152 . . . . 0.0 111.7 169.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 25' ' ' LEU . . . . . 0.482 HD23 HD21 ' D' ' 38' ' ' LEU . 13.2 tp -47.68 -42.98 26.09 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 115.493 -2.194 . . . . 0.0 110.352 177.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 60.1 tp -71.27 -50.96 27.34 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 127.765 2.426 . . . . 0.0 108.8 -174.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -56.35 -35.21 67.38 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.072 -2.268 . . . . 0.0 114.249 170.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -68.52 -40.46 80.77 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 116.962 -1.895 . . . . 0.0 110.597 173.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.76 -15.32 62.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 127.219 2.208 . . . . 0.0 113.578 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . 0.298 18.3 m-30 -75.26 -26.2 58.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 118.034 -2.916 . . . . 0.0 111.007 161.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -83.91 -23.95 30.97 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 124.288 3.222 . . . . 0.0 114.788 -168.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -103.28 4.74 36.89 Favored 'General case' 0 N--CA 1.451 -0.397 1 N-CA-C 121.863 4.024 . . . . 0.0 121.863 153.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.261 39.9 m-20 68.11 26.56 7.14 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.593 1.957 . . . . 0.0 113.762 170.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 91.1 mt -93.94 5.67 50.92 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.12 2.568 . . . . 0.0 113.294 175.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -52.79 59.83 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.531 2.332 . . . . 0.0 114.063 176.099 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.7 -45.91 66.79 Favored Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-O 115.808 -2.044 . . . . 0.0 108.758 -168.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.251 26.5 Cg_endo -64.4 -28.57 62.76 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 CA-C-N 122.428 1.903 . . . . 0.0 113.211 176.076 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 38' ' ' LEU . . . . . 0.482 HD21 HD23 ' D' ' 25' ' ' LEU . 44.4 tp -68.2 -50.17 55.96 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 -179.366 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 95.4 mt -58.28 -38.37 76.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.542 1.537 . . . . 0.0 114.128 166.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . 0.395 6.1 m-20 -68.01 -29.64 68.7 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 117.503 -1.237 . . . . 0.0 111.04 177.214 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 17.1 tp -75.29 -35.41 61.31 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 123.247 1.499 . . . . 0.0 113.439 172.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 7.4 mmm -87.24 -19.97 27.57 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 116.154 -2.218 . . . . 0.0 114.359 -176.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 93.8 mt -125.78 126.4 44.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.534 -2.604 . . . . 0.0 107.968 -172.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 44' ' ' THR . . . . . 0.464 ' CG2' HG23 ' C' ' 81' ' ' THR . 61.8 p -62.67 157.97 54.34 Favored Pre-proline 0 N--CA 1.449 -0.524 0 CA-C-O 114.152 -2.832 . . . . 0.0 117.646 174.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -59.69 -37.42 87.67 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 CA-C-N 125.429 2.975 . . . . 0.0 117.221 -173.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -63.68 -31.81 73.1 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 120.44 -1.413 . . . . 0.0 113.327 169.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -73.15 -30.13 63.37 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 120.351 -1.468 . . . . 0.0 110.958 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 48' ' ' ARG . . . . . 0.507 ' HD2' ' CE2' ' C' ' 19' ' ' TRP . 77.9 mtm-85 -76.59 -41.17 47.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.933 2.093 . . . . 0.0 111.898 176.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -54.96 -60.44 3.37 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 125.379 1.472 . . . . 0.0 111.933 166.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.15 -43.23 66.85 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 73.3 mt -64.58 -53.92 40.22 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 126.163 2.165 . . . . 0.0 114.08 173.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -37.89 -36.93 0.36 Allowed Glycine 0 C--N 1.336 0.534 0 CA-C-N 120.224 1.374 . . . . 0.0 116.315 159.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 87.3 m -77.84 -35.94 50.55 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.017 2.127 . . . . 0.0 110.633 -176.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 54' ' ' ARG . . . . . 0.43 ' HB3' HD11 ' D' ' 82' ' ' ILE . 22.7 mtt180 -71.87 -20.94 61.73 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 114.199 -2.81 . . . . 0.0 110.445 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 85.8 t -55.79 -46.63 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 116.285 1.957 . . . . 0.0 116.285 166.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -84.81 -26.52 27.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 126.689 2.493 . . . . 0.0 110.22 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 15.4 mt -70.31 -36.72 68.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 O-C-N 118.759 -2.463 . . . . 0.0 108.737 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 58' ' ' VAL . . . . . 0.483 ' CG2' HD12 ' D' ' 82' ' ' ILE . 94.9 t -67.93 -32.62 57.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 118.097 2.629 . . . . 0.0 118.097 170.276 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -70.82 -45.22 64.96 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.407 -1.724 . . . . 0.0 111.667 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.18 -32.7 74.38 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.428 1.491 . . . . 0.0 110.045 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 19.7 mt -71.88 -17.09 62.14 Favored 'General case' 0 N--CA 1.447 -0.579 1 O-C-N 115.027 -4.796 . . . . 0.0 114.676 172.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -91.21 -32.11 15.91 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 124.249 1.976 . . . . 0.0 113.025 165.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 63' ' ' ARG . . . . . 0.576 ' HG2' ' HG3' ' D' ' 65' ' ' GLU . 20.6 ttm180 -61.78 -52.79 62.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.733 -1.854 . . . . 0.0 113.029 170.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.63 26.23 69.61 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-O 115.362 -2.91 . . . . 0.0 118.792 174.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 65' ' ' GLU . . . . . 0.576 ' HG3' ' HG2' ' D' ' 63' ' ' ARG . 81.4 mt-10 -99.75 -45.59 5.69 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 100.808 -3.775 . . . . 0.0 100.808 -166.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 5.1 mtm -88.88 56.57 3.78 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 23.7 p -90.36 -171.77 3.21 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 123.428 1.585 . . . . 0.0 113.629 -168.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.376 7.2 tp60 61.25 -82.64 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 121.3 3.815 . . . . 0.0 121.3 170.036 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 25.7 ttt85 -93.84 -31.96 14.14 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 126.247 2.217 . . . . 0.0 112.53 175.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -76.49 -44.22 36.27 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 -165.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.54 -44.42 69.2 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 172.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . 0.285 27.1 mtmt -72.96 -19.2 61.28 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 114.988 -2.434 . . . . 0.0 109.674 -177.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -123.9 -11.31 7.66 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 125.872 1.983 . . . . 0.0 111.812 -168.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 -103.85 -47.6 4.16 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 128.642 2.777 . . . . 0.0 109.816 176.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.21 -45.06 11.0 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 128.316 3.51 . . . . 0.0 105.448 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 76.73 -135.0 16.1 Favored Glycine 0 N--CA 1.444 -0.822 0 O-C-N 117.784 -3.072 . . . . 0.0 118.035 172.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.298 . . -78.28 36.83 0.25 Allowed 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 118.683 2.846 . . . . 0.0 118.683 -154.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.41 -15.64 2.7 Favored Glycine 0 N--CA 1.447 -0.594 1 C-N-CA 130.861 4.077 . . . . 0.0 113.626 168.057 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 3.9 tt -68.21 -15.45 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-O 114.091 -2.862 . . . . 0.0 116.217 -172.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -95.75 -27.32 15.31 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 127.183 2.802 . . . . 0.0 109.853 178.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.3 m -52.46 -39.98 61.74 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 124.289 3.222 . . . . 0.0 111.65 159.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 82' ' ' ILE . . . . . 0.483 HD12 ' CG2' ' D' ' 58' ' ' VAL 0.259 34.2 mm -71.28 -45.03 72.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 C-N-CA 125.447 1.499 . . . . 0.0 112.237 -176.607 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 19.5 p -86.4 -24.02 25.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 115.465 -2.207 . . . . 0.0 114.606 174.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -90.95 168.23 11.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 126.479 3.038 . . . . 0.0 106.099 177.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.11 147.33 18.52 Favored Glycine 0 N--CA 1.447 -0.585 0 CA-C-O 125.102 2.501 . . . . 0.0 107.527 172.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 5.9 m -68.15 -27.99 66.91 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 118.155 -2.968 . . . . 0.0 114.742 -154.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -128.42 33.99 4.61 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 122.786 1.279 . . . . 0.0 110.956 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 90.7 p -73.72 -177.84 2.92 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 118.16 -2.837 . . . . 0.0 111.686 170.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.6 tt -69.89 -23.88 63.32 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 117.364 -3.335 . . . . 0.0 112.725 -164.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -60.56 -17.46 46.29 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 128.802 2.841 . . . . 0.0 111.265 167.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.09 -35.62 10.75 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.062 -1.923 . . . . 0.0 110.311 175.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 56.96 80.54 0.28 Allowed Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 119.909 3.3 . . . . 0.0 119.909 -175.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 93' ' ' PRO . . . . . 0.559 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.413 67.2 Cg_exo 32.66 27.82 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.114 0 O-C-N 123.223 1.118 . . . . 0.0 114.399 46.197 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 47.9 t -51.17 -8.31 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 117.608 2.448 . . . . 0.0 117.608 174.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 95' ' ' GLU . . . . . 0.559 ' OE2' ' HA ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -117.72 -21.85 8.29 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 113.262 -1.79 . . . . 0.0 110.506 -173.195 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 40.3 tp -63.77 -53.79 45.47 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.761 -2.066 . . . . 0.0 109.657 151.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -46.1 -60.86 2.03 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 120.523 3.527 . . . . 0.0 120.523 171.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -60.41 -18.17 48.97 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 127.358 2.263 . . . . 0.0 115.03 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 59.1 t90 -88.3 -42.43 12.24 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 170.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 42.0 mt -51.62 -46.36 63.61 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 170.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -60.88 -35.08 75.71 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.797 2.839 . . . . 0.0 109.96 -170.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.61 9.31 21.69 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 127.194 2.197 . . . . 0.0 116.544 177.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 103' ' ' VAL . . . . . 0.438 HG11 ' CD1' ' C' ' 25' ' ' LEU . 88.6 t -125.24 -35.06 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 112.338 -2.21 . . . . 0.0 111.243 177.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 82.5 mt -97.7 -23.05 16.11 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.264 1.826 . . . . 0.0 114.376 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 60.0 mt -117.23 12.78 14.49 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 125.32 1.638 . . . . 0.0 107.021 -174.099 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -70.33 161.8 29.73 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 120.027 -1.67 . . . . 0.0 110.912 -174.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -62.67 -32.3 73.34 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 126.122 1.769 . . . . 0.0 111.928 -177.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 C--O 1.251 1.152 0 C-N-CA 127.823 2.449 . . . . 0.0 109.938 170.306 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 53.9 ttp . . . . . 0 N--CA 1.448 -0.535 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -38.2 90.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 126.786 2.554 . . . . 0.0 113.754 172.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -59.59 -48.42 81.73 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 115.127 -2.368 . . . . 0.0 109.112 170.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -67.48 -42.4 83.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 126.407 2.317 . . . . 0.0 110.981 -169.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 86.8 mmt-85 -66.01 -25.38 67.05 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 126.54 2.4 . . . . 0.0 114.504 175.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -82.1 -30.04 31.44 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.574 -0.704 . . . . 0.0 110.762 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -73.43 -27.97 61.72 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.813 -3.054 . . . . 0.0 112.039 169.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -63.18 -35.0 78.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 116.556 -3.84 . . . . 0.0 115.334 170.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -62.07 -53.61 53.1 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 128.151 3.834 . . . . 0.0 115.863 168.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.1 mt -67.59 -26.53 66.32 Favored 'General case' 0 N--CA 1.447 -0.609 1 O-C-N 112.933 -6.104 . . . . 0.0 116.977 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.445 HH12 ' CD ' ' B' ' 59' ' ' GLU . 67.0 ttt180 -49.33 -43.26 43.56 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 116.35 -1.786 . . . . 0.0 110.342 162.386 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -75.01 -23.21 58.18 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 114.954 -2.45 . . . . 0.0 115.764 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.3 t -81.65 -14.71 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 119.987 1.267 . . . . 0.0 113.177 171.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -88.88 -45.97 9.29 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 117.863 -3.023 . . . . 0.0 116.258 161.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.3 tp -54.18 -42.19 69.38 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 118.264 -2.772 . . . . 0.0 111.239 170.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.262 29.9 tp -67.12 -38.8 86.22 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.829 1.252 . . . . 0.0 114.092 175.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -67.47 -48.61 66.69 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 116.932 -1.508 . . . . 0.0 109.957 174.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.7 m-20 -59.06 -20.52 54.03 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 119.422 1.01 . . . . 0.0 113.586 174.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.29 -36.95 29.21 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -63.79 -44.58 92.94 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 119.314 -2.116 . . . . 0.0 112.538 168.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.77 -29.51 70.18 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.327 -1.797 . . . . 0.0 112.581 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -95.97 9.41 40.79 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.386 7.8 m-20 54.98 21.94 4.05 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 118.143 2.646 . . . . 0.0 118.143 -168.098 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.8 mt -89.47 9.15 27.53 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.27 -2.769 . . . . 0.0 107.143 172.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -55.63 -51.8 65.97 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.989 2.177 . . . . 0.0 113.587 -171.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.52 -53.36 52.47 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-O 115.84 -2.029 . . . . 0.0 114.221 177.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_exo -35.0 -53.02 0.69 Allowed 'Trans proline' 0 N--CA 1.448 -1.162 0 C-N-CA 122.563 2.175 . . . . 0.0 113.563 162.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.6 tp -74.87 -32.42 61.88 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.575 -3.203 . . . . 0.0 115.573 -171.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -63.43 -44.95 93.09 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 130.335 3.454 . . . . 0.0 114.782 171.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -60.76 -34.92 75.18 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 127.063 2.145 . . . . 0.0 108.995 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.0 tp -74.56 -42.87 58.03 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 120.517 3.525 . . . . 0.0 120.517 170.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 95.9 mmm -78.73 -21.5 47.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 114.745 -2.55 . . . . 0.0 116.857 177.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 mp -132.93 141.13 48.19 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.126 1.77 . . . . 0.0 108.041 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.3 p -80.39 153.76 74.03 Favored Pre-proline 0 N--CA 1.446 -0.628 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -55.68 -17.16 16.83 Favored 'Trans proline' 0 N--CA 1.452 -0.94 1 C-N-CA 125.594 4.196 . . . . 0.0 116.233 -173.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -76.88 -45.18 29.17 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 167.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . 0.279 42.1 mt-10 -74.7 -31.37 61.85 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 123.509 1.623 . . . . 0.0 109.997 -175.145 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -67.12 -54.41 21.64 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 119.361 -2.087 . . . . 0.0 115.374 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -47.75 -44.58 28.2 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.274 1.83 . . . . 0.0 112.738 163.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.81 -38.12 89.93 Favored 'General case' 0 N--CA 1.448 -0.561 1 O-C-N 114.787 -4.946 . . . . 0.0 114.962 174.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -62.77 -37.29 86.05 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 116.402 -1.761 . . . . 0.0 113.366 165.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.51 -36.83 48.27 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 119.999 2.76 . . . . 0.0 119.999 159.271 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.1 m -74.38 -40.62 61.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 120.996 2.398 . . . . 0.0 110.901 173.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.267 97.6 mtt180 -53.16 -36.11 60.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 67.3 t -63.18 -38.94 83.43 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 167.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.6 mtp180 -74.71 -25.74 59.35 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 114.726 -2.559 . . . . 0.0 110.759 175.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.251 63.2 mt -68.84 -51.09 48.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 115.514 -2.184 . . . . 0.0 108.857 167.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 53.9 t -62.38 -31.26 51.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 115.041 -2.409 . . . . 0.0 115.036 177.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -59.34 -55.46 34.44 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 127.454 2.971 . . . . 0.0 108.274 169.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -73.26 -14.86 61.41 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 122.658 2.481 . . . . 0.0 115.85 -178.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.9 mt -84.25 -27.38 27.95 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.318 1.847 . . . . 0.0 113.148 173.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.51 -18.37 41.78 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 117.934 -2.979 . . . . 0.0 118.336 165.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.6 ttm105 -82.22 -53.48 6.03 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 170.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.3 37.29 90.66 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 129.589 3.471 . . . . 0.0 107.727 170.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -86.32 -49.76 7.43 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 120.199 -1.765 . . . . 0.0 109.684 170.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 44.2 mtt -63.58 135.1 56.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 123.65 1.691 . . . . 0.0 109.527 165.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.2 p -99.37 -174.87 2.84 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 110.042 -3.254 . . . . 0.0 111.738 161.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -75.93 -33.49 59.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 117.359 -3.338 . . . . 0.0 109.132 -170.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.0 tpt85 -58.87 -26.97 64.74 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 131.067 3.747 . . . . 0.0 114.021 172.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -87.49 -42.93 12.42 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 120.283 -1.511 . . . . 0.0 111.971 173.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.31 -23.98 67.66 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -174.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.8 tptp -66.2 -40.1 90.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 113.958 -1.474 . . . . 0.0 110.864 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -83.64 -34.48 25.03 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 124.578 2.132 . . . . 0.0 112.456 179.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -85.25 -55.62 3.94 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.355 -2.716 . . . . 0.0 108.099 -170.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.0 mt -112.17 6.05 18.84 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 128.504 2.722 . . . . 0.0 114.343 -165.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.82 10.95 73.15 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-O 115.624 -2.765 . . . . 0.0 110.417 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.32 119.63 27.78 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 122.116 2.958 . . . . 0.0 118.312 -174.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.91 162.23 9.55 Favored Glycine 0 C--N 1.342 0.892 0 O-C-N 126.658 2.474 . . . . 0.0 118.396 159.047 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 52.1 mt -59.34 -45.84 92.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 131.535 3.934 . . . . 0.0 111.791 -172.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.33 -39.2 63.0 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -178.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.6 p -63.77 -41.35 97.99 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 114.785 -2.531 . . . . 0.0 117.364 169.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 31.0 mm -62.05 -37.34 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 125.931 3.968 . . . . 0.0 112.795 163.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . 0.369 54.3 m -64.67 -49.62 70.26 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.189 -2.194 . . . . 0.0 113.386 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -62.58 -53.47 54.23 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.248 -2.158 . . . . 0.0 107.653 173.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -41.75 -38.57 2.36 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 126.368 1.937 . . . . 0.0 115.609 175.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.4 m -77.03 -36.12 56.42 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 117.863 0.832 . . . . 0.0 110.274 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -68.44 -35.52 77.72 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 121.597 -0.69 . . . . 0.0 112.718 170.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 7.8 m -62.68 -38.26 89.64 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 173.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . 0.259 35.7 tp -68.28 -31.16 70.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.986 2.114 . . . . 0.0 113.926 174.376 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -84.35 -33.61 23.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 119.75 1.159 . . . . 0.0 112.434 171.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . 0.261 . . -71.48 -18.4 62.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 117.485 2.402 . . . . 0.0 117.485 166.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.56 136.76 92.47 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 158.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.5 153.03 79.29 Favored 'Trans proline' 0 N--CA 1.446 -1.288 0 CA-C-O 126.836 2.765 . . . . 0.0 113.831 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.5 m -61.8 -26.17 39.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-O 115.344 -2.265 . . . . 0.0 111.461 -169.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.266 22.9 pm0 -69.47 -32.45 71.37 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 123.414 2.824 . . . . 0.0 110.108 175.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 4.6 tp -76.13 -38.24 57.06 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 124.288 3.222 . . . . 0.0 113.162 173.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 56.1 mtm-85 -56.7 -37.06 70.39 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.57 1.948 . . . . 0.0 115.126 161.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -72.41 -31.19 65.32 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 121.748 2.067 . . . . 0.0 112.304 170.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -72.59 -50.07 27.92 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 115.586 -2.15 . . . . 0.0 116.24 172.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.27 -21.25 59.84 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 122.326 2.33 . . . . 0.0 110.912 -170.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -77.96 -15.39 59.02 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.691 1.996 . . . . 0.0 112.695 176.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -92.89 -33.27 14.28 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 121.854 2.116 . . . . 0.0 110.542 166.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . 0.411 47.0 t -84.16 -26.06 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-O 115.289 -2.291 . . . . 0.0 116.546 -168.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.7 mt -107.56 -3.99 18.8 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 123.692 1.71 . . . . 0.0 113.537 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 75.4 mt -133.45 8.64 3.95 Favored 'General case' 0 N--CA 1.447 -0.584 1 O-C-N 113.324 -5.86 . . . . 0.0 111.478 -156.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.6 mtpt . . . . . 0 N--CA 1.452 -0.339 0 CA-C-N 122.257 2.298 . . . . 0.0 115.668 178.952 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 122.651 1.215 . . . . 0.0 108.713 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . 0.295 42.6 mtt -65.13 -51.22 62.52 Favored 'General case' 0 N--CA 1.444 -0.751 0 O-C-N 121.523 -0.735 . . . . 0.0 111.226 176.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.59 -40.94 69.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.392 1.077 . . . . 0.0 113.834 177.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -70.74 -32.4 69.56 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 126.912 2.085 . . . . 0.0 110.68 177.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -73.93 -41.18 62.43 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 118.396 -2.69 . . . . 0.0 109.488 178.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -65.55 -42.51 91.78 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 169.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -63.8 -36.7 84.77 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 167.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -63.36 -40.74 98.09 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 117.307 -1.757 . . . . 0.0 113.476 170.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -53.17 -49.2 67.14 Favored 'General case' 0 N--CA 1.452 -0.36 1 O-C-N 115.79 -4.319 . . . . 0.0 111.617 172.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -52.64 -49.08 65.87 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 127.677 2.391 . . . . 0.0 110.631 171.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 79.4 mt -69.42 -30.32 68.23 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 116.175 -4.078 . . . . 0.0 109.677 -178.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -63.07 -26.43 68.83 Favored 'General case' 0 N--CA 1.453 -0.319 1 CA-C-N 126.057 4.026 . . . . 0.0 113.427 171.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -76.09 -46.12 30.56 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.186 1.794 . . . . 0.0 111.958 174.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 18.7 t -64.91 -37.81 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 119.941 -1.725 . . . . 0.0 106.417 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -64.36 -50.24 68.49 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.504 -1.998 . . . . 0.0 108.635 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 39.0 tp -60.67 -39.3 87.91 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 120.073 -1.642 . . . . 0.0 111.627 -174.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 23.8 tp -75.97 -35.94 59.45 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 119.449 -2.032 . . . . 0.0 112.375 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -48.36 -39.72 23.14 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 124.465 2.078 . . . . 0.0 112.988 168.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -89.06 -23.48 22.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 118.93 -2.357 . . . . 0.0 109.987 -176.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.55 -26.61 66.39 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-O 116.092 -1.909 . . . . 0.0 109.213 174.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -76.38 -30.32 57.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 127.15 2.18 . . . . 0.0 112.509 175.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -70.71 -26.25 63.32 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 165.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -105.76 -4.86 20.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 124.678 2.18 . . . . 0.0 110.897 -175.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.278 7.4 m-20 57.21 42.34 25.55 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 116.522 -3.861 . . . . 0.0 111.797 -175.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 22.9 mt -120.31 13.46 11.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.842 2.457 . . . . 0.0 112.619 174.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -65.07 -39.91 93.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 112.78 -3.486 . . . . 0.0 114.375 174.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 11.3 mt -55.04 -48.28 96.43 Favored Pre-proline 0 N--CA 1.452 -0.346 0 CA-C-N 121.899 2.136 . . . . 0.0 112.857 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.302 58.4 Cg_endo -66.77 -40.76 12.08 Favored 'Trans proline' 0 N--CA 1.445 -1.352 0 O-C-N 117.581 -1.852 . . . . 0.0 114.787 172.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 38' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' B' ' 38' ' ' LEU . 24.0 tp -52.66 -40.71 63.12 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 125.581 1.801 . . . . 0.0 109.722 174.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 68.8 mt -80.65 -36.64 32.23 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.133 -2.854 . . . . 0.0 110.335 -171.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -60.88 -42.0 97.1 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 173.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 46.4 tp -67.41 -45.11 77.11 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.866 1.266 . . . . 0.0 111.095 -175.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 14.9 mmt -75.1 -34.4 61.72 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.778 2.031 . . . . 0.0 115.415 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 33.7 mt -128.1 122.69 32.67 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 125.235 1.414 . . . . 0.0 109.218 -170.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 35.7 p -75.32 162.6 72.23 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 126.331 1.852 . . . . 0.0 114.978 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . 0.274 9.7 Cg_endo -67.8 -21.28 44.78 Favored 'Trans proline' 0 N--CA 1.446 -1.31 0 CA-C-N 125.136 2.87 . . . . 0.0 116.244 -164.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.61 -37.63 73.88 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.552 1.941 . . . . 0.0 111.543 169.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -72.62 -35.24 67.78 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 173.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 45.9 mtm-85 -66.61 -37.3 84.58 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 116.209 -1.853 . . . . 0.0 112.715 169.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.46 -46.75 87.87 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 126.3 2.25 . . . . 0.0 115.662 165.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.2 -30.11 66.0 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 116.734 -1.603 . . . . 0.0 109.307 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 17.7 mt -75.42 -28.43 59.4 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 121.238 1.836 . . . . 0.0 113.989 174.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.41 -41.47 77.47 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 125.504 1.526 . . . . 0.0 111.971 172.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 27.2 m -76.44 -37.65 56.69 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.011 -0.995 . . . . 0.0 112.119 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -58.92 -31.14 68.39 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 124.874 1.359 . . . . 0.0 108.797 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 91.9 t -59.16 -49.22 84.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 O-C-N 116.895 -3.628 . . . . 0.0 115.279 167.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -56.51 -32.92 65.53 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 116.94 -3.6 . . . . 0.0 109.432 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 62.9 mt -72.04 -44.59 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-O 115.912 -1.994 . . . . 0.0 114.746 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 54.7 t -66.88 -41.69 87.99 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 119.638 1.108 . . . . 0.0 110.439 176.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' GLU . . . . . 0.445 ' CD ' HH12 ' A' ' 21' ' ' ARG . 36.5 tt0 -52.47 -41.07 63.02 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 169.204 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -82.78 -25.19 33.0 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 117.579 2.437 . . . . 0.0 117.579 173.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 61' ' ' LEU . . . . . 0.446 HD23 ' HA ' ' B' ' 61' ' ' LEU . 14.0 mt -48.79 -44.74 39.31 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 120.332 1.424 . . . . 0.0 113.657 154.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 44.3 mt -85.73 -2.61 58.39 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 115.158 -2.353 . . . . 0.0 114.426 -178.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 ttm105 -93.34 -71.7 0.64 Allowed 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 125.634 1.834 . . . . 0.0 114.701 176.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.16 55.75 1.92 Allowed Glycine 0 CA--C 1.525 0.702 0 CA-C-N 114.3 -1.318 . . . . 0.0 113.338 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -137.83 -8.3 1.62 Allowed 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 127.656 2.382 . . . . 0.0 115.441 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 40.4 mtt -89.82 133.37 34.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 167.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -62.27 160.41 13.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 127.883 2.473 . . . . 0.0 116.287 156.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -50.52 -43.29 55.87 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.576 -1.202 . . . . 0.0 111.237 172.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -58.88 -45.4 90.31 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 126.885 2.616 . . . . 0.0 114.281 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -67.12 -46.22 74.79 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.092 2.957 . . . . 0.0 109.998 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' B' ' 71' ' ' LEU . 34.3 mt -48.77 -56.11 9.58 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.927 1.691 . . . . 0.0 109.014 171.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 34.7 tptt -66.9 -31.74 72.53 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 115.477 1.658 . . . . 0.0 115.477 -174.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -126.21 0.73 7.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 120.919 1.69 . . . . 0.0 112.914 -167.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -124.1 -6.4 7.79 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.77 1.228 . . . . 0.0 114.143 171.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 33.1 mt -127.88 -10.98 5.46 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 129.395 3.078 . . . . 0.0 117.051 165.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 79.45 11.87 84.4 Favored Glycine 0 CA--C 1.524 0.63 0 C-N-CA 126.453 1.978 . . . . 0.0 117.383 178.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.92 114.32 28.32 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 129.956 3.302 . . . . 0.0 115.038 -164.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.54 171.56 36.57 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 127.205 2.336 . . . . 0.0 111.736 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 mt -48.98 -47.2 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 131.603 3.961 . . . . 0.0 111.856 172.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.1 -55.77 16.86 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.997 -2.314 . . . . 0.0 114.211 176.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 27.2 m -46.18 -45.44 16.79 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 118.178 2.658 . . . . 0.0 118.178 165.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 18.4 mm -67.34 -45.42 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 O-C-N 116.909 -3.62 . . . . 0.0 113.896 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 5.7 m -47.75 -40.27 20.14 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 169.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -74.39 -37.74 63.33 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.853 2.461 . . . . 0.0 113.703 -176.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -72.73 -37.31 57.57 Favored Glycine 0 N--CA 1.447 -0.587 0 O-C-N 119.01 -2.306 . . . . 0.0 116.67 165.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 37.9 m -64.4 -42.06 96.32 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 119.097 -2.413 . . . . 0.0 113.834 176.038 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -61.8 -37.47 84.49 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 120.757 -1.214 . . . . 0.0 112.328 168.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 37.2 m -75.69 -30.2 59.27 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.913 0.863 . . . . 0.0 113.025 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.83 -44.02 94.28 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 114.917 -2.468 . . . . 0.0 113.182 164.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 61.1 mttt -51.36 -45.62 62.46 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 127.109 2.755 . . . . 0.0 111.725 169.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.81 -30.55 65.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -176.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.76 155.06 92.39 Favored Pre-proline 0 N--CA 1.45 -0.44 0 C-N-CA 128.055 2.542 . . . . 0.0 113.221 -171.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . 0.271 23.9 Cg_exo -63.38 156.28 57.1 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 O-C-N 117.184 -2.061 . . . . 0.0 116.424 176.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -61.89 -40.83 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 O-C-N 118.41 -2.682 . . . . 0.0 113.791 170.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.325 23.0 pm0 -61.02 -26.07 67.35 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 114.08 -2.867 . . . . 0.0 114.984 170.161 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.3 tp -84.89 -44.58 13.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 122.311 2.323 . . . . 0.0 105.597 178.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 23.2 mtm-85 -64.5 -27.13 68.76 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 116.347 -3.971 . . . . 0.0 116.696 -177.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -75.2 -33.31 61.4 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.24 0.543 . . . . 0.0 111.657 178.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -69.74 -52.56 24.29 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.976 2.11 . . . . 0.0 105.886 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.3 mt -65.07 -43.68 91.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.697 0.799 . . . . 0.0 112.043 -172.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -59.86 -36.29 76.56 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.838 0.455 . . . . 0.0 110.245 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -68.83 -46.22 69.11 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 116.226 1.936 . . . . 0.0 116.226 171.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.7 t -71.16 -57.57 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 113.905 -2.95 . . . . 0.0 112.362 174.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.84 -18.81 63.46 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 126.544 2.402 . . . . 0.0 113.616 -163.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 31.4 mt -97.09 -36.27 10.54 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 116.941 -3.599 . . . . 0.0 109.236 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -88.3 19.79 3.59 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 116.37 -3.956 . . . . 0.0 109.508 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . 0.363 69.0 m -87.94 -25.62 23.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 131.289 3.836 . . . . 0.0 114.26 160.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 . . . . . 0 C--O 1.25 1.088 0 O-C-N 116.511 -3.868 . . . . 0.0 112.132 166.991 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ttt . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.12 128.22 33.01 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 126.006 2.066 . . . . 0.0 110.668 -176.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -122.76 135.73 54.65 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 126.392 2.307 . . . . 0.0 113.277 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -120.58 156.38 31.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.078 0.951 . . . . 0.0 111.466 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -129.85 165.68 31.63 Favored Pre-proline 0 N--CA 1.45 -0.438 1 C-N-CA 132.367 4.267 . . . . 0.0 113.214 169.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -81.6 -20.57 6.73 Favored 'Trans proline' 0 N--CA 1.449 -1.107 0 N-CA-C 116.175 1.567 . . . . 0.0 116.175 -179.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -138.96 160.61 39.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.891 1.994 . . . . 0.0 108.951 170.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 28.0 t -151.58 124.45 8.58 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 129.46 3.104 . . . . 0.0 110.405 176.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.68 -26.5 61.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 124.183 1.944 . . . . 0.0 113.188 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.87 -37.42 14.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 117.424 -3.298 . . . . 0.0 117.036 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 64.3 mtt -61.2 -33.85 74.14 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 126.27 2.232 . . . . 0.0 111.167 163.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.9 -42.65 99.86 Favored 'General case' 0 N--CA 1.446 -0.664 1 O-C-N 115.61 -4.431 . . . . 0.0 115.279 168.425 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -75.23 -25.73 58.36 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 120.283 -1.511 . . . . 0.0 113.945 175.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -62.03 -37.17 83.92 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 120.765 -1.209 . . . . 0.0 109.48 160.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -36.6 84.64 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 119.732 -1.855 . . . . 0.0 112.92 174.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -68.61 -33.31 73.83 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 124.302 2.001 . . . . 0.0 116.327 174.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -77.35 -24.12 50.77 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 129.918 3.287 . . . . 0.0 117.038 173.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -70.52 -36.56 73.81 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 125.092 2.377 . . . . 0.0 112.611 161.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 9.4 t-105 -63.45 -58.3 7.48 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 118.555 -2.59 . . . . 0.0 112.628 167.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 20.9 mt -56.63 -29.21 61.96 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 124.573 3.351 . . . . 0.0 109.772 -176.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -82.94 -23.92 33.26 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 122.007 2.185 . . . . 0.0 113.238 -177.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -62.6 -40.31 96.52 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 114.482 -2.675 . . . . 0.0 110.294 162.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.37 -49.94 67.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 116.002 -1.951 . . . . 0.0 110.202 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -60.52 -39.65 88.6 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 122.411 2.368 . . . . 0.0 115.902 176.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 63.7 tp -65.1 -41.63 94.78 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 127.291 2.236 . . . . 0.0 107.556 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 12.0 tp -74.1 -43.77 56.4 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 122.545 1.164 . . . . 0.0 111.682 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -57.09 -28.93 63.07 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 164.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . 0.277 91.7 m-20 -79.02 -24.1 43.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 129.364 3.066 . . . . 0.0 113.812 176.002 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.24 -6.21 54.25 Favored 'General case' 0 N--CA 1.448 -0.555 1 O-C-N 115.607 -4.433 . . . . 0.0 112.018 176.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -76.09 -21.93 56.16 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.533 171.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -65.08 -23.92 67.3 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 120.287 -1.508 . . . . 0.0 111.342 177.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -138.43 7.73 2.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 119.817 -1.802 . . . . 0.0 113.107 -163.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 50.8 28.16 3.49 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.684 2.476 . . . . 0.0 117.684 -168.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 50.1 mt -88.86 19.12 4.25 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 118.873 0.76 . . . . 0.0 110.302 164.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -64.94 -46.33 82.04 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 119.243 -2.161 . . . . 0.0 115.43 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.333 71.6 mt -68.86 -41.93 22.01 Favored Pre-proline 0 N--CA 1.452 -0.358 0 C-N-CA 127.685 2.394 . . . . 0.0 113.936 169.008 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_exo -58.93 -48.83 13.0 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 C-N-CA 121.668 1.579 . . . . 0.0 115.569 170.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 66.3 tp -53.86 -45.56 71.02 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 118.132 -2.855 . . . . 0.0 115.05 167.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 20.5 mt -68.24 -26.42 65.68 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 118.938 -1.105 . . . . 0.0 112.986 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -77.85 -39.13 44.48 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 127.782 2.433 . . . . 0.0 108.159 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 38.7 tp -56.71 -48.03 78.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 125.217 2.437 . . . . 0.0 111.835 167.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 7.8 mmt -84.03 -15.48 47.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 112.194 -3.765 . . . . 0.0 113.721 -167.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mp -135.34 157.53 46.66 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 126.724 2.515 . . . . 0.0 114.662 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 34.7 p -76.44 151.78 83.28 Favored Pre-proline 0 N--CA 1.448 -0.555 0 CA-C-O 114.023 -2.894 . . . . 0.0 111.32 161.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -63.46 -27.23 70.45 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 CA-C-N 123.797 2.392 . . . . 0.0 112.177 179.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.05 -44.0 74.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 115.713 -2.089 . . . . 0.0 110.922 170.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -71.13 -28.57 64.39 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 116.465 -1.731 . . . . 0.0 110.754 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 48' ' ' ARG . . . . . 0.401 ' HD2' ' CZ2' ' D' ' 19' ' ' TRP . 88.1 mtm-85 -71.61 -46.49 59.02 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 121.722 2.056 . . . . 0.0 109.267 176.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.15 -30.71 71.81 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.851 -1.78 . . . . 0.0 114.237 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.31 -50.4 63.75 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.786 2.434 . . . . 0.0 110.095 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 51' ' ' LEU . . . . . 0.493 HD13 ' CE1' ' D' ' 22' ' ' PHE . 9.2 mt -65.81 -40.28 91.72 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 122.147 2.249 . . . . 0.0 108.676 -179.376 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.9 -38.57 94.29 Favored Glycine 0 C--N 1.337 0.605 0 O-C-N 117.186 -3.446 . . . . 0.0 115.706 171.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 20.8 m -66.65 -38.69 87.39 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 114.341 -2.742 . . . . 0.0 110.59 169.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -61.71 -29.91 70.42 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 121.109 1.777 . . . . 0.0 112.642 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 91.2 t -69.5 -43.07 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 123.113 2.688 . . . . 0.0 108.812 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -70.15 -28.8 65.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 113.144 -3.312 . . . . 0.0 113.065 174.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 9.4 mt -56.31 -57.61 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 124.852 3.478 . . . . 0.0 112.168 157.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 57.5 t -57.11 -40.48 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 CA-C-O 117.17 -1.395 . . . . 0.0 111.429 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -61.4 -45.82 92.72 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.719 2.008 . . . . 0.0 106.166 178.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -68.28 -32.96 73.5 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 120.309 1.413 . . . . 0.0 111.453 -176.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 22.4 mt -76.58 -22.89 53.64 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 124.564 1.146 . . . . 0.0 109.359 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 80.7 mt -80.17 -44.18 20.28 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 117.509 -3.244 . . . . 0.0 113.713 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttm105 -57.0 -39.26 74.35 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.492 2.317 . . . . 0.0 115.664 170.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 57.77 26.83 58.26 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 126.81 2.148 . . . . 0.0 117.269 171.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -97.07 -7.37 32.96 Favored 'General case' 0 N--CA 1.449 -0.495 1 CA-C-O 111.474 -4.108 . . . . 0.0 108.569 170.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 50.6 mtt -69.55 147.68 50.45 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 125.864 3.938 . . . . 0.0 116.621 167.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 88.6 p -106.8 168.2 9.35 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.352 1.461 . . . . 0.0 107.706 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -46.53 -30.15 2.1 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 176.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 29.9 ttp-105 -59.01 -55.01 40.62 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 126.22 2.2 . . . . 0.0 113.686 176.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . 0.319 1.7 mt-10 -70.27 -40.66 74.24 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 -174.216 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 22.5 mt -53.43 -35.63 60.65 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 119.073 -2.267 . . . . 0.0 112.469 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -91.32 -30.68 16.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.895 2.078 . . . . 0.0 112.747 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -97.83 -59.17 1.82 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 119.514 1.052 . . . . 0.0 111.22 -171.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -70.31 -42.18 72.32 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 116.559 -2.056 . . . . 0.0 113.804 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mp -90.0 -15.42 31.93 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 127.629 2.371 . . . . 0.0 112.427 -172.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 60.93 -105.47 0.86 Allowed Glycine 0 N--CA 1.448 -0.535 0 CA-C-O 116.711 -2.161 . . . . 0.0 116.753 168.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.24 -17.44 2.68 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 129.887 3.275 . . . . 0.0 112.839 -169.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.54 -13.82 71.62 Favored Glycine 0 N--CA 1.45 -0.399 0 O-C-N 118.177 -2.827 . . . . 0.0 114.236 172.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 3.9 tt -56.48 -39.86 64.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 CA-C-N 114.765 -0.718 . . . . 0.0 109.949 174.086 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.1 -12.77 59.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 126.916 3.246 . . . . 0.0 112.585 -170.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 11.0 m -69.69 -46.45 66.0 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 116.927 -3.608 . . . . 0.0 107.191 166.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 46.4 mm -66.96 -40.18 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 N-CA-C 116.781 2.141 . . . . 0.0 116.781 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 40.5 p -100.69 -17.77 16.83 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -167.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 60.4 mtp85 -103.62 161.51 13.84 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 114.819 -2.515 . . . . 0.0 115.288 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.33 158.51 30.0 Favored Glycine 0 CA--C 1.524 0.618 0 O-C-N 126.053 2.095 . . . . 0.0 117.838 -177.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 88.9 p -63.85 4.83 0.26 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 118.135 2.642 . . . . 0.0 118.135 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -115.78 -5.25 12.09 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 3.2 p -68.21 177.12 2.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.287 1.835 . . . . 0.0 113.233 -154.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 15.3 tp -58.05 -26.49 62.55 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 116.272 -1.823 . . . . 0.0 111.703 -167.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -106.14 7.63 31.75 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 113.933 -2.937 . . . . 0.0 111.73 176.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -111.91 -5.74 14.32 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 129.976 3.31 . . . . 0.0 113.353 167.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.79 151.09 89.78 Favored Pre-proline 0 N--CA 1.452 -0.334 0 C-N-CA 127.076 2.15 . . . . 0.0 115.449 171.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -55.69 139.02 82.82 Favored 'Trans proline' 0 N--CA 1.448 -1.193 0 CA-C-N 120.324 1.151 . . . . 0.0 112.238 174.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 99.0 t -72.22 -30.94 37.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 124.714 1.206 . . . . 0.0 108.266 -166.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -60.75 -19.7 59.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.956 2.947 . . . . 0.0 118.956 161.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 43.8 tp -84.02 -47.25 11.15 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.322 -0.861 . . . . 0.0 109.53 168.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 76.8 mtp180 -56.85 -49.9 74.06 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 115.894 -2.003 . . . . 0.0 109.812 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -53.09 -50.61 64.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.026 1.73 . . . . 0.0 109.294 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 61.0 t90 -75.1 -33.21 61.6 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.817 1.247 . . . . 0.0 112.271 -165.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 82.3 mt -63.49 -26.07 68.55 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 116.635 -3.791 . . . . 0.0 114.657 166.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -72.97 -27.39 61.79 Favored 'General case' 0 N--CA 1.45 -0.436 1 O-C-N 114.549 -5.094 . . . . 0.0 108.041 169.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -80.3 -24.17 40.18 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . 0.317 99.5 t -97.95 -28.18 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 124.73 3.423 . . . . 0.0 116.382 177.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 18.6 mt -110.52 -29.05 8.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.268 1.827 . . . . 0.0 112.973 -172.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 71.3 mt -121.0 30.54 6.81 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 41.4 pttt . . . . . 0 N--CA 1.45 -0.456 0 C-N-CA 126.578 1.951 . . . . 0.0 113.168 162.856 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' D' D ' 5' ' ' SER . . . . . 0.448 ' HB2' ' HD2' ' D' ' 6' ' ' PRO . 90.9 p . . . . . 0 N--CA 1.45 -0.439 0 CA-C-O 116.618 -1.658 . . . . 0.0 110.17 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 6' ' ' PRO . . . . . 0.448 ' HD2' ' HB2' ' D' ' 5' ' ' SER . 37.5 Cg_endo -79.92 -44.03 0.12 Allowed 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 124.652 3.568 . . . . 0.0 112.112 155.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -152.66 140.24 19.79 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 155.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 36.0 t -67.13 121.22 15.14 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 109.805 -3.361 . . . . 0.0 110.849 -173.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . 0.263 . . -56.97 -21.26 28.98 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 117.711 -1.138 . . . . 0.0 110.659 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.5 -29.18 17.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.889 2.476 . . . . 0.0 113.556 -172.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.3 21.7 mmt -64.95 -37.48 87.79 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.888 -0.577 . . . . 0.0 112.189 158.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.81 -35.14 80.15 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 117.147 2.277 . . . . 0.0 117.147 173.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -60.73 -58.25 9.25 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.957 -2.965 . . . . 0.0 108.233 159.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -47.3 -38.38 12.52 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 117.907 -2.995 . . . . 0.0 118.815 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.39 5.8 49.23 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 131.408 3.883 . . . . 0.0 115.074 -173.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -104.93 -22.62 13.11 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 117.046 -1.454 . . . . 0.0 107.949 146.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -77.29 -34.08 55.61 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 123.23 2.741 . . . . 0.0 112.294 -176.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -66.5 -15.3 63.27 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 171.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 19' ' ' TRP . . . . . 0.401 ' CZ2' ' HD2' ' C' ' 48' ' ' ARG . 28.6 t-105 -82.96 -37.18 24.45 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 167.156 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.17 -15.34 62.93 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 114.501 -2.666 . . . . 0.0 111.095 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -65.15 -49.58 69.32 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 114.012 -2.899 . . . . 0.0 105.714 164.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 22' ' ' PHE . . . . . 0.493 ' CE1' HD13 ' C' ' 51' ' ' LEU . 74.4 t80 -70.05 -38.76 75.89 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 122.177 2.262 . . . . 0.0 111.207 -172.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 20.7 t -66.19 -34.84 72.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 C-N-CA 128.317 2.647 . . . . 0.0 111.032 171.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -75.31 -37.83 60.6 Favored 'General case' 0 N--CA 1.448 -0.539 1 O-C-N 115.302 -4.624 . . . . 0.0 115.46 167.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 tp -69.09 -33.07 72.94 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 24.8 tp -73.85 -46.07 47.24 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 121.426 -0.796 . . . . 0.0 110.066 -177.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -58.03 -46.05 85.94 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 126.222 1.809 . . . . 0.0 112.097 172.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -52.35 -30.44 28.63 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 166.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 -29.24 30.87 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.436 1.094 . . . . 0.0 113.369 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -50.54 -40.57 52.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 125.264 2.459 . . . . 0.0 111.246 167.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -75.44 -30.18 59.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 118.834 -2.416 . . . . 0.0 113.744 -158.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 53.3 p-10 -111.18 14.17 21.79 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 128.922 3.889 . . . . 0.0 118.448 168.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 52.89 54.82 9.88 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 14.9 mt -121.33 5.42 10.22 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 129.305 3.042 . . . . 0.0 110.749 171.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -61.89 2.26 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 116.428 -1.748 . . . . 0.0 112.071 174.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 4.2 mt -52.15 -45.74 93.8 Favored Pre-proline 0 N--CA 1.45 -0.445 0 CA-C-O 115.183 -2.342 . . . . 0.0 115.22 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.24 -20.55 14.39 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 114.714 -3.057 . . . . 0.0 114.159 172.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 12.0 tp -68.01 -35.73 78.78 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 124.126 3.148 . . . . 0.0 113.18 169.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 24.3 mt -71.05 -36.37 72.29 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 123.227 1.489 . . . . 0.0 107.15 -175.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 35.3 m-20 -78.58 -26.99 45.6 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.863 1.792 . . . . 0.0 112.688 -175.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -68.02 -48.45 65.65 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.143 166.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 65.1 mmm -65.47 -34.63 78.74 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 114.892 -2.48 . . . . 0.0 114.858 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -115.16 144.76 43.18 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 122.231 2.287 . . . . 0.0 116.798 -172.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 70.1 p -67.62 148.78 98.54 Favored Pre-proline 0 N--CA 1.452 -0.37 0 O-C-N 117.161 -3.462 . . . . 0.0 110.035 167.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -35.79 -54.15 0.81 Allowed 'Trans proline' 0 N--CA 1.451 -1.009 1 C-N-CA 127.072 5.181 . . . . 0.0 113.438 171.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -71.37 -9.63 58.47 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 -178.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . 0.251 38.8 mt-10 -86.43 -41.63 14.28 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 120.398 -1.439 . . . . 0.0 112.321 163.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -59.88 -36.5 77.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 125.216 2.436 . . . . 0.0 114.455 172.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -74.43 -40.19 62.12 Favored 'General case' 0 N--CA 1.451 -0.412 1 C-N-CA 134.76 5.224 . . . . 0.0 108.404 -175.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.28 -41.4 63.65 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 116.605 -3.809 . . . . 0.0 112.736 171.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 50.8 mt -59.65 -44.87 93.38 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 119.833 -1.792 . . . . 0.0 107.904 178.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.22 -33.38 85.77 Favored Glycine 0 CA--C 1.523 0.576 0 C-N-CA 118.563 -1.78 . . . . 0.0 114.884 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 97.6 m -78.96 -24.03 44.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 119.577 -2.131 . . . . 0.0 111.156 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 27.0 mtt180 -75.26 -20.67 59.05 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 117.579 -1.649 . . . . 0.0 113.105 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 99.3 t -49.56 -61.02 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 114.731 -2.556 . . . . 0.0 115.763 159.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -65.27 -26.07 67.92 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 126.187 2.179 . . . . 0.0 113.515 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 57' ' ' ILE . . . . . 0.404 HG12 ' HB3' ' D' ' 75' ' ' LEU . 36.5 mt -67.51 -52.09 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 129.711 3.204 . . . . 0.0 107.831 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 55.0 t -54.49 -39.62 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 125.984 1.714 . . . . 0.0 115.618 165.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -58.1 -60.73 3.28 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 122.98 1.371 . . . . 0.0 114.005 176.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -57.24 -37.86 72.93 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 128.725 2.81 . . . . 0.0 110.525 176.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 7.2 mt -61.06 -41.34 96.44 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 115.857 -2.337 . . . . 0.0 114.262 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 31.5 mt -67.84 -40.62 83.68 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.521 2.328 . . . . 0.0 110.91 170.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -63.9 -42.6 97.39 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 115.214 1.561 . . . . 0.0 115.214 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 52.0 61.2 6.73 Favored Glycine 0 CA--C 1.521 0.443 0 O-C-N 116.841 -3.662 . . . . 0.0 116.019 -173.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -139.31 -37.63 0.5 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 121.005 2.402 . . . . 0.0 106.972 -174.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 49.1 mtt -93.08 52.68 1.84 Allowed 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 118.9 -2.375 . . . . 0.0 113.724 159.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 31.1 p -95.01 -174.85 3.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 121.405 3.854 . . . . 0.0 121.405 -172.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.25 4.4 tp-100 56.3 -76.24 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 129.101 2.96 . . . . 0.0 115.431 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 49.8 ttt85 -88.25 -34.95 17.56 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 121.565 1.984 . . . . 0.0 114.137 169.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -74.67 -51.84 13.27 Favored 'General case' 0 N--CA 1.446 -0.674 0 O-C-N 118.829 -2.419 . . . . 0.0 116.504 -157.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -35.66 -47.97 0.5 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.517 1.127 . . . . 0.0 112.757 161.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -68.91 -27.24 65.59 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 116.948 2.203 . . . . 0.0 116.948 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -105.32 -31.73 8.93 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 124.796 2.236 . . . . 0.0 112.823 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -87.67 -36.45 17.43 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.537 2.051 . . . . 0.0 116.537 -172.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 75' ' ' LEU . . . . . 0.404 ' HB3' HG12 ' D' ' 57' ' ' ILE . 0.8 OUTLIER -110.19 -36.31 5.86 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.714 2.006 . . . . 0.0 108.638 175.977 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 59.61 -113.01 4.81 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 118.885 2.314 . . . . 0.0 118.885 167.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.57 2.91 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 120.94 3.681 . . . . 0.0 120.94 -159.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -110.94 -7.2 25.56 Favored Glycine 0 CA--C 1.526 0.774 0 O-C-N 119.736 -1.852 . . . . 0.0 111.512 170.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 4.9 tt -73.91 -19.43 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 118.839 -2.566 . . . . 0.0 114.3 -166.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -97.34 -11.85 23.53 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 119.589 1.086 . . . . 0.0 109.466 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.2 m -79.54 -55.43 5.05 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 106.376 -1.712 . . . . 0.0 106.376 161.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.327 20.4 mm -58.18 -26.98 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 118.141 -2.849 . . . . 0.0 114.599 176.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 30.9 p -111.08 8.55 21.85 Favored 'General case' 0 N--CA 1.451 -0.401 1 N-CA-C 123.34 4.57 . . . . 0.0 123.34 177.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -112.03 -144.58 0.39 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 114.915 -2.469 . . . . 0.0 106.519 164.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 75.77 155.3 5.38 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-N 122.959 2.618 . . . . 0.0 109.757 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 94.1 p -71.66 -30.8 66.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 176.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -138.9 43.16 2.09 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 -167.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 96.6 p -84.14 -179.32 7.2 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 124.074 1.892 . . . . 0.0 112.053 173.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.267 1.6 mp -69.46 -9.0 51.81 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 112.665 -2.061 . . . . 0.0 114.676 175.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 22.6 tttt -71.81 -16.44 62.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 115.618 1.711 . . . . 0.0 115.618 155.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -101.08 -41.88 6.59 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 120.057 -1.652 . . . . 0.0 109.515 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 92' ' ' ALA . . . . . 0.493 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 59.62 91.66 0.07 OUTLIER Pre-proline 0 N--CA 1.452 -0.345 0 CA-C-N 120.695 1.589 . . . . 0.0 109.997 -174.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 93' ' ' PRO . . . . . 0.493 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.285 97.9 Cg_exo 37.4 35.72 0.0 OUTLIER 'Cis proline' 0 N--CA 1.448 -1.161 0 N-CA-C 116.756 1.791 . . . . 0.0 116.756 29.823 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 94' ' ' VAL . . . . . 0.481 HG22 ' HB1' ' D' ' 92' ' ' ALA . 61.1 t -66.76 -18.22 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 C-N-CA 128.327 2.651 . . . . 0.0 111.324 -172.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.55 -28.11 9.06 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -166.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 36.9 tp -57.69 -46.06 84.81 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 120.531 -1.356 . . . . 0.0 110.884 151.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -67.5 -49.24 64.34 Favored 'General case' 0 N--CA 1.451 -0.408 1 O-C-N 116.135 -4.103 . . . . 0.0 112.184 -175.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -61.0 -2.61 0.61 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 114.383 -2.722 . . . . 0.0 111.811 172.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -103.87 -54.18 2.61 Favored 'General case' 0 N--CA 1.45 -0.438 1 CA-C-N 127.74 4.791 . . . . 0.0 110.888 171.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 92.1 mt -48.81 -42.56 36.46 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.8 1.24 . . . . 0.0 107.657 174.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -66.99 -35.54 80.17 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.574 -0.704 . . . . 0.0 112.372 -173.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -80.51 -24.35 39.46 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 120.612 1.551 . . . . 0.0 109.136 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 78.1 t -100.88 -15.2 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 123.908 3.049 . . . . 0.0 107.626 -168.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 83.9 mt -112.9 -16.22 12.74 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 121.487 1.949 . . . . 0.0 112.463 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.353 25.1 mt -98.4 16.34 21.96 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 171.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 15.6 pttp -77.77 161.52 27.62 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.741 2.016 . . . . 0.0 114.131 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 5.4 m -80.74 -9.66 59.79 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 117.893 -3.005 . . . . 0.0 117.797 -164.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-N 121.851 2.114 . . . . 0.0 112.913 -176.044 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 56.6 ttp . . . . . 0 N--CA 1.448 -0.549 0 CA-C-O 121.197 0.523 . . . . 0.0 109.863 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.97 -49.81 76.46 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 117.08 -3.513 . . . . 0.0 114.959 168.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -54.31 -43.13 70.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 122.711 1.243 . . . . 0.0 112.452 173.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -55.42 -53.11 60.33 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 122.78 1.276 . . . . 0.0 112.313 174.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -69.94 -40.57 75.42 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 116.576 -1.678 . . . . 0.0 109.372 -175.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -47.8 -33.35 7.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 125.768 2.699 . . . . 0.0 116.067 171.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . 0.309 2.6 mp0 -73.55 -31.7 63.79 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 117.772 -3.08 . . . . 0.0 113.008 173.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -76.08 -19.8 58.26 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 119.401 -2.062 . . . . 0.0 110.014 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.47 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG 0.34 38.7 t-105 -71.18 -50.06 37.22 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.184 2.994 . . . . 0.0 114.981 166.304 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.54 -27.38 68.58 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.027 1.731 . . . . 0.0 114.514 173.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -75.05 -35.06 61.91 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 116.566 2.061 . . . . 0.0 116.566 165.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.38 -50.27 70.15 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 119.883 1.219 . . . . 0.0 112.806 161.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.4 t -76.96 -25.58 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 CA-C-O 115.414 -2.232 . . . . 0.0 113.811 -173.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -61.02 -55.74 29.21 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 115.405 -2.236 . . . . 0.0 114.893 155.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 48.9 tp -56.18 -37.43 69.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 121.011 1.732 . . . . 0.0 113.154 -173.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 23.4 tp -68.23 -46.84 69.43 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 110.082 -3.235 . . . . 0.0 114.411 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -60.88 -42.47 97.99 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 118.569 -2.582 . . . . 0.0 112.023 174.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.89 -32.23 71.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 126.221 2.201 . . . . 0.0 111.996 173.133 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.505 ' HB2' HD22 ' A' ' 38' ' ' LEU . . . -66.88 -36.68 82.84 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 111.883 -3.913 . . . . 0.0 108.971 171.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -62.64 -34.05 76.26 Favored 'General case' 0 N--CA 1.448 -0.547 1 CA-C-N 130.116 5.871 . . . . 0.0 115.328 168.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.328 77.1 mt-30 -64.6 -21.2 66.65 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 116.972 2.212 . . . . 0.0 116.972 170.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -109.02 10.57 26.17 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 124.701 1.25 . . . . 0.0 108.623 173.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 52.66 27.21 5.0 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 116.737 -3.727 . . . . 0.0 118.265 -168.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.2 mt -102.54 6.69 40.03 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 117.491 -3.255 . . . . 0.0 112.004 -172.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -72.22 -30.59 65.07 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.561 1.544 . . . . 0.0 110.755 -158.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 56.4 mt -63.6 -59.23 12.28 Favored Pre-proline 0 N--CA 1.451 -0.396 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 167.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -49.96 -33.91 35.67 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 CA-C-N 124.994 2.819 . . . . 0.0 113.454 170.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.505 HD22 ' HB2' ' A' ' 29' ' ' ALA . 13.3 tp -64.44 -52.08 59.87 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 122.281 2.31 . . . . 0.0 116.097 174.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.3 mt -60.68 -35.09 75.41 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.13 1.772 . . . . 0.0 114.78 168.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 -73.87 -30.75 62.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 121.801 2.091 . . . . 0.0 108.02 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.275 19.6 tp -78.36 -36.93 45.41 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 116.78 -3.7 . . . . 0.0 111.272 176.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 62.1 mmm -70.68 -20.28 62.7 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 118.279 2.696 . . . . 0.0 118.279 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.426 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 10.5 mt -137.32 125.15 22.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 130.342 3.457 . . . . 0.0 114.278 178.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 66.8 p -67.16 152.19 96.35 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-O 114.715 -2.564 . . . . 0.0 108.855 175.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -59.32 -26.83 83.24 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 N-CA-C 119.163 2.717 . . . . 0.0 119.163 -159.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -63.59 -44.55 93.67 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 125.645 1.84 . . . . 0.0 108.143 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 21.9 mt-10 -59.13 -44.9 92.06 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 131.673 3.989 . . . . 0.0 114.353 177.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.6 mtm180 -65.48 -54.67 25.02 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.889 3.276 . . . . 0.0 113.266 172.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -47.42 -36.32 9.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 165.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.12 -38.74 79.05 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 118.595 -2.565 . . . . 0.0 114.057 169.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.9 mt -66.7 -32.49 73.84 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 116.672 -1.632 . . . . 0.0 107.076 178.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.93 -50.74 62.67 Favored Glycine 0 CA--C 1.523 0.57 0 CA-C-N 120.287 1.403 . . . . 0.0 110.986 166.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.5 m -60.74 -33.85 73.53 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 120.723 2.261 . . . . 0.0 110.804 -175.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -73.18 -25.95 60.99 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 120.926 1.694 . . . . 0.0 109.092 -170.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 85.8 t -58.49 -43.4 86.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 C-N-CA 124.695 1.198 . . . . 0.0 112.44 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 -67.16 -43.21 82.83 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 129.271 3.028 . . . . 0.0 112.227 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 81.8 mt -54.11 -54.64 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 125.114 1.509 . . . . 0.0 111.09 165.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.7 t -66.1 -26.2 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 120.729 1.604 . . . . 0.0 112.263 176.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . 0.25 11.0 tt0 -63.67 -53.39 52.07 Favored 'General case' 0 N--CA 1.446 -0.652 1 O-C-N 116.066 -4.146 . . . . 0.0 111.396 170.095 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -75.63 -23.05 56.33 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 117.17 -3.456 . . . . 0.0 113.02 -175.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 80.3 mt -76.31 -34.88 59.04 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 119.011 -2.306 . . . . 0.0 112.224 165.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 63.2 mt -73.55 -50.12 22.95 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 116.792 -3.693 . . . . 0.0 113.105 173.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.7 ttm180 -43.05 -41.54 3.54 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 116.532 -3.855 . . . . 0.0 115.424 161.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 59.11 29.71 65.91 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 120.278 2.871 . . . . 0.0 120.278 172.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -95.75 -43.13 8.02 Favored 'General case' 0 N--CA 1.444 -0.725 1 C-N-CA 131.746 4.019 . . . . 0.0 114.505 175.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 40.8 mtt -69.48 130.54 42.78 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 168.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.7 p -78.73 172.19 14.08 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.933 2.093 . . . . 0.0 113.074 158.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -50.54 -44.4 56.44 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 128.106 2.562 . . . . 0.0 113.995 171.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -61.9 -27.1 68.57 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 118.935 -2.353 . . . . 0.0 115.517 177.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -84.26 -54.64 4.66 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 126.994 2.118 . . . . 0.0 111.788 -178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.5 mt -46.74 -29.71 2.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 119.127 3.01 . . . . 0.0 119.127 164.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -72.86 -18.4 61.44 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.795 2.038 . . . . 0.0 114.53 173.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -91.99 -74.27 0.52 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.106 2.162 . . . . 0.0 110.628 160.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -66.22 -21.78 66.32 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 127.105 2.753 . . . . 0.0 112.238 -151.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 13.0 mt -120.07 -26.79 5.46 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 120.254 -1.529 . . . . 0.0 108.425 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.51 15.47 27.24 Favored Glycine 0 CA--C 1.526 0.774 0 C-N-CA 126.137 1.827 . . . . 0.0 115.993 170.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.52 126.79 35.12 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 126.248 1.793 . . . . 0.0 113.784 -164.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.21 157.16 49.63 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-O 122.079 0.821 . . . . 0.0 113.927 175.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.4 mt -57.09 -48.79 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.52 -33.42 66.04 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 117.561 -1.209 . . . . 0.0 113.562 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.6 p -67.64 -44.35 78.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 122.005 0.907 . . . . 0.0 111.091 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.3 mm -70.94 -33.79 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.276 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 15.0 m -56.14 -61.79 2.15 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 118.487 -2.633 . . . . 0.0 113.661 165.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -58.02 -36.49 72.78 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 130.673 3.589 . . . . 0.0 114.013 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.59 -36.76 32.56 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-O 115.008 -3.107 . . . . 0.0 108.172 -177.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 68.8 m -63.56 -52.97 58.76 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 119.368 1.584 . . . . 0.0 113.373 168.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -57.11 -31.52 65.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.754 -1.593 . . . . 0.0 110.285 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.7 m -77.06 -25.8 52.83 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 124.865 3.484 . . . . 0.0 113.479 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 29.3 tp -82.62 -42.43 18.24 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 119.222 3.045 . . . . 0.0 119.222 174.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -59.38 -39.88 84.73 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 125.179 1.391 . . . . 0.0 111.335 162.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.11 -35.77 78.67 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 117.283 -1.767 . . . . 0.0 113.762 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -50.47 142.59 15.04 Favored Pre-proline 0 N--CA 1.448 -0.532 0 CA-C-O 116.597 -1.668 . . . . 0.0 113.573 175.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.7 145.32 36.7 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 CA-C-N 121.472 1.561 . . . . 0.0 111.624 -168.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 m -57.26 -32.25 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -168.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -55.42 -36.03 66.03 Favored 'General case' 0 N--CA 1.445 -0.723 1 O-C-N 113.409 -5.807 . . . . 0.0 114.79 174.059 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 33.5 tp -67.31 -39.31 85.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 114.268 -2.777 . . . . 0.0 115.373 169.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 87.1 mtm-85 -66.82 -43.12 84.62 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 125.375 1.672 . . . . 0.0 110.467 168.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -61.63 -28.3 69.27 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 125.171 1.544 . . . . 0.0 108.7 -176.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 22.1 t90 -75.14 -61.74 1.79 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 170.26 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 92.1 mt -51.35 -38.47 53.35 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -58.25 -31.0 66.99 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 120.94 -1.1 . . . . 0.0 112.764 172.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -83.54 -19.28 35.95 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 120.144 -1.597 . . . . 0.0 114.743 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 21.2 t -95.81 -55.39 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 1 C-N-CA 133.105 4.562 . . . . 0.0 111.1 -176.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.6 mt -89.32 -15.56 33.15 Favored 'General case' 0 N--CA 1.448 -0.533 1 O-C-N 115.35 -4.594 . . . . 0.0 110.433 -171.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 59.4 mt -116.5 4.58 13.29 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 122.829 2.559 . . . . 0.0 113.634 -172.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mttp . . . . . 0 N--CA 1.451 -0.392 0 O-C-N 123.874 0.734 . . . . 0.0 112.886 179.142 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.709 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 51.7 mtt -69.39 -38.52 78.02 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 116.319 -1.801 . . . . 0.0 108.776 168.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.11 -41.38 98.17 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 124.126 3.148 . . . . 0.0 109.787 -173.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -71.98 -26.18 62.15 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 119.867 -1.771 . . . . 0.0 113.96 173.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -73.94 -36.27 64.62 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 117.974 -2.954 . . . . 0.0 112.135 169.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -72.43 -34.33 67.73 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 116.433 -1.746 . . . . 0.0 112.775 177.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 69.1 t60 -62.15 -46.14 90.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 127.862 3.226 . . . . 0.0 109.512 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -64.58 -35.19 80.2 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 117.374 -3.329 . . . . 0.0 115.805 168.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -70.06 -22.54 63.06 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 119.706 -1.872 . . . . 0.0 111.887 176.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -85.16 -47.69 9.88 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 128.361 2.664 . . . . 0.0 106.936 174.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . 0.253 45.5 mt -49.98 -24.57 2.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 118.12 2.637 . . . . 0.0 118.12 174.068 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 50.9 ttt180 -68.19 -33.63 74.8 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.938 -2.351 . . . . 0.0 112.196 173.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -66.28 -43.47 86.3 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 127.142 2.177 . . . . 0.0 110.971 176.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 38.6 t -58.97 -38.69 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 129.988 3.315 . . . . 0.0 115.545 173.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -71.44 -41.9 68.89 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 113.249 -1.796 . . . . 0.0 113.696 166.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 48.5 tp -60.38 -36.31 77.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 173.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.328 55.2 tp -80.77 -37.15 30.86 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 115.537 -2.173 . . . . 0.0 111.229 178.638 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -56.91 -44.41 82.37 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 116.491 -2.084 . . . . 0.0 114.398 167.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 50.6 m-20 -73.45 -26.49 60.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 120.19 1.359 . . . . 0.0 111.929 -172.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.86 -36.21 62.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.494 1.918 . . . . 0.0 114.939 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -60.79 -33.75 73.46 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 116.21 -1.853 . . . . 0.0 114.813 159.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -67.55 -29.22 68.54 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 122.529 2.422 . . . . 0.0 112.221 171.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -96.8 -0.1 48.53 Favored 'General case' 0 N--CA 1.447 -0.599 1 CA-C-O 111.465 -4.112 . . . . 0.0 110.174 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.46 0.4 OUTLIER 57.92 14.09 2.43 Favored 'General case' 0 N--CA 1.445 -0.683 1 C-N-CA 131.94 4.096 . . . . 0.0 117.163 -178.438 . . . . . . . . 4 3 . 1 . 005 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' B' ' 34' ' ' LEU . 20.5 mt -88.96 22.08 2.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 129.115 2.966 . . . . 0.0 109.722 -177.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -88.39 -20.61 25.04 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 117.456 2.391 . . . . 0.0 117.456 -157.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 23.5 mt -73.2 -56.62 3.2 Favored Pre-proline 0 N--CA 1.449 -0.497 0 CA-C-N 112.089 -2.323 . . . . 0.0 111.747 170.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -62.62 -27.96 76.68 Favored 'Trans proline' 0 N--CA 1.448 -1.15 1 C-N-CA 125.698 4.265 . . . . 0.0 112.814 178.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 41.9 tp -73.35 -37.66 65.99 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.849 1.968 . . . . 0.0 106.903 -178.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 80.7 mt -70.84 -38.69 73.2 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 125.522 2.582 . . . . 0.0 112.189 175.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -57.39 -29.31 63.97 Favored 'General case' 0 N--CA 1.449 -0.5 1 O-C-N 114.531 -5.105 . . . . 0.0 113.578 165.146 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 45.0 tp -78.5 -48.02 16.16 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 117.283 -3.386 . . . . 0.0 111.904 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 11.4 mmt -82.89 -11.23 58.37 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -167.178 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 1.1 mp -140.61 128.32 21.65 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.287 1.835 . . . . 0.0 112.354 -169.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 66.8 p -80.19 160.63 67.72 Favored Pre-proline 0 N--CA 1.449 -0.48 0 CA-C-O 115.385 -2.245 . . . . 0.0 110.334 -178.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -55.16 -36.36 92.96 Favored 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 124.895 3.73 . . . . 0.0 113.784 -169.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.32 -26.28 38.87 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 124.468 1.105 . . . . 0.0 110.155 -172.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -67.49 -47.27 70.52 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 119.084 -2.26 . . . . 0.0 110.91 167.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 48' ' ' ARG . . . . . 0.47 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 62.7 mtm-85 -63.58 -41.35 98.38 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 125.163 1.539 . . . . 0.0 115.064 178.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.57 -39.31 93.51 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 118.891 -2.38 . . . . 0.0 114.876 169.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.62 -46.96 65.03 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 18.8 mt -53.09 -34.93 58.83 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 117.04 -3.537 . . . . 0.0 116.492 169.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.96 -24.17 71.47 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 110.688 -2.96 . . . . 0.0 115.967 172.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.5 m -101.88 -22.35 14.35 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 114.926 -2.464 . . . . 0.0 110.969 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -63.32 -21.62 66.37 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 121.311 1.869 . . . . 0.0 112.643 166.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 10.5 t -54.16 -49.37 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 O-C-N 116.599 -3.813 . . . . 0.0 114.424 163.001 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 -74.07 -31.84 63.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 96.3 mt -70.73 -46.97 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 3.3 t -63.23 -36.2 75.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 O-C-N 116.975 -3.578 . . . . 0.0 111.634 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.16 -41.94 76.24 Favored 'General case' 0 N--CA 1.452 -0.35 1 O-C-N 115.861 -4.274 . . . . 0.0 116.396 169.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -80.08 -17.33 52.95 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 129.951 3.3 . . . . 0.0 112.468 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 54.6 mt -82.73 -9.78 59.2 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 117.183 -3.448 . . . . 0.0 111.027 168.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 89.3 mt -107.38 -31.33 8.22 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 128.413 2.685 . . . . 0.0 112.079 169.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 16.5 ttm105 -70.66 -54.46 11.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.692 1.738 . . . . 0.0 115.692 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.68 54.61 30.22 Favored Glycine 0 C--N 1.337 0.622 0 CA-C-O 115.301 -2.944 . . . . 0.0 117.111 -170.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -126.95 -17.01 4.99 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 117.152 2.278 . . . . 0.0 117.152 175.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 81.4 mtp -102.93 146.44 28.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.208 -2.183 . . . . 0.0 111.731 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -93.54 172.55 8.2 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 118.471 -2.643 . . . . 0.0 107.845 172.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -58.4 -37.41 75.25 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 175.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -55.25 -36.51 66.14 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 126.298 2.951 . . . . 0.0 118.208 172.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -85.08 -38.92 18.57 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 128.284 2.634 . . . . 0.0 106.681 -174.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 73.3 mt -58.56 -42.49 88.06 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 117.056 -3.527 . . . . 0.0 111.491 170.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 tptt -59.26 -65.92 0.59 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 127.757 2.423 . . . . 0.0 111.02 173.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -74.16 -29.75 61.93 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 114.687 -2.805 . . . . 0.0 114.147 -168.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . 0.31 39.6 mt-10 -115.91 -23.62 8.5 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 114.867 -2.492 . . . . 0.0 114.422 -162.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mt -104.85 -6.1 20.53 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 126.092 2.12 . . . . 0.0 114.389 162.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.94 16.8 70.91 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 119.672 -1.251 . . . . 0.0 113.496 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.55 134.72 34.18 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 122.833 3.316 . . . . 0.0 117.808 -179.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.17 -173.24 7.43 Favored Glycine 0 C--N 1.334 0.456 0 CA-C-O 124.527 2.181 . . . . 0.0 111.848 158.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 97.3 mt -83.13 -44.98 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 O-C-N 117.255 -3.497 . . . . 0.0 113.146 -177.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.97 -23.26 52.34 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 -169.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 17.2 m -66.04 -44.31 85.0 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.315 1.446 . . . . 0.0 113.841 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 21.1 mm -76.74 -30.14 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 C-N-CA 125.916 1.686 . . . . 0.0 107.663 173.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 6.7 m -59.4 -50.72 72.86 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 120.245 -1.534 . . . . 0.0 111.003 169.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -61.72 -42.18 98.61 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -48.55 -44.54 29.31 Favored Glycine 0 N--CA 1.446 -0.657 1 C-N-CA 131.038 4.161 . . . . 0.0 109.7 176.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 3.6 p -74.02 -35.83 64.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.361 1.465 . . . . 0.0 114.055 -178.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -69.59 -41.19 76.11 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 127.514 2.326 . . . . 0.0 107.702 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 6.0 m -72.51 -31.99 65.79 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 119.33 -2.107 . . . . 0.0 115.057 -176.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.09 -25.86 20.53 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 115.913 -1.994 . . . . 0.0 106.682 -177.416 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 58.1 tttm -64.4 -48.67 74.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 121.993 2.179 . . . . 0.0 105.234 172.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.18 3.94 25.29 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 117.368 -3.332 . . . . 0.0 116.671 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.7 141.71 64.91 Favored Pre-proline 0 N--CA 1.45 -0.425 0 O-C-N 117.49 -3.256 . . . . 0.0 113.157 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -49.03 124.99 12.35 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 123.192 2.595 . . . . 0.0 116.891 172.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.31 -23.56 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 1 O-C-N 115.887 -4.258 . . . . 0.0 115.571 -172.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -60.36 -30.25 69.43 Favored 'General case' 0 N--CA 1.453 -0.308 1 O-C-N 114.865 -4.897 . . . . 0.0 111.877 171.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 14.7 tp -79.35 -36.79 38.86 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 117.39 -1.291 . . . . 0.0 110.655 171.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 32.0 mtm-85 -65.78 -39.77 91.33 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.832 2.16 . . . . 0.0 116.832 171.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -58.23 -39.37 78.92 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 130.296 3.438 . . . . 0.0 112.013 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -61.44 -59.2 5.61 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 128.188 2.595 . . . . 0.0 114.347 163.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 50.5 mt -75.11 -25.4 58.45 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 122.036 2.198 . . . . 0.0 114.529 -165.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -52.53 -35.79 54.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 129.71 3.204 . . . . 0.0 110.814 170.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -95.47 -47.71 6.15 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.156 2.183 . . . . 0.0 114.021 175.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.9 t -68.16 -20.78 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 O-C-N 119.749 -1.844 . . . . 0.0 112.928 -170.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 50.9 mt -107.14 -42.99 4.72 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -176.37 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 11.5 mt -77.35 -5.76 50.8 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.007 -1.451 . . . . 0.0 114.066 -174.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -104.29 -2.56 25.41 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 117.268 2.322 . . . . 0.0 117.268 169.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 31.6 m -79.68 -1.13 36.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 114.338 -2.744 . . . . 0.0 114.051 164.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 . . . . . 0 C--O 1.25 1.107 0 CA-C-N 124.905 3.502 . . . . 0.0 109.523 -178.689 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 11.5 ttt . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 116.941 -1.504 . . . . 0.0 111.581 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.263 . . -57.39 141.96 45.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 129.049 2.94 . . . . 0.0 104.646 178.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -120.11 149.66 41.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 123.921 0.763 . . . . 0.0 111.301 -176.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -141.2 148.37 39.83 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 174.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 60.4 p -159.67 158.47 27.38 Favored Pre-proline 0 N--CA 1.446 -0.646 1 C-N-CA 132.77 4.428 . . . . 0.0 111.025 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -52.91 -47.82 25.45 Favored 'Trans proline' 0 N--CA 1.45 -1.076 0 C-N-CA 122.376 2.051 . . . . 0.0 113.58 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -139.88 141.52 36.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 117.308 -3.37 . . . . 0.0 110.951 -171.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 11.9 t -141.95 137.38 31.22 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 112.684 -2.053 . . . . 0.0 106.341 168.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.89 -42.76 94.51 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 117.546 2.424 . . . . 0.0 117.546 174.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.85 -33.38 23.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 168.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 47.6 mtt -83.44 -37.83 22.69 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 115.189 -2.338 . . . . 0.0 113.43 175.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.85 -37.31 71.11 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 123.224 2.738 . . . . 0.0 112.802 166.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -67.52 -38.36 84.12 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 119.389 -2.069 . . . . 0.0 114.661 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -72.22 -25.97 61.85 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.074 -1.641 . . . . 0.0 111.626 176.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -39.59 86.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 125.888 2.756 . . . . 0.0 113.237 169.723 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -69.54 -48.83 59.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 119.439 -2.038 . . . . 0.0 108.856 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -70.34 -24.85 63.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 115.265 -2.302 . . . . 0.0 110.552 -175.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -56.8 -48.9 76.89 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.482 2.313 . . . . 0.0 113.138 161.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 -56.29 -64.74 0.76 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 170.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 20' ' ' LEU . . . . . 0.477 HD13 ' HA ' ' C' ' 20' ' ' LEU . 4.4 mm? -57.7 -33.08 68.01 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.901 2.08 . . . . 0.0 106.342 -175.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -66.74 -36.12 81.71 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 112.721 -3.514 . . . . 0.0 115.995 167.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -64.78 -37.57 88.05 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 122.747 2.521 . . . . 0.0 107.329 169.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.57 -23.38 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 O-C-N 116.647 -3.783 . . . . 0.0 111.521 176.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -83.6 -40.94 18.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 172.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 32.0 tp -56.13 -41.77 75.85 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 119.268 0.94 . . . . 0.0 111.674 171.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 37.3 tp -72.67 -31.58 65.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 123.962 1.839 . . . . 0.0 113.101 -177.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -83.81 -18.71 36.73 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 119.265 -2.147 . . . . 0.0 114.285 176.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -74.27 -38.87 63.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 116.665 -1.636 . . . . 0.0 112.714 160.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.3 -21.68 62.91 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.13 -5.76 37.81 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 120.34 1.427 . . . . 0.0 108.435 173.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -80.1 -38.55 31.42 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 121.936 2.153 . . . . 0.0 111.473 -176.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . 0.277 25.2 p-10 -120.5 33.11 5.71 Favored 'General case' 0 N--CA 1.451 -0.406 1 O-C-N 115.528 -4.483 . . . . 0.0 116.034 169.89 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 61.48 33.6 18.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 131.097 3.759 . . . . 0.0 117.499 171.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 42.0 mt -103.32 10.22 37.61 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.759 1.623 . . . . 0.0 109.593 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -74.04 -32.62 63.41 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 118.384 -2.698 . . . . 0.0 114.601 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 11.3 mt -78.04 -42.57 2.18 Favored Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-O 116.278 -1.82 . . . . 0.0 108.839 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -59.45 -34.64 97.23 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 CA-C-O 115.306 -2.039 . . . . 0.0 113.578 166.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 14.3 tp -61.66 -43.77 98.23 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.768 1.918 . . . . 0.0 113.654 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -67.01 -25.51 66.33 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 173.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -75.14 -19.08 60.07 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 169.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 38.2 tp -84.2 -55.17 4.33 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 126.027 2.079 . . . . 0.0 113.672 168.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 9.1 mmt -73.93 -24.41 59.66 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 119.13 -2.232 . . . . 0.0 110.973 -162.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 11.1 mp -127.25 132.6 50.33 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 129.743 3.217 . . . . 0.0 111.623 -171.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -73.06 157.23 88.81 Favored Pre-proline 0 N--CA 1.448 -0.532 0 C-N-CA 125.787 1.635 . . . . 0.0 108.622 172.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -45.94 -32.44 9.54 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 121.393 1.396 . . . . 0.0 113.451 168.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -39.88 87.35 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 122.097 0.951 . . . . 0.0 113.368 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -72.76 -47.12 49.47 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 129.797 3.239 . . . . 0.0 109.919 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 48' ' ' ARG . . . . . 0.465 ' HD2' ' CZ2' ' D' ' 19' ' ' TRP . 58.0 mtm-85 -56.95 -41.54 78.47 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 175.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -70.69 -33.08 70.52 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 172.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.16 -39.58 82.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 171.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 20.9 mt -61.84 -33.2 73.74 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 122.238 2.29 . . . . 0.0 113.612 167.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.42 -27.32 73.84 Favored Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.834 171.291 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 93.8 m -82.18 -43.61 17.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.034 -2.45 . . . . 0.0 112.131 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -57.25 -36.61 71.18 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 114.214 -2.803 . . . . 0.0 115.298 169.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 22.1 t -51.05 -44.53 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-O 113.585 -3.102 . . . . 0.0 113.926 162.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 16.0 mtp180 -62.14 -28.51 69.69 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 124.698 3.408 . . . . 0.0 112.846 171.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 67.7 mt -80.93 -32.88 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 C-N-CA 119.297 -0.961 . . . . 0.0 111.577 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 92.4 t -66.98 -48.97 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 117.593 -1.194 . . . . 0.0 110.801 165.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -58.47 -50.77 72.55 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -177.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -66.81 -37.01 83.69 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 115.385 -2.245 . . . . 0.0 111.107 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 94.1 mt -70.0 -21.46 63.21 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 116.844 2.164 . . . . 0.0 116.844 173.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 19.7 mt -78.49 -23.69 46.27 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 169.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -71.48 -44.6 64.42 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.874 -2.391 . . . . 0.0 110.868 168.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 65.76 22.78 70.35 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-O 125.235 2.575 . . . . 0.0 116.87 174.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -99.03 -21.52 16.17 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 117.964 -3.08 . . . . 0.0 111.077 -176.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 12.0 mtt -71.89 127.19 31.76 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 120.529 -1.357 . . . . 0.0 112.223 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 60.4 p -74.64 163.01 28.2 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 126.146 2.154 . . . . 0.0 111.382 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -37.89 -41.9 0.57 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 116.191 1.923 . . . . 0.0 116.191 171.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 31.8 ttp-105 -60.75 -48.41 81.9 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 121.912 0.863 . . . . 0.0 111.687 176.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -67.47 -34.17 76.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.97 2.108 . . . . 0.0 106.565 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 68.5 mt -68.72 -30.94 69.68 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 119.069 -2.269 . . . . 0.0 111.82 172.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 39.7 tttp -73.99 -42.34 60.57 Favored 'General case' 0 N--CA 1.453 -0.283 1 O-C-N 115.093 -4.754 . . . . 0.0 116.341 170.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -76.13 -21.6 56.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.84 1.256 . . . . 0.0 109.535 -170.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -124.69 -39.71 2.27 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 117.422 -1.275 . . . . 0.0 114.238 -170.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.326 5.6 mp -102.01 -15.56 16.75 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 115.869 -2.015 . . . . 0.0 109.588 -168.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 76' ' ' GLY . . . . . 0.425 ' O ' HG22 ' C' ' 79' ' ' ILE . . . 48.2 -131.11 19.58 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 128.433 2.921 . . . . 0.0 117.328 158.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.25 -22.28 33.1 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.575 -2.133 . . . . 0.0 111.926 -174.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.23 -15.13 81.85 Favored Glycine 0 CA--C 1.523 0.588 0 C-N-CA 127.065 2.269 . . . . 0.0 112.032 -169.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 79' ' ' ILE . . . . . 0.425 HG22 ' O ' ' C' ' 76' ' ' GLY . 17.5 tt -58.64 -33.84 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 125.535 1.534 . . . . 0.0 110.155 -178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.6 -32.7 74.19 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 120.897 -1.127 . . . . 0.0 113.505 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 2.9 m -62.79 -44.03 97.23 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 117.462 -3.274 . . . . 0.0 109.454 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 39.0 mm -88.36 -18.26 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 129.385 3.074 . . . . 0.0 112.054 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 71.7 p -110.93 -11.05 14.37 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 120.701 3.593 . . . . 0.0 120.701 174.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 43.3 mtp85 -115.29 156.1 26.07 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.426 -3.296 . . . . 0.0 113.335 174.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.86 172.22 45.61 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 128.034 2.73 . . . . 0.0 112.783 -177.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 97.2 p -89.86 10.08 25.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 116.976 -3.661 . . . . 0.0 117.776 -176.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -104.55 0.85 29.13 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 118.002 -2.936 . . . . 0.0 114.215 161.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 99.9 p -59.23 172.83 0.55 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 126.459 3.028 . . . . 0.0 115.753 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 26.5 tp -70.72 -12.44 61.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 111.015 -2.811 . . . . 0.0 111.3 -170.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -124.02 0.98 8.58 Favored 'General case' 0 N--CA 1.451 -0.376 1 O-C-N 116.262 -4.024 . . . . 0.0 110.328 177.279 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -113.36 -21.33 10.96 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 121.535 3.902 . . . . 0.0 121.535 173.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.42 157.78 4.62 Favored Pre-proline 0 N--CA 1.452 -0.352 0 C-N-CA 129.499 3.12 . . . . 0.0 112.994 170.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -56.98 129.05 32.47 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 N-CA-C 114.389 0.88 . . . . 0.0 114.389 173.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 61.8 t -59.78 -30.84 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 C-N-CA 128.907 2.883 . . . . 0.0 112.0 -162.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -62.59 -24.42 67.55 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 176.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 4.6 tp -68.35 -55.77 10.87 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 115.594 -2.146 . . . . 0.0 110.136 168.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 59.6 mtp180 -48.49 -40.79 27.83 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 128.593 2.757 . . . . 0.0 108.589 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -70.89 -52.84 17.71 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.613 1.965 . . . . 0.0 112.46 -179.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 32.8 t90 -46.7 -40.71 13.79 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 116.833 -3.667 . . . . 0.0 117.829 168.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 27.9 mt -75.46 -22.02 57.64 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.237 -175.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -78.64 -34.34 46.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 117.696 -1.145 . . . . 0.0 108.658 172.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -68.94 -18.57 64.11 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 125.245 1.418 . . . . 0.0 110.869 -178.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 96.9 t -105.58 -40.77 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 C-N-CA 127.819 2.448 . . . . 0.0 115.808 -177.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -103.51 -16.37 15.58 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 128.743 2.817 . . . . 0.0 111.728 -167.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 23.9 mt -120.44 -3.47 9.91 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 121.317 1.871 . . . . 0.0 112.427 -177.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 58.9 pttt . . . . . 0 N--CA 1.451 -0.391 0 O-C-N 118.242 -2.786 . . . . 0.0 117.754 -171.739 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 66.9 p . . . . . 0 N--CA 1.446 -0.625 0 CA-C-O 114.699 -2.572 . . . . 0.0 115.084 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -61.96 -19.55 66.39 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 CA-C-N 122.709 2.003 . . . . 0.0 117.239 172.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . 0.354 49.5 t80 -173.78 148.1 1.43 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.386 2.274 . . . . 0.0 106.804 171.088 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 11.9 t -62.19 128.64 37.07 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 103.236 -2.875 . . . . 0.0 103.236 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.42 -25.26 61.41 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 112.826 -1.988 . . . . 0.0 111.205 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.93 -36.4 83.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 119.072 -2.267 . . . . 0.0 114.457 165.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -66.63 -33.91 76.71 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 177.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . 0.28 . . -60.86 -35.41 76.51 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 118.257 -2.777 . . . . 0.0 109.602 175.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -70.85 -50.88 30.49 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.292 -2.13 . . . . 0.0 106.726 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -54.77 -46.23 74.37 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.28 2.232 . . . . 0.0 108.15 -170.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -31.36 71.32 Favored 'General case' 0 N--CA 1.45 -0.459 1 O-C-N 115.872 -4.268 . . . . 0.0 110.647 -168.594 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.6 t60 -76.56 -27.67 55.98 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 164.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -67.67 -33.21 74.47 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 118.017 -2.927 . . . . 0.0 116.139 169.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -74.99 -26.55 59.65 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 128.833 2.853 . . . . 0.0 115.196 167.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 19' ' ' TRP . . . . . 0.465 ' CZ2' ' HD2' ' C' ' 48' ' ' ARG . 5.1 t-105 -70.58 -48.26 56.13 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 116.939 -3.6 . . . . 0.0 110.371 165.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 93.6 mt -68.56 -25.22 64.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 120.52 -1.363 . . . . 0.0 110.14 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 17.4 ttt180 -62.37 -33.97 75.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 118.047 -0.978 . . . . 0.0 112.039 168.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . 0.451 88.1 t80 -70.68 -36.56 73.38 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 171.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.99 -45.47 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 O-C-N 119.144 -2.223 . . . . 0.0 110.396 172.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -74.91 -33.48 62.02 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 118.033 2.605 . . . . 0.0 118.033 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 17.3 tp -60.62 -43.05 97.92 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 124.353 2.025 . . . . 0.0 111.099 167.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 42.3 tp -60.91 -44.0 97.77 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 118.272 -2.767 . . . . 0.0 109.546 175.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -59.36 -55.62 32.46 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 120.092 1.315 . . . . 0.0 107.89 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -58.14 -30.56 66.43 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 126.483 2.364 . . . . 0.0 115.858 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.34 -24.95 62.2 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.899 0.88 . . . . 0.0 112.048 175.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -76.81 -26.16 54.1 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 119.516 1.053 . . . . 0.0 110.428 168.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -84.54 -19.06 33.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 118.185 -2.822 . . . . 0.0 113.421 -176.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 53.7 p30 -114.97 10.38 16.27 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 114.889 1.441 . . . . 0.0 114.889 172.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 49.63 42.42 23.19 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.601 1.188 . . . . 0.0 112.024 -176.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 47.1 mt -102.03 11.99 37.56 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 121.476 1.944 . . . . 0.0 112.824 167.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . 0.366 0.0 OUTLIER -49.71 -67.16 0.28 Allowed 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 119.876 3.287 . . . . 0.0 119.876 177.296 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 6.2 mt -58.2 -48.63 96.69 Favored Pre-proline 0 N--CA 1.449 -0.505 0 CA-C-O 114.745 -2.55 . . . . 0.0 110.554 -177.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.33 -25.49 71.45 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 CA-C-N 125.36 2.95 . . . . 0.0 112.912 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 14.8 tp -79.48 -40.23 30.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 125.535 3.789 . . . . 0.0 116.575 177.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 89.0 mt -68.34 -42.56 79.11 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 11.8 m-20 -71.5 -28.21 63.75 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 113.844 -2.979 . . . . 0.0 117.009 177.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 28.1 tp -57.6 -52.1 66.8 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 114.063 -2.875 . . . . 0.0 114.149 156.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 19.4 mmt -75.88 -25.66 56.32 Favored 'General case' 0 N--CA 1.448 -0.529 1 C-N-CA 131.823 4.049 . . . . 0.0 117.704 -173.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 14.6 mt -132.95 129.63 38.52 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 126.012 2.07 . . . . 0.0 110.476 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 71.6 p -77.25 167.23 38.21 Favored Pre-proline 0 N--CA 1.451 -0.412 0 CA-C-O 114.927 -2.463 . . . . 0.0 109.369 -167.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -45.23 -42.18 16.88 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 O-C-N 125.938 2.546 . . . . 0.0 116.15 -173.359 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -92.01 -7.65 48.28 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.765 1.626 . . . . 0.0 111.387 -169.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -88.5 -36.17 16.58 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 168.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -66.48 -38.64 87.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 127.199 2.2 . . . . 0.0 111.864 169.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -79.35 -37.39 37.55 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 119.747 -1.846 . . . . 0.0 108.955 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -49.44 -58.71 4.65 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 121.812 2.097 . . . . 0.0 108.93 163.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 49.0 mt -64.13 -44.09 93.25 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 117.786 -3.071 . . . . 0.0 111.406 -165.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -33.64 -50.3 0.57 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-O 114.48 -3.4 . . . . 0.0 121.551 149.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 28.7 m -73.57 -29.71 62.58 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 120.944 2.372 . . . . 0.0 109.262 177.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 54' ' ' ARG . . . . . 0.555 ' HA ' HD12 ' D' ' 57' ' ' ILE 0.262 96.9 mtt180 -64.42 -28.66 69.83 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 120.509 -1.369 . . . . 0.0 113.573 -176.676 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 10.8 t -56.62 -51.86 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 120.6 1.545 . . . . 0.0 112.037 162.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -77.08 -11.06 59.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 117.227 -1.789 . . . . 0.0 113.905 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 57' ' ' ILE . . . . . 0.555 HD12 ' HA ' ' D' ' 54' ' ' ARG . 36.9 mt -74.91 -47.73 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 122.223 2.283 . . . . 0.0 105.804 175.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 58' ' ' VAL . . . . . 0.408 HG22 HG23 ' D' ' 82' ' ' ILE . 91.3 t -65.03 -41.61 92.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 173.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -56.26 -31.18 63.34 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.684 -2.51 . . . . 0.0 115.204 173.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -84.56 -29.69 25.67 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 120.34 1.427 . . . . 0.0 114.543 -176.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 25.0 mt -67.06 -20.46 65.83 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.999 1.719 . . . . 0.0 113.628 161.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 27.6 mt -94.64 -21.22 18.94 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 120.118 -1.614 . . . . 0.0 111.559 171.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . 0.256 32.0 ttm180 -79.95 -40.46 28.03 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.898 0.856 . . . . 0.0 111.295 176.014 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 73.24 6.63 69.84 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 127.652 2.548 . . . . 0.0 117.98 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -93.48 -32.8 14.05 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 124.872 0.983 . . . . 0.0 113.304 -170.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 39.0 mtt -80.28 42.54 0.58 Allowed 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 127.383 3.468 . . . . 0.0 114.03 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 89.0 p -67.86 163.0 22.89 Favored 'General case' 0 N--CA 1.446 -0.669 1 O-C-N 115.664 -4.398 . . . . 0.0 113.966 -176.051 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 67.83 -55.21 0.49 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 114.564 -2.636 . . . . 0.0 115.917 163.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 ttt85 -125.05 -29.27 3.34 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 122.327 2.33 . . . . 0.0 116.49 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -77.16 -37.32 54.09 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 118.346 -2.721 . . . . 0.0 111.081 -173.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 11.7 mt -53.71 -30.34 43.43 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.0 1.857 . . . . 0.0 115.405 168.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -91.73 -7.24 50.3 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -136.18 -17.43 1.59 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 114.926 -2.464 . . . . 0.0 117.65 -175.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 74' ' ' GLU . . . . . 0.436 ' HB3' HD22 ' D' ' 75' ' ' LEU . 5.4 tp10 -90.59 -35.43 15.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 126.549 2.405 . . . . 0.0 112.015 163.062 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 75' ' ' LEU . . . . . 0.51 HD22 ' N ' ' D' ' 75' ' ' LEU 0.307 1.4 mm? -94.61 -57.2 2.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 127.352 2.261 . . . . 0.0 116.215 172.382 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.65 -162.83 44.43 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 116.249 -2.417 . . . . 0.0 114.612 174.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -33.3 -32.93 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 130.159 4.094 . . . . 0.0 118.084 -157.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.01 -19.43 56.7 Favored Glycine 0 C--N 1.337 0.632 1 C-N-CA 131.316 4.294 . . . . 0.0 110.491 174.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . 0.256 0.9 OUTLIER -58.65 -29.94 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 121.655 2.728 . . . . 0.0 114.778 175.508 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.62 -12.86 60.04 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 116.591 -1.671 . . . . 0.0 111.731 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 14.4 m -71.76 -37.16 70.54 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 118.322 2.712 . . . . 0.0 118.322 158.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 82' ' ' ILE . . . . . 0.408 HG23 HG22 ' D' ' 58' ' ' VAL . 25.8 mm -82.93 -27.06 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 CA-C-N 113.645 -1.616 . . . . 0.0 111.573 -173.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 71.5 p -102.31 -19.03 15.17 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 127.261 2.224 . . . . 0.0 110.625 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.322 16.3 mtp180 -119.79 154.25 34.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.297 -2.752 . . . . 0.0 113.531 178.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 109.38 146.41 11.49 Favored Glycine 0 C--N 1.338 0.692 0 C-N-CA 119.922 -1.132 . . . . 0.0 111.355 -159.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 84.5 p -72.68 -21.62 61.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 129.606 3.163 . . . . 0.0 112.907 -160.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -130.09 38.78 3.75 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 128.344 3.527 . . . . 0.0 113.397 175.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 29.1 p -57.46 169.59 0.63 Allowed 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 127.365 2.916 . . . . 0.0 117.374 173.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.373 0.7 OUTLIER -65.77 -3.48 5.0 Favored 'General case' 0 C--O 1.223 -0.297 1 O-C-N 115.59 -4.444 . . . . 0.0 119.443 159.122 . . . . . . . . 4 3 . 1 . 005 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 66.2 tttt -76.68 -22.83 53.45 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 126.957 2.661 . . . . 0.0 114.625 162.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -105.21 -39.89 6.04 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 131.638 3.975 . . . . 0.0 115.448 -152.368 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 92' ' ' ALA . . . . . 0.628 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 55.33 85.49 0.19 Allowed Pre-proline 0 N--CA 1.448 -0.569 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 167.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 93' ' ' PRO . . . . . 0.628 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.357 0.0 OUTLIER 33.95 33.11 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.21 0 C-N-CA 119.468 -3.138 . . . . 0.0 118.857 40.047 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 91.8 t -65.32 -28.81 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 O-C-N 125.837 1.961 . . . . 0.0 107.215 -170.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 95' ' ' GLU . . . . . 0.519 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.263 0.1 OUTLIER -81.82 -42.78 19.18 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 130.066 3.346 . . . . 0.0 109.979 -170.131 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 9.0 tp -63.26 -40.99 98.97 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 118.501 0.591 . . . . 0.0 111.95 165.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 -55.53 -53.59 54.46 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 116.823 -1.56 . . . . 0.0 115.193 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -57.65 -34.63 69.56 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 126.192 2.183 . . . . 0.0 114.41 177.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 59.5 t90 -75.74 -45.51 36.09 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 117.932 -2.98 . . . . 0.0 111.74 175.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 94.1 mt -55.99 -37.13 68.7 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 118.597 -2.564 . . . . 0.0 114.541 174.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -70.8 -21.24 62.5 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 -174.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -89.37 -48.99 6.97 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 123.674 1.702 . . . . 0.0 111.398 171.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 89.7 t -63.17 -38.78 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 O-C-N 118.261 -2.774 . . . . 0.0 113.136 178.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 75.6 mt -84.94 -20.74 30.19 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 115.716 -2.394 . . . . 0.0 114.561 -174.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 55.0 mt -93.86 5.38 51.84 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 124.943 2.306 . . . . 0.0 116.078 177.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 19.1 pttp -60.93 147.28 43.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.657 1.983 . . . . 0.0 107.481 -172.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 34.3 m -65.88 -29.0 69.37 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 119.505 3.15 . . . . 0.0 119.505 -171.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 . . . . . 0 C--O 1.252 1.226 0 O-C-N 118.701 -2.5 . . . . 0.0 113.838 166.541 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.8 ttp . . . . . 0 N--CA 1.451 -0.415 0 N-CA-C 117.31 2.337 . . . . 0.0 117.31 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.04 -40.52 73.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 173.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -77.67 -39.8 43.73 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -42.23 -40.72 2.5 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 128.313 2.645 . . . . 0.0 113.048 168.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 67.0 mmt-85 -79.87 -25.71 40.58 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 125.401 1.688 . . . . 0.0 114.716 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 29.8 t60 -70.58 -39.16 74.04 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 121.63 2.014 . . . . 0.0 111.295 171.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -55.41 -43.13 74.99 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.108 1.363 . . . . 0.0 110.119 172.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -65.1 -37.47 87.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 118.362 2.727 . . . . 0.0 118.362 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 41.9 t-105 -65.94 -47.88 73.21 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.606 169.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 69.6 mt -57.68 -38.33 74.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 120.56 1.527 . . . . 0.0 109.693 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 43.5 ttt180 -62.75 -36.46 83.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 121.221 1.828 . . . . 0.0 114.658 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -61.76 -41.79 98.14 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 121.195 1.816 . . . . 0.0 108.8 173.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.5 t -67.42 -49.77 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 121.477 1.944 . . . . 0.0 105.912 -173.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -71.15 -32.27 68.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 118.997 -2.314 . . . . 0.0 113.899 -177.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 19.4 tp -55.68 -49.49 72.81 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.524 -2.61 . . . . 0.0 109.169 167.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.09 -31.3 72.44 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 118.649 -2.532 . . . . 0.0 114.331 176.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -57.96 -51.82 68.06 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.801 1.778 . . . . 0.0 115.801 169.156 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -60.8 -39.43 88.91 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 126.156 1.782 . . . . 0.0 112.93 173.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.72 -48.85 76.84 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 115.054 -2.403 . . . . 0.0 114.845 163.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -55.89 -43.42 77.23 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 124.338 3.244 . . . . 0.0 113.85 172.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -70.55 -21.23 62.73 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 125.071 1.482 . . . . 0.0 114.613 -177.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -95.7 5.87 50.32 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 118.95 2.945 . . . . 0.0 118.95 165.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.398 6.0 m-20 71.59 35.59 1.42 Allowed 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 118.467 -2.646 . . . . 0.0 113.769 -172.108 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.268 49.1 mt -125.61 14.26 8.13 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 119.975 -1.703 . . . . 0.0 112.86 -167.282 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -73.97 -41.73 61.53 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 118.715 -2.49 . . . . 0.0 114.81 -172.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.5 mt -64.58 -52.77 49.82 Favored Pre-proline 0 N--CA 1.448 -0.554 0 O-C-N 125.571 1.794 . . . . 0.0 110.386 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -71.67 -20.28 26.81 Favored 'Trans proline' 0 N--CA 1.448 -1.19 0 CA-C-N 121.132 1.44 . . . . 0.0 111.287 -170.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.6 tp -71.22 -56.62 5.68 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 129.132 2.973 . . . . 0.0 109.278 173.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.3 mt -61.3 -30.68 70.63 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 120.074 -1.641 . . . . 0.0 110.04 176.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -67.32 -10.87 55.19 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 117.055 -3.528 . . . . 0.0 113.977 176.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.4 tt -102.96 -36.94 8.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.448 1.499 . . . . 0.0 113.442 173.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 79.9 mmm -78.87 -33.16 46.04 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 127.733 2.413 . . . . 0.0 117.293 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.8 mt -119.03 143.05 47.3 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.948 2.899 . . . . 0.0 112.148 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.7 p -82.91 167.13 31.63 Favored Pre-proline 0 N--CA 1.45 -0.444 0 CA-C-O 115.748 -2.073 . . . . 0.0 114.44 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . 0.443 65.4 Cg_exo -47.24 -60.58 0.83 Allowed 'Trans proline' 0 N--CA 1.45 -1.083 0 N-CA-C 119.935 3.014 . . . . 0.0 119.935 -172.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -67.55 -6.15 18.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 119.585 3.18 . . . . 0.0 119.585 168.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -84.21 -49.28 8.96 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.061 2.209 . . . . 0.0 108.017 170.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.4 mtm-85 -46.34 -45.86 17.85 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.022 2.129 . . . . 0.0 112.861 163.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.24 -46.18 78.04 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.953 1.408 . . . . 0.0 112.279 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.88 -41.43 87.1 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 130.321 3.448 . . . . 0.0 109.071 170.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.1 mt -54.76 -34.42 62.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 124.552 3.342 . . . . 0.0 112.88 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.05 -49.26 76.85 Favored Glycine 0 N--CA 1.446 -0.66 1 C-N-CA 131.72 4.486 . . . . 0.0 113.282 168.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.9 m -70.87 -34.37 71.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.692 1.197 . . . . 0.0 109.551 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -61.38 -37.18 82.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 117.178 2.288 . . . . 0.0 117.178 177.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.5 t -59.29 -38.9 77.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 125.33 1.452 . . . . 0.0 109.188 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.2 mtp180 -66.34 -31.91 72.98 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 128.389 2.675 . . . . 0.0 111.921 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 85.8 mt -77.29 -35.67 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 125.865 1.666 . . . . 0.0 110.49 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.48 HG21 ' CE ' ' B' ' 42' ' ' MET . 71.8 t -67.02 -46.16 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-O 117.144 -1.408 . . . . 0.0 107.768 170.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -64.9 -36.53 84.68 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 121.219 1.827 . . . . 0.0 108.422 -170.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -84.59 -29.82 25.51 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.862 -2.399 . . . . 0.0 111.843 -175.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.277 50.0 mt -69.56 -31.53 69.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 118.432 -2.667 . . . . 0.0 113.046 164.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tt -77.54 -37.27 51.19 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 117.033 -1.867 . . . . 0.0 112.152 172.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -69.06 -31.16 69.72 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 128.261 2.624 . . . . 0.0 115.733 176.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.63 -23.73 8.42 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 121.203 3.241 . . . . 0.0 121.203 164.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -64.89 -51.29 62.77 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 176.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 37.8 ttm -90.94 135.9 33.43 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 -155.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 83.8 p -107.94 170.53 7.94 Favored 'General case' 0 CA--C 1.52 -0.191 0 O-C-N 119.499 -2.001 . . . . 0.0 113.627 -166.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -35.17 -61.55 0.42 Allowed 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 124.879 2.276 . . . . 0.0 110.582 -176.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.0 tpt85 -67.14 -14.98 63.43 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.57 3.148 . . . . 0.0 115.455 -174.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -97.93 -46.89 5.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 128.003 3.314 . . . . 0.0 109.608 175.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.2 mt -50.25 -40.17 47.05 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.3 tptp -46.68 -50.61 17.55 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 111.901 -2.409 . . . . 0.0 114.686 164.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -78.95 -24.89 43.64 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.839 2.056 . . . . 0.0 111.646 -177.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -103.01 -26.71 12.98 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 -171.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 37.1 mt -130.35 0.21 4.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.305 -2.747 . . . . 0.0 113.859 -173.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.57 4.2 17.6 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-N 111.936 -2.393 . . . . 0.0 113.868 -164.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.13 123.16 26.55 Favored 'General case' 0 N--CA 1.449 -0.517 1 O-C-N 115.895 -4.297 . . . . 0.0 110.487 -168.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.78 166.79 45.41 Favored Glycine 0 CA--C 1.524 0.595 1 CA-C-O 128.388 4.327 . . . . 0.0 113.392 173.124 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 60.3 mt -65.48 -27.44 41.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 110.73 -2.735 . . . . 0.0 109.805 -172.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.73 -37.59 73.5 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 120.414 1.461 . . . . 0.0 111.744 -175.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.6 p -86.94 -16.56 35.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.267 40.8 mm -71.07 -56.5 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 C-N-CA 129.939 3.296 . . . . 0.0 108.978 162.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.4 m -53.71 -44.47 69.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 121.573 1.988 . . . . 0.0 116.219 175.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.5 ttt180 -70.85 -54.59 10.98 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 123.142 1.449 . . . . 0.0 108.928 174.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -51.75 -25.74 15.87 Favored Glycine 0 C--N 1.337 0.608 0 O-C-N 118.647 -2.533 . . . . 0.0 116.797 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.3 m -75.59 -48.28 22.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.805 2.842 . . . . 0.0 110.717 171.286 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -76.73 -25.04 53.08 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 124.142 0.901 . . . . 0.0 112.079 -176.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 74.8 m -70.19 -35.76 74.16 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 126.22 1.808 . . . . 0.0 115.201 163.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 tp -68.49 -33.38 74.04 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 116.277 -4.014 . . . . 0.0 113.839 167.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -70.37 -43.01 71.03 Favored 'General case' 0 N--CA 1.45 -0.463 1 O-C-N 115.944 -4.223 . . . . 0.0 111.388 175.129 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.01 -11.22 27.03 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 174.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.421 ' HB1' HD23 ' A' ' 96' ' ' LEU . . . -60.86 157.12 42.16 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -61.2 153.23 66.43 Favored 'Trans proline' 0 N--CA 1.449 -1.09 1 C-N-CA 128.6 6.2 . . . . 0.0 115.27 160.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 31.2 m -78.7 -29.92 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 117.399 -1.72 . . . . 0.0 115.63 -165.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -61.38 -28.02 68.94 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.975 3.31 . . . . 0.0 112.651 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.421 HD23 ' HB1' ' A' ' 92' ' ' ALA . 30.0 tp -65.61 -48.72 71.31 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.921 2.088 . . . . 0.0 111.106 178.427 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 80.0 mtm-85 -74.98 -35.98 62.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.117 -2.864 . . . . 0.0 113.946 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -70.04 -17.8 63.27 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 119.079 -2.263 . . . . 0.0 110.519 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 43.8 t90 -91.09 -44.86 9.02 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 85.2 mt -57.88 -38.16 75.27 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -41.55 -41.46 2.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 119.297 3.073 . . . . 0.0 119.297 159.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -96.84 -26.71 15.01 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 123.018 1.39 . . . . 0.0 109.85 -162.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.5 t -86.35 -44.07 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 128.902 2.881 . . . . 0.0 111.531 174.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.6 mt -89.37 -45.1 9.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.766 -1.834 . . . . 0.0 114.611 -171.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.1 mt -103.2 -26.4 13.0 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -167.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? . . . . . 0 N--CA 1.447 -0.583 0 O-C-N 119.688 -1.883 . . . . 0.0 111.911 177.973 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.383 0 CA-C-O 115.068 -2.396 . . . . 0.0 113.649 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 19.4 mtt -69.07 -35.24 76.31 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 126.983 2.677 . . . . 0.0 111.79 168.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.9 -32.25 69.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 122.565 2.438 . . . . 0.0 109.174 -175.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -73.51 -30.84 63.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 116.056 -1.926 . . . . 0.0 108.09 174.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -76.92 -31.47 56.69 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.794 1.179 . . . . 0.0 109.007 -175.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -71.0 -31.05 67.47 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 127.71 2.404 . . . . 0.0 113.517 173.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 45.3 t60 -66.61 -36.09 81.76 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.933 1.693 . . . . 0.0 112.186 164.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -83.63 -10.54 58.15 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 118.8 -2.437 . . . . 0.0 113.678 174.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -90.36 -23.31 21.13 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 118.3 -2.75 . . . . 0.0 110.12 171.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 1.8 t-105 -76.52 -34.96 58.55 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 120.097 1.317 . . . . 0.0 112.378 167.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 19.5 mt -70.11 -9.98 57.28 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 119.06 -1.056 . . . . 0.0 112.631 175.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -79.38 -32.28 43.07 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 129.024 2.93 . . . . 0.0 115.944 162.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -68.16 -29.84 68.81 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 115.066 -2.654 . . . . 0.0 112.939 163.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 98.1 t -73.37 -43.75 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 120.897 -1.127 . . . . 0.0 113.812 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -60.31 -52.72 64.05 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 171.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 14.4 tp -58.24 -34.87 70.92 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 114.737 -2.554 . . . . 0.0 110.994 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 55.5 tp -64.2 -57.07 10.57 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 128.762 2.825 . . . . 0.0 108.396 176.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.417 ' HE3' HE22 ' B' ' 31' ' ' GLN . 33.7 ttpt -47.04 -53.24 13.04 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 119.102 -2.249 . . . . 0.0 115.396 167.254 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -56.09 -40.82 74.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 117.7 -1.6 . . . . 0.0 110.507 177.2 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.28 -35.05 76.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.368 1.08 . . . . 0.0 113.471 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -60.61 -47.27 86.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 127.249 2.219 . . . . 0.0 111.963 173.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.417 HE22 ' HE3' ' B' ' 27' ' ' LYS . 40.8 mt-30 -56.87 -24.5 52.14 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 170.444 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -108.73 -3.45 17.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 131.264 3.825 . . . . 0.0 112.933 -171.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 61.17 35.67 18.4 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 126.463 2.352 . . . . 0.0 117.29 -174.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.8 mt -123.35 12.82 9.48 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 127.645 2.378 . . . . 0.0 116.219 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -59.9 -38.2 81.59 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 119.39 3.107 . . . . 0.0 119.39 175.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 2.0 mt -71.96 -48.15 11.11 Favored Pre-proline 0 N--CA 1.451 -0.414 0 O-C-N 124.728 1.268 . . . . 0.0 114.421 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -63.21 -27.83 72.73 Favored 'Trans proline' 0 N--CA 1.447 -1.218 0 C-N-CA 123.971 3.114 . . . . 0.0 112.528 172.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.6 tp -67.26 -47.26 71.25 Favored 'General case' 0 N--CA 1.449 -0.522 1 O-C-N 115.007 -4.808 . . . . 0.0 112.883 167.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 89.2 mt -65.43 -16.9 64.11 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.505 1.522 . . . . 0.0 115.066 170.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -81.92 -28.97 32.53 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 130.458 3.503 . . . . 0.0 110.332 166.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 60.5 tp -89.52 -26.24 20.99 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 118.776 -1.17 . . . . 0.0 112.956 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' MET . . . . . 0.48 ' CE ' HG21 ' A' ' 58' ' ' VAL 0.259 15.4 mmt -95.97 -16.37 21.74 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 119.408 3.114 . . . . 0.0 119.408 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 31.9 mt -123.68 143.94 49.95 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.232 2.613 . . . . 0.0 109.797 174.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 44' ' ' THR . . . . . 0.602 ' HB ' ' CD ' ' B' ' 45' ' ' PRO . 40.0 p -93.95 174.88 3.39 Favored Pre-proline 0 N--CA 1.452 -0.353 0 O-C-N 126.754 2.534 . . . . 0.0 112.134 177.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 45' ' ' PRO . . . . . 0.602 ' CD ' ' HB ' ' B' ' 44' ' ' THR . 37.4 Cg_exo -62.61 -46.42 11.6 Favored 'Trans proline' 0 N--CA 1.449 -1.1 0 CA-C-O 123.9 1.542 . . . . 0.0 112.714 -170.051 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -53.46 -40.6 65.4 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 116.108 -1.901 . . . . 0.0 115.329 172.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -75.36 -35.37 61.13 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 127.503 3.002 . . . . 0.0 117.305 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 43.9 mtm-85 -65.73 -47.93 73.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.245 2.218 . . . . 0.0 109.444 173.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -63.95 -35.86 82.08 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 176.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.98 -50.9 71.94 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.011 1.724 . . . . 0.0 113.629 160.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 30.6 mt -56.62 -45.59 81.43 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 116.396 -1.764 . . . . 0.0 107.531 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.51 -39.8 75.49 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-O 126.104 3.058 . . . . 0.0 119.717 174.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.5 m -74.61 -35.48 62.94 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 110.565 -2.817 . . . . 0.0 111.749 173.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . 0.305 96.6 mtt180 -56.58 -32.08 64.87 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 123.611 2.914 . . . . 0.0 112.971 170.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . 0.415 13.6 t -51.2 -51.46 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 120.619 1.554 . . . . 0.0 109.712 166.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -76.1 -33.09 59.49 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 117.308 2.336 . . . . 0.0 117.308 -174.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.43 ' HA ' HD13 ' B' ' 75' ' ' LEU . 42.1 mt -68.26 -39.62 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 CA-C-O 114.376 -2.726 . . . . 0.0 104.82 173.308 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.279 53.4 t -77.5 -35.44 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 1 CA-C-N 127.647 4.748 . . . . 0.0 112.08 -179.66 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -60.44 -34.0 73.35 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 125.736 2.684 . . . . 0.0 117.946 165.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -83.73 -33.73 25.02 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 114.185 -2.816 . . . . 0.0 107.84 -176.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 27.2 mt -43.15 -46.44 5.91 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 124.424 3.283 . . . . 0.0 114.43 157.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 17.1 mt -83.01 -21.09 33.97 Favored 'General case' 0 N--CA 1.451 -0.424 1 N-CA-C 122.756 4.354 . . . . 0.0 122.756 172.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 32.2 ttm105 -69.23 -49.22 58.4 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.83 47.36 8.68 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 118.417 2.127 . . . . 0.0 118.417 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . 0.284 66.4 mm-40 -117.66 -37.1 3.52 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 116.937 -1.506 . . . . 0.0 108.485 -171.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 90.8 mtp -100.12 123.3 44.2 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 123.623 2.92 . . . . 0.0 113.736 -162.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 97.4 p -64.18 162.66 14.07 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 125.077 1.486 . . . . 0.0 113.669 173.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -45.08 -33.66 2.25 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.659 1.984 . . . . 0.0 115.147 165.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -67.73 -52.01 42.55 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 127.062 3.315 . . . . 0.0 108.884 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -53.5 -48.12 69.25 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 118.073 -2.892 . . . . 0.0 116.237 173.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 59.8 mt -57.18 -39.22 74.91 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 123.316 1.532 . . . . 0.0 111.548 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 32.3 tptt -77.25 -51.79 10.32 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 112.036 -2.347 . . . . 0.0 109.724 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -82.54 -4.03 56.92 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 117.002 2.223 . . . . 0.0 117.002 -169.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -137.03 -12.02 1.69 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 113.241 -1.8 . . . . 0.0 111.442 -169.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' B' ' 57' ' ' ILE . 26.8 mt -134.53 7.73 3.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 113.388 -3.196 . . . . 0.0 111.74 177.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 60.65 16.66 46.07 Favored Glycine 0 CA--C 1.522 0.488 0 C-N-CA 129.742 3.544 . . . . 0.0 112.013 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.07 108.92 18.38 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 121.731 3.975 . . . . 0.0 121.731 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.0 175.54 53.07 Favored Glycine 0 CA--C 1.523 0.577 0 O-C-N 119.317 -2.114 . . . . 0.0 113.857 -174.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 6.4 mt -50.34 -43.16 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 O-C-N 120.061 -1.847 . . . . 0.0 115.361 176.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.76 -38.87 90.24 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.467 -2.645 . . . . 0.0 111.955 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 37.8 m -67.69 -52.04 42.56 Favored 'General case' 0 N--CA 1.444 -0.744 0 O-C-N 126.268 2.23 . . . . 0.0 109.223 -176.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 37.5 mm -65.91 -41.52 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-O 115.472 -2.204 . . . . 0.0 110.51 176.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 98.3 m -54.71 -65.63 0.54 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 124.034 3.107 . . . . 0.0 109.344 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -49.85 -42.03 46.57 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 117.215 2.302 . . . . 0.0 117.215 167.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -39.09 -60.86 1.51 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 118.634 2.214 . . . . 0.0 118.634 162.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 91.6 p -75.46 -21.06 58.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 128.902 2.881 . . . . 0.0 110.806 -175.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -71.54 -33.86 69.51 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 117.206 2.298 . . . . 0.0 117.206 163.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 2.4 m -72.7 -30.82 64.53 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 116.519 -1.705 . . . . 0.0 109.998 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 11.6 mt -59.59 -52.64 64.69 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 124.391 3.269 . . . . 0.0 116.473 166.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 50.5 tttm -63.81 -19.81 65.3 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -176.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.46 -22.1 32.68 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 114.842 -2.504 . . . . 0.0 116.892 167.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.99 151.01 97.58 Favored Pre-proline 0 N--CA 1.451 -0.394 0 CA-C-N 121.868 2.122 . . . . 0.0 114.629 -169.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . 0.274 52.4 Cg_exo -49.85 133.98 34.33 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 124.844 3.696 . . . . 0.0 114.154 163.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.418 HG12 ' NH1' ' B' ' 97' ' ' ARG . 22.4 m -73.41 -25.61 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -158.36 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 12.9 pm0 -62.09 -31.48 71.93 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 118.018 -0.992 . . . . 0.0 109.55 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 33.7 tp -74.27 -46.31 42.14 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 120.09 1.314 . . . . 0.0 107.472 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 97' ' ' ARG . . . . . 0.418 ' NH1' HG12 ' B' ' 94' ' ' VAL . 19.3 mtm-85 -59.26 -34.06 71.8 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -71.41 -27.28 63.19 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 30.3 t90 -81.78 -50.1 9.63 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 131.454 3.902 . . . . 0.0 111.978 173.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 40.0 mt -69.29 -19.71 63.9 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 116.518 -1.706 . . . . 0.0 115.55 -170.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -60.29 -36.6 78.25 Favored 'General case' 0 N--CA 1.452 -0.355 1 CA-C-O 111.663 -4.018 . . . . 0.0 114.91 174.062 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -86.17 -36.88 19.24 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 123.574 2.897 . . . . 0.0 112.422 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 37.5 t -49.97 -61.74 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 126.292 1.837 . . . . 0.0 108.566 169.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 80.4 mt -78.16 -48.62 15.52 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 118.168 -1.413 . . . . 0.0 111.13 -165.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 57.4 mt -88.86 27.86 1.26 Allowed 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.886 -2.384 . . . . 0.0 110.642 -164.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -130.01 7.42 5.1 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 128.244 2.618 . . . . 0.0 111.983 171.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 71.2 m -87.73 -9.4 54.14 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.347 2.659 . . . . 0.0 115.098 163.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.683 2.793 . . . . 0.0 109.596 168.636 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 44.4 ttm . . . . . 0 N--CA 1.474 0.732 0 CA-C-O 117.787 -1.102 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.38 136.77 57.44 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.421 1.488 . . . . 0.0 110.296 175.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -104.27 163.15 12.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.969 2.508 . . . . 0.0 112.951 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -158.72 146.08 17.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 116.914 -3.616 . . . . 0.0 108.896 -169.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 59.0 p -154.66 173.81 4.44 Favored Pre-proline 0 N--CA 1.452 -0.326 0 C-N-CA 127.796 2.439 . . . . 0.0 117.512 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -69.62 -29.6 24.27 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 120.926 1.084 . . . . 0.0 113.412 171.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -150.1 145.99 26.66 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.696 2.398 . . . . 0.0 111.763 -171.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t -153.44 129.25 10.16 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 170.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.41 -24.98 67.7 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 114.783 -2.532 . . . . 0.0 112.138 176.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.27 -21.72 66.29 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 116.521 -1.704 . . . . 0.0 114.867 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 58.9 mtt -85.77 -34.35 21.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 127.179 2.799 . . . . 0.0 109.386 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.09 -33.06 75.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 123.347 1.546 . . . . 0.0 110.565 173.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -78.22 -23.75 47.32 Favored 'General case' 0 N--CA 1.449 -0.495 1 O-C-N 115.375 -4.578 . . . . 0.0 114.294 178.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -84.2 -38.11 20.99 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.685 -1.15 . . . . 0.0 111.797 175.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -37.78 82.42 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 118.603 0.638 . . . . 0.0 112.174 169.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -59.58 -35.68 74.76 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 116.637 -2.025 . . . . 0.0 113.762 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -75.04 -35.93 61.88 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 130.002 3.321 . . . . 0.0 110.056 -176.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -67.9 -50.53 55.68 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.559 1.144 . . . . 0.0 111.796 173.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 17.5 t-105 -58.39 -46.09 87.05 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 117.673 2.471 . . . . 0.0 117.673 167.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -66.11 -21.94 66.38 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 113.607 -3.092 . . . . 0.0 114.279 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -60.67 -44.76 96.1 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 122.148 2.249 . . . . 0.0 112.947 165.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -57.0 -44.03 82.33 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 128.108 2.563 . . . . 0.0 105.321 -176.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 34.2 t -67.2 -34.24 68.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 116.828 -1.558 . . . . 0.0 113.682 -177.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -84.19 -43.53 14.85 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 125.859 1.974 . . . . 0.0 109.139 -172.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 21.1 tp -56.97 -37.47 71.62 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 117.159 -1.4 . . . . 0.0 109.779 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 17.1 tp -76.83 -31.84 57.16 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 120.014 1.279 . . . . 0.0 109.529 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -59.2 -46.14 89.2 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 126.725 2.01 . . . . 0.0 114.989 169.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -60.96 -36.86 80.51 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 129.768 3.227 . . . . 0.0 113.644 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.28 -25.42 62.44 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 128.253 2.621 . . . . 0.0 114.271 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -61.52 -25.65 67.42 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.896 2.078 . . . . 0.0 112.754 169.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -93.44 -0.92 56.28 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 118.44 -2.663 . . . . 0.0 113.097 -174.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -134.97 18.42 3.47 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 120.759 1.618 . . . . 0.0 114.139 165.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 67.02 20.12 10.46 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.865 1.266 . . . . 0.0 113.885 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 94.2 mt -85.35 10.5 12.49 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 174.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -74.68 -40.11 61.59 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 118.243 -2.785 . . . . 0.0 112.872 -171.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.285 26.0 mt -62.61 -52.94 61.35 Favored Pre-proline 0 N--CA 1.446 -0.644 0 C-N-CA 129.405 3.082 . . . . 0.0 113.692 167.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -55.28 -41.93 73.51 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 N-CA-C 117.563 2.101 . . . . 0.0 117.563 170.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 64.0 tp -56.48 -37.85 70.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.132 1.373 . . . . 0.0 112.935 171.36 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 32.7 mt -92.08 -5.87 51.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -84.03 -21.51 31.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.463 1.905 . . . . 0.0 110.017 163.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 27.4 tp -83.26 -45.02 14.31 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 126.696 3.141 . . . . 0.0 116.524 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 42' ' ' MET . . . . . 0.412 ' C ' HD12 ' C' ' 43' ' ' LEU . 3.9 mmt -87.2 -7.52 57.85 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 111.616 -2.538 . . . . 0.0 114.899 -162.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 43' ' ' LEU . . . . . 0.412 HD12 ' C ' ' C' ' 42' ' ' MET . 10.0 mp -137.28 161.09 37.18 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 127.247 2.219 . . . . 0.0 109.28 -175.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 44' ' ' THR . . . . . 0.441 ' HB ' ' HD2' ' C' ' 45' ' ' PRO . 23.3 p -100.38 164.97 15.29 Favored Pre-proline 0 N--CA 1.449 -0.495 0 O-C-N 119.231 -2.168 . . . . 0.0 110.465 172.297 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 45' ' ' PRO . . . . . 0.441 ' HD2' ' HB ' ' C' ' 44' ' ' THR . 4.6 Cg_exo -41.28 -46.55 5.57 Favored 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 123.352 2.701 . . . . 0.0 115.036 171.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.75 -13.54 58.89 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 127.162 2.789 . . . . 0.0 115.286 -174.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -87.78 -30.22 20.42 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 131.229 3.812 . . . . 0.0 112.132 174.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 87.5 mtm-85 -71.33 -43.03 67.79 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 116.762 -1.589 . . . . 0.0 113.738 163.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -64.21 -23.69 67.4 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 125.083 1.489 . . . . 0.0 111.759 172.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.45 -50.36 70.07 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 127.652 2.381 . . . . 0.0 109.838 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 17.0 mt -77.57 -32.44 53.78 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 118.174 -2.828 . . . . 0.0 114.364 176.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.58 -44.73 85.93 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 118.677 -1.725 . . . . 0.0 115.157 164.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 26.9 m -73.15 -30.73 63.79 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 113.932 -2.937 . . . . 0.0 114.421 169.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 23.0 mtt180 -68.71 -36.14 78.06 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 125.891 3.95 . . . . 0.0 115.288 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 14.3 t -57.24 -36.54 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 129.253 3.021 . . . . 0.0 108.786 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 24.1 mtp180 -78.7 -24.07 45.22 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 121.49 0.662 . . . . 0.0 110.545 -176.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 61.8 mt -65.95 -49.4 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 O-C-N 117.691 -3.13 . . . . 0.0 108.174 174.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 96.6 t -53.57 -53.25 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 C-N-CA 128.512 2.725 . . . . 0.0 112.637 173.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -58.56 -39.3 79.9 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.433 1.493 . . . . 0.0 112.333 174.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -80.11 -37.33 33.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 120.927 1.694 . . . . 0.0 111.918 -177.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 80.8 mt -59.43 -36.8 76.58 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 169.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 70.8 mt -84.47 -36.2 22.46 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 125.05 1.469 . . . . 0.0 111.378 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 63' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' C' ' 63' ' ' ARG . 34.1 ttm180 -52.69 -60.76 2.87 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 117.579 -3.201 . . . . 0.0 110.357 173.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.7 49.29 6.19 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 130.65 3.976 . . . . 0.0 114.594 174.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -123.95 18.85 9.3 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 126.132 2.873 . . . . 0.0 113.372 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 14.5 mtt -116.45 131.91 56.82 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 117.07 -3.519 . . . . 0.0 110.015 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 54.2 p -95.37 162.78 13.52 Favored 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 132.424 4.29 . . . . 0.0 110.935 175.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -50.03 -33.28 17.63 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 116.65 2.093 . . . . 0.0 116.65 -169.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -72.59 -40.03 66.89 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.032 0.933 . . . . 0.0 111.336 177.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -68.08 -36.95 80.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 172.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 48.3 mt -55.67 -37.73 68.68 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.072 1.749 . . . . 0.0 112.066 164.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . 0.363 83.7 tttt -66.75 -63.33 1.09 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.114 0.566 . . . . 0.0 112.45 170.124 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -70.14 -42.56 72.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 115.284 -2.293 . . . . 0.0 111.154 -169.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -86.41 -48.81 8.11 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 122.391 2.359 . . . . 0.0 116.025 176.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.413 5.3 mp -74.28 -46.4 41.53 Favored 'General case' 0 N--CA 1.451 -0.377 1 CA-C-N 126.611 4.278 . . . . 0.0 113.62 -173.09 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.23 -160.74 52.55 Favored Glycine 0 C--N 1.338 0.639 0 C-N-CA 129.574 3.464 . . . . 0.0 113.12 -175.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -52.77 -27.77 19.42 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 116.352 1.982 . . . . 0.0 116.352 171.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.58 -19.19 26.21 Favored Glycine 0 C--N 1.338 0.661 1 CA-C-O 110.691 -5.505 . . . . 0.0 115.127 175.194 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 6.3 tt -55.36 -33.66 32.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 1 O-C-N 130.606 4.357 . . . . 0.0 110.683 176.082 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.54 -40.62 61.59 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.901 -2.999 . . . . 0.0 113.195 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 22.0 m -47.52 -30.53 3.58 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 116.907 2.188 . . . . 0.0 116.907 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 30.8 mm -109.32 -6.63 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 128.318 2.647 . . . . 0.0 115.481 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.9 p -118.94 -17.58 9.03 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 118.483 2.771 . . . . 0.0 118.483 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -105.4 134.51 48.4 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.441 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 108.08 171.55 21.63 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 125.895 1.712 . . . . 0.0 114.584 168.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 89.3 p -65.94 -21.76 66.45 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.163 2.481 . . . . 0.0 116.868 -171.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 57.1 m-80 -95.45 13.44 25.92 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 127.136 2.772 . . . . 0.0 115.754 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 48.7 p -77.73 172.22 13.75 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 128.459 3.981 . . . . 0.0 113.607 -173.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 40.9 tp -59.91 -28.94 68.02 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 117.621 -3.174 . . . . 0.0 113.737 -165.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -108.2 13.04 26.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.214 -2.179 . . . . 0.0 111.4 -177.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -132.09 -33.86 1.3 Allowed 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -27.92 149.14 0.03 OUTLIER Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 127.514 2.326 . . . . 0.0 115.199 147.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -62.27 153.81 67.58 Favored 'Trans proline' 0 N--CA 1.45 -1.077 0 CA-C-O 125.577 2.241 . . . . 0.0 110.722 -175.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 47.8 t -69.08 -50.53 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 C-N-CA 129.91 3.284 . . . . 0.0 106.762 -172.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -46.19 -36.96 6.49 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 123.301 1.524 . . . . 0.0 113.277 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 23.1 tp -76.07 -43.26 44.49 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 117.443 -3.286 . . . . 0.0 108.474 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -66.1 -37.85 86.79 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 115.042 -2.409 . . . . 0.0 106.428 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -66.05 -55.81 14.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 128.707 2.803 . . . . 0.0 110.003 178.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -52.64 -47.36 67.11 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 128.193 3.433 . . . . 0.0 112.362 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 45.3 mt -61.31 -35.76 78.23 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 129.212 3.005 . . . . 0.0 111.913 173.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -72.21 -42.52 65.67 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 116.781 -3.699 . . . . 0.0 112.64 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -56.48 -47.23 79.69 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 129.52 3.128 . . . . 0.0 106.368 176.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 96.4 t -82.2 -62.12 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 124.631 2.158 . . . . 0.0 113.602 -173.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 69.0 mt -71.42 -14.64 62.22 Favored 'General case' 0 N--CA 1.443 -0.775 0 O-C-N 117.318 -3.364 . . . . 0.0 118.214 -172.005 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 70.6 mt -129.73 39.83 3.66 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 115.375 1.621 . . . . 0.0 115.375 -177.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 46.6 pttt . . . . . 0 N--CA 1.449 -0.502 0 O-C-N 120.966 -1.084 . . . . 0.0 113.766 -173.385 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 61.2 p . . . . . 0 N--CA 1.447 -0.624 0 CA-C-O 114.026 -2.892 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -74.67 -54.97 0.08 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.039 0 CA-C-N 124.473 2.633 . . . . 0.0 108.127 -172.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -125.33 146.56 49.52 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-O 116.674 -1.632 . . . . 0.0 111.403 147.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 38.4 t -76.49 133.45 39.79 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 115.778 -2.058 . . . . 0.0 109.778 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.24 -15.3 0.89 Allowed 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 117.904 2.557 . . . . 0.0 117.904 162.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . 0.262 . . -81.95 -35.81 28.65 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 128.257 3.885 . . . . 0.0 113.727 177.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 2.0 mmm -79.59 -31.07 41.74 Favored 'General case' 0 N--CA 1.452 -0.34 1 O-C-N 116.177 -4.077 . . . . 0.0 113.182 167.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.45 94.94 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 118.205 -2.809 . . . . 0.0 112.793 173.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -46.3 -54.66 8.51 Favored 'General case' 0 N--CA 1.45 -0.425 1 CA-C-O 130.069 4.747 . . . . 0.0 115.953 165.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -64.67 -39.94 94.56 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 109.563 -3.471 . . . . 0.0 113.362 -169.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -16.23 63.08 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 176.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -85.0 -35.86 21.68 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -94.43 -29.36 15.01 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.603 1.961 . . . . 0.0 113.517 -166.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -69.02 -10.15 56.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 113.91 -2.948 . . . . 0.0 110.442 156.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . 0.35 2.7 t-105 -82.8 -38.04 23.67 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 124.4 3.273 . . . . 0.0 110.501 173.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 20' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' D' ' 20' ' ' LEU . 41.7 mt -71.14 -20.01 62.36 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 113.306 -1.77 . . . . 0.0 111.379 174.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 36.2 ttt180 -64.11 -35.34 80.45 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 121.356 1.889 . . . . 0.0 112.855 167.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -72.85 -47.2 48.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.591 1.957 . . . . 0.0 111.455 168.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . 0.439 18.4 t -58.25 -41.48 81.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 O-C-N 117.447 -3.283 . . . . 0.0 107.782 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -71.7 -31.66 66.99 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 176.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 22.6 tp -70.94 -36.59 72.66 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 123.587 1.661 . . . . 0.0 113.553 171.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 25.1 tp -68.51 -38.72 81.18 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 119.535 -1.978 . . . . 0.0 112.302 172.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 ttpp -58.75 -50.89 72.23 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.749 -3.095 . . . . 0.0 111.009 174.36 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -60.17 -21.08 61.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.181 -2.199 . . . . 0.0 115.677 175.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 29' ' ' ALA . . . . . 0.609 ' HB1' ' HA ' ' D' ' 35' ' ' HIS . . . -79.64 -46.47 17.13 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 127.004 2.122 . . . . 0.0 110.012 174.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -58.29 -21.8 50.29 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 121.706 2.048 . . . . 0.0 112.943 173.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -85.46 -14.68 45.35 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.156 1.382 . . . . 0.0 114.587 -171.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -128.3 10.12 6.23 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 120.163 -1.585 . . . . 0.0 113.915 173.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 52.45 38.14 24.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 -172.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 21.1 mt -99.2 16.9 21.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 119.175 3.028 . . . . 0.0 119.175 159.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 35' ' ' HIS . . . . . 0.609 ' HA ' ' HB1' ' D' ' 29' ' ' ALA . 18.1 p-80 -67.58 -60.88 2.2 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.319 3.448 . . . . 0.0 108.839 -171.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.98 -29.6 3.17 Favored Pre-proline 0 N--CA 1.449 -0.511 0 CA-C-O 116.372 -1.775 . . . . 0.0 114.104 -174.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.286 53.9 Cg_exo -68.13 -29.89 32.48 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 N-CA-C 116.044 1.517 . . . . 0.0 116.044 164.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 18.7 tp -71.77 -46.87 57.0 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 115.445 -2.217 . . . . 0.0 112.49 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 20.4 mt -55.28 -44.03 75.28 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 126.144 2.153 . . . . 0.0 116.577 170.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -77.32 -27.65 52.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.833 3.208 . . . . 0.0 112.153 -176.126 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 23.9 tp -54.39 -50.3 67.86 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 117.209 -3.432 . . . . 0.0 111.76 162.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 16.9 mmt -73.19 -39.42 65.61 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 119.604 3.187 . . . . 0.0 119.604 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 21.5 mt -114.52 129.73 56.69 Favored 'General case' 0 N--CA 1.447 -0.587 1 O-C-N 116.056 -4.153 . . . . 0.0 109.695 -167.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 44' ' ' THR . . . . . 0.414 ' HB ' ' HD2' ' D' ' 45' ' ' PRO . 70.8 p -77.38 159.44 77.5 Favored Pre-proline 0 N--CA 1.449 -0.518 0 C-N-CA 126.526 1.93 . . . . 0.0 109.545 176.231 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 45' ' ' PRO . . . . . 0.414 ' HD2' ' HB ' ' D' ' 44' ' ' THR . 72.2 Cg_exo -46.37 -38.38 20.56 Favored 'Trans proline' 0 N--CA 1.449 -1.11 1 C-N-CA 125.982 4.455 . . . . 0.0 116.557 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -76.2 -29.09 57.49 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 117.58 -3.2 . . . . 0.0 110.953 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -70.94 -43.85 67.32 Favored 'General case' 0 N--CA 1.446 -0.665 1 O-C-N 116.091 -4.13 . . . . 0.0 104.376 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 13.4 mtm-85 -61.69 -37.64 84.86 Favored 'General case' 0 N--CA 1.448 -0.54 1 O-C-N 114.985 -4.822 . . . . 0.0 114.012 169.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -69.88 -38.35 76.35 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.11 -28.32 66.37 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 116.604 -1.665 . . . . 0.0 111.019 165.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . 0.271 21.3 mt -74.26 -39.46 62.99 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 123.921 3.055 . . . . 0.0 113.699 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -56.0 -39.51 79.51 Favored Glycine 0 C--N 1.333 0.385 0 CA-C-O 122.445 1.025 . . . . 0.0 113.885 167.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 73.7 m -80.17 -28.02 38.86 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.574 -0.813 . . . . 0.0 110.813 -174.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -71.04 -20.87 62.33 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 116.99 -3.569 . . . . 0.0 112.074 175.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.95 -45.52 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 166.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.579 2.7 ptm180 -68.74 -37.34 79.35 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 128.05 2.54 . . . . 0.0 115.698 173.134 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 27.8 mt -60.1 -46.21 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 119.945 -1.722 . . . . 0.0 108.3 172.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 47.0 t -66.0 -38.54 82.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 CA-C-N 122.669 2.486 . . . . 0.0 113.387 178.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -62.65 -40.9 98.49 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.343 -1.313 . . . . 0.0 109.179 -177.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -82.31 -22.92 35.41 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 115.189 -2.339 . . . . 0.0 108.32 -176.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 25.9 mt -62.65 -37.6 87.03 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 120.774 1.624 . . . . 0.0 111.219 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 32.1 mt -70.3 -43.63 69.99 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 125.653 1.846 . . . . 0.0 114.3 172.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . 0.37 32.0 ttm180 -74.1 -37.9 64.01 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 128.437 2.695 . . . . 0.0 111.744 -172.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 48.31 46.04 28.32 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 122.593 3.797 . . . . 0.0 122.593 170.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -126.94 -35.99 2.23 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 127.485 2.314 . . . . 0.0 110.032 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 20.5 mtt -74.7 51.1 0.46 Allowed 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 147.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 49.6 p -76.13 -172.88 2.18 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -173.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.333 35.5 tp60 68.23 -78.33 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 115.545 -2.169 . . . . 0.0 114.73 159.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 20.1 ttt85 -106.09 -35.76 7.14 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 128.918 2.887 . . . . 0.0 111.668 176.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -76.64 -18.4 58.61 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -168.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -38.61 65.34 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 124.591 1.182 . . . . 0.0 109.217 176.236 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -78.25 -21.79 49.35 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 118.181 -2.824 . . . . 0.0 115.941 172.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -121.8 -7.31 9.03 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 126.905 2.628 . . . . 0.0 113.503 -156.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -119.0 -41.02 2.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 128.489 2.716 . . . . 0.0 109.607 168.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.08 -29.1 27.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 119.246 0.93 . . . . 0.0 109.344 177.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 76.76 179.53 48.04 Favored Glycine 0 CA--C 1.523 0.545 0 O-C-N 118.899 -2.376 . . . . 0.0 114.296 157.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.06 -8.49 30.78 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.546 -2.738 . . . . 0.0 116.229 -148.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.75 -19.19 73.02 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-O 117.22 -1.878 . . . . 0.0 108.793 173.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 11.5 tt -47.95 -18.44 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 121.15 2.475 . . . . 0.0 114.715 167.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.2 -25.19 12.56 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 118.777 -2.452 . . . . 0.0 109.061 -168.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 7.6 m -64.6 -35.9 82.49 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 116.995 -3.566 . . . . 0.0 113.767 150.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 19.0 mm -82.64 -14.63 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 118.266 -2.771 . . . . 0.0 112.867 -171.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 77.6 p -120.68 -16.86 8.16 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.621 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -99.46 173.53 6.71 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 123.241 2.746 . . . . 0.0 106.811 169.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.01 151.67 26.9 Favored Glycine 0 C--N 1.337 0.612 0 O-C-N 119.979 -1.701 . . . . 0.0 113.566 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 5.7 p -69.46 -11.37 60.77 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 118.976 -2.485 . . . . 0.0 115.437 -151.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -150.27 42.46 0.84 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 127.164 3.364 . . . . 0.0 112.427 -176.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 1.4 p -64.2 168.82 5.07 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 127.42 2.288 . . . . 0.0 115.057 166.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.316 7.0 tt -64.16 -30.51 71.57 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 120.11 -1.619 . . . . 0.0 112.933 171.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 62.5 tttt -62.32 -38.46 89.54 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 127.581 2.352 . . . . 0.0 108.977 169.2 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -85.28 -27.27 26.09 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 120.477 -1.389 . . . . 0.0 111.383 -163.435 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 92' ' ' ALA . . . . . 0.738 ' HB1' HG22 ' D' ' 94' ' ' VAL 0.285 . . 62.67 77.79 0.32 Allowed Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 127.075 2.15 . . . . 0.0 108.453 163.078 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 93' ' ' PRO . . . . . 0.471 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 95.8 Cg_exo 21.62 29.29 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.18 0 N-CA-C 122.223 3.893 . . . . 0.0 122.223 46.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 94' ' ' VAL . . . . . 0.738 HG22 ' HB1' ' D' ' 92' ' ' ALA . 2.9 t -57.09 -36.42 51.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 C-N-CA 130.717 3.607 . . . . 0.0 110.546 -171.103 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.61 -40.28 49.87 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 113.217 -1.81 . . . . 0.0 114.225 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 48.3 tp -52.19 -53.15 46.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 130.667 3.587 . . . . 0.0 106.857 165.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -50.42 -45.63 55.86 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 174.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -63.35 -32.31 73.7 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 128.373 2.669 . . . . 0.0 114.126 -176.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 77.2 t90 -80.85 -44.08 18.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 125.69 2.662 . . . . 0.0 114.47 -178.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 70.1 mt -61.94 -32.19 72.58 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 117.236 -3.415 . . . . 0.0 111.324 165.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -69.59 -19.58 63.66 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 118.902 2.927 . . . . 0.0 118.902 178.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -90.02 -44.93 9.51 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 119.164 -2.21 . . . . 0.0 108.856 171.36 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 37.6 t -84.42 -34.33 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 O-C-N 119.517 -1.99 . . . . 0.0 110.682 -168.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 64.2 mt -90.34 -34.41 15.7 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 117.848 -3.033 . . . . 0.0 110.225 -172.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 22.5 mt -91.2 15.58 11.57 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 128.494 2.717 . . . . 0.0 111.328 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 7.4 pttp -55.32 158.88 2.92 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 130.6 3.56 . . . . 0.0 108.294 154.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 75.1 m -116.4 23.26 12.22 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 116.854 -1.546 . . . . 0.0 109.812 -164.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 C--O 1.25 1.097 0 C-N-CA 129.409 3.084 . . . . 0.0 115.232 153.98 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 41.2 ttp . . . . . 0 N--CA 1.448 -0.538 0 CA-C-O 113.949 -2.929 . . . . 0.0 111.915 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -50.56 -48.36 57.44 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 121.731 2.06 . . . . 0.0 112.554 169.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -67.86 -39.41 83.79 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 126.157 2.884 . . . . 0.0 113.471 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -62.72 -42.96 99.91 Favored 'General case' 0 N--CA 1.449 -0.491 1 O-C-N 116.196 -4.065 . . . . 0.0 112.239 -178.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.3 22.6 mmt180 -74.38 -38.14 63.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 125.597 1.811 . . . . 0.0 111.723 -171.17 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -53.76 -40.52 66.27 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 161.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -40.98 96.47 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 117.422 -3.299 . . . . 0.0 111.998 177.047 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -60.73 -27.37 67.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.835 1.654 . . . . 0.0 112.395 177.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 8.6 t-105 -83.84 -49.52 8.97 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.777 1.631 . . . . 0.0 111.77 171.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.9 mt -58.17 -24.73 60.0 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.946 -1.721 . . . . 0.0 113.447 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -63.74 -45.16 91.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 114.527 -1.215 . . . . 0.0 112.013 173.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -61.26 -45.04 96.18 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 124.649 1.218 . . . . 0.0 109.52 172.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.5 t -60.55 -32.0 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 125.23 1.581 . . . . 0.0 111.58 -176.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.91 -38.01 69.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 118.841 2.904 . . . . 0.0 118.841 160.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 28.1 tp -57.54 -49.69 75.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.359 1.063 . . . . 0.0 110.263 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 54.0 tp -70.22 -31.45 68.88 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 113.645 -3.074 . . . . 0.0 113.998 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -61.58 -44.43 97.03 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 128.165 3.416 . . . . 0.0 111.527 168.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -71.33 -26.82 62.99 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 114.022 -1.444 . . . . 0.0 113.05 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.1 -40.56 78.31 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 118.887 -2.383 . . . . 0.0 112.215 167.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.429 ' CE1' ' CD2' ' A' ' 35' ' ' HIS . 53.8 m-85 -55.58 -40.53 72.1 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 116.454 -3.904 . . . . 0.0 113.999 159.579 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -64.0 -32.97 74.7 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.71 2.05 . . . . 0.0 112.359 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -109.09 10.68 25.99 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 128.376 2.671 . . . . 0.0 114.64 -172.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 63.65 25.26 14.22 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 124.191 1.948 . . . . 0.0 114.911 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.9 mt -107.14 20.98 18.24 Favored 'General case' 0 N--CA 1.449 -0.488 1 O-C-N 116.13 -4.106 . . . . 0.0 115.866 164.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.429 ' CD2' ' CE1' ' A' ' 30' ' ' TYR . 46.7 p-80 -67.62 -32.63 73.47 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.824 -3.048 . . . . 0.0 113.483 175.701 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.286 14.4 mt -73.0 -43.63 7.87 Favored Pre-proline 0 N--CA 1.448 -0.553 0 CA-C-O 114.636 -2.602 . . . . 0.0 110.588 176.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -59.19 -37.84 89.46 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 CA-C-N 123.195 2.177 . . . . 0.0 111.993 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.0 tp -64.34 -40.54 96.09 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 116.241 -1.837 . . . . 0.0 112.631 175.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.8 mt -77.5 -17.09 58.31 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 121.573 1.988 . . . . 0.0 114.661 -171.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -74.96 -29.89 61.05 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 169.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tt -88.44 -42.87 11.87 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.933 -2.461 . . . . 0.0 106.747 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.4 mmm -67.55 -25.01 65.6 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 113.474 -3.155 . . . . 0.0 118.433 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.2 mt -129.25 140.62 51.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 126.279 2.237 . . . . 0.0 109.435 177.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.2 p -72.44 157.35 89.24 Favored Pre-proline 0 N--CA 1.452 -0.369 0 C-N-CA 127.103 2.161 . . . . 0.0 111.608 175.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -51.18 -42.85 51.87 Favored 'Trans proline' 0 N--CA 1.447 -1.253 1 C-N-CA 127.51 5.473 . . . . 0.0 117.746 172.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -70.73 -39.81 73.15 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 116.49 -1.719 . . . . 0.0 115.543 169.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . 0.299 71.9 mt-10 -50.52 -54.26 23.72 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 168.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.7 mtm-85 -61.67 -41.91 98.2 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 117.584 -3.197 . . . . 0.0 112.352 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -73.3 -10.12 59.42 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 120.473 1.488 . . . . 0.0 108.607 -176.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.43 -35.15 12.46 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 119.469 -2.02 . . . . 0.0 113.425 170.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.14 -24.63 62.3 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 178.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.03 -40.62 99.16 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 118.133 -1.984 . . . . 0.0 115.862 157.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 74.8 m -74.18 -29.55 61.81 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 118.634 1.217 . . . . 0.0 111.421 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -59.75 -29.18 67.98 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 116.513 -3.867 . . . . 0.0 112.213 171.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.8 t -75.74 -36.93 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-N 119.87 1.214 . . . . 0.0 109.512 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.2 mtp180 -59.1 -40.94 86.88 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 118.886 -2.384 . . . . 0.0 109.752 168.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.271 74.9 mt -65.18 -50.07 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 C-N-CA 126.163 1.785 . . . . 0.0 110.485 -177.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.1 -39.64 86.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 120.399 -1.438 . . . . 0.0 109.747 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -52.93 -55.37 23.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 121.51 1.959 . . . . 0.0 111.209 173.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -67.95 -22.72 65.03 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 117.159 -3.463 . . . . 0.0 110.638 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.8 mt -87.75 -24.4 23.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 177.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.311 29.3 tp -81.25 -22.94 38.35 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.999 2.12 . . . . 0.0 115.062 163.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . 0.292 45.7 ttm180 -77.57 -55.16 5.6 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.687 -2.508 . . . . 0.0 112.615 175.337 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.92 10.17 84.39 Favored Glycine 0 CA--C 1.521 0.432 1 N-CA-C 123.72 4.248 . . . . 0.0 123.72 -175.125 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.306 74.6 mm-40 -106.48 -24.4 12.22 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -172.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.7 ttm -78.27 126.43 30.78 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 126.418 2.324 . . . . 0.0 111.158 155.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.3 p -81.01 162.66 23.72 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 119.389 -2.069 . . . . 0.0 115.667 177.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -55.21 -35.29 64.71 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 120.67 1.577 . . . . 0.0 111.078 172.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.7 tpt85 -72.99 -21.75 60.79 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 119.122 -2.236 . . . . 0.0 110.318 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -86.79 -33.11 20.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 122.028 2.194 . . . . 0.0 110.428 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.3 mt -63.27 -30.88 71.94 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 118.62 -2.55 . . . . 0.0 109.45 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -62.65 -31.15 71.97 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 128.594 2.758 . . . . 0.0 111.133 176.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -101.22 -37.58 8.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 121.72 2.054 . . . . 0.0 112.563 175.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -98.03 -20.53 17.33 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 119.149 -2.219 . . . . 0.0 110.412 -157.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.6 mt -114.27 -8.92 12.88 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 127.72 2.408 . . . . 0.0 110.018 162.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 86.73 10.56 72.57 Favored Glycine 0 CA--C 1.523 0.539 1 O-C-N 114.822 -4.924 . . . . 0.0 115.676 170.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -96.17 121.32 37.82 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 130.401 3.48 . . . . 0.0 115.894 -162.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.16 153.33 51.87 Favored Glycine 0 C--N 1.339 0.713 0 N-CA-C 118.79 2.276 . . . . 0.0 118.79 -176.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 14.5 mt -58.5 -34.92 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 O-C-N 117.036 -3.626 . . . . 0.0 114.202 -164.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.04 -34.06 50.73 Favored 'General case' 0 N--CA 1.452 -0.363 1 O-C-N 115.944 -4.223 . . . . 0.0 116.085 -168.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 48.3 p -78.14 -30.69 49.43 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 119.713 -1.867 . . . . 0.0 108.548 173.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.286 14.5 mm -65.18 -48.17 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 O-C-N 126.04 2.088 . . . . 0.0 110.224 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 45.7 m -58.51 -43.73 89.21 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.047 -0.977 . . . . 0.0 112.824 170.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -61.14 -50.47 73.05 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 -176.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -59.96 -35.94 88.65 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-N 122.336 2.335 . . . . 0.0 113.097 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 71.0 m -60.93 -45.67 93.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -58.22 -43.4 87.68 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 117.139 -3.475 . . . . 0.0 114.784 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.0 m -63.85 -26.44 68.61 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.888 1.675 . . . . 0.0 111.421 176.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.3 tp -83.28 -35.33 25.38 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 113.114 -3.327 . . . . 0.0 109.015 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -70.34 -29.26 65.91 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 127.894 3.247 . . . . 0.0 112.662 170.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.74 3.01 56.41 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.667 1.187 . . . . 0.0 110.71 173.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.99 145.4 77.39 Favored Pre-proline 0 N--CA 1.447 -0.578 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.65 152.37 78.09 Favored 'Trans proline' 0 N--CA 1.451 -0.99 0 C-N-CA 117.17 -1.42 . . . . 0.0 114.628 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -57.76 -42.04 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-O 115.665 -2.112 . . . . 0.0 114.212 -174.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -48.11 -40.98 25.16 Favored 'General case' 0 N--CA 1.453 -0.289 1 O-C-N 130.585 4.928 . . . . 0.0 115.794 173.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 39.3 tp -75.71 -50.01 16.62 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.974 1.368 . . . . 0.0 111.248 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -57.02 -46.76 82.1 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 117.971 -2.956 . . . . 0.0 111.317 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -66.09 -34.51 78.22 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 120.467 -1.395 . . . . 0.0 111.128 -174.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 60.2 t90 -77.34 -34.69 55.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.425 -2.672 . . . . 0.0 109.336 -178.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.7 mt -78.66 -22.98 46.0 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 117.951 -2.968 . . . . 0.0 104.856 -174.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -63.59 -32.61 74.13 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 128.74 2.816 . . . . 0.0 111.733 170.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -87.78 -19.21 27.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 129.098 2.959 . . . . 0.0 112.431 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.8 t -101.37 -61.83 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 80.3 mt -87.4 -19.93 27.39 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 118.006 -2.934 . . . . 0.0 115.331 -162.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.2 mt -106.67 0.51 24.38 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 118.707 -2.496 . . . . 0.0 114.809 178.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.0 tttp . . . . . 0 N--CA 1.45 -0.475 0 N-CA-C 117.669 2.47 . . . . 0.0 117.669 -176.565 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.727 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 38.6 mtt -69.06 -35.32 76.43 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 121.681 2.037 . . . . 0.0 110.245 168.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.22 -35.87 80.23 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.048 0.928 . . . . 0.0 111.681 178.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -64.6 -52.99 54.64 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 115.715 -2.088 . . . . 0.0 112.632 164.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 42.6 tp60 -60.53 -28.09 68.14 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 123.598 2.908 . . . . 0.0 117.192 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -77.22 -38.3 51.59 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 126.333 2.968 . . . . 0.0 117.096 172.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -52.24 -51.72 56.71 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.007 -2.933 . . . . 0.0 107.812 169.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -53.79 -36.14 62.11 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 126.468 2.355 . . . . 0.0 115.301 166.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -76.92 -35.25 57.46 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 117.191 -3.443 . . . . 0.0 114.534 -175.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . 0.253 47.9 t-105 -57.68 -50.74 72.19 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.334 -1.479 . . . . 0.0 113.375 158.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 70.8 mt -68.41 -12.16 60.73 Favored 'General case' 0 N--CA 1.452 -0.375 0 O-C-N 116.841 -3.662 . . . . 0.0 110.219 -176.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -83.12 -26.42 31.03 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 122.477 2.399 . . . . 0.0 111.53 169.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -71.25 -42.17 69.18 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.021 160.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 53.6 t -69.02 -43.24 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 1 O-C-N 115.917 -4.239 . . . . 0.0 113.582 -178.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -63.87 -47.51 80.4 Favored 'General case' 0 N--CA 1.454 -0.265 1 C-N-CA 131.997 4.119 . . . . 0.0 111.643 169.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.76 -40.86 85.16 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 120.606 1.548 . . . . 0.0 111.211 176.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 67.8 tp -72.27 -36.69 69.06 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 119.316 -2.115 . . . . 0.0 105.5 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -58.83 -47.8 83.56 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 116.27 -1.824 . . . . 0.0 108.176 175.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -76.97 -30.35 55.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 122.707 2.503 . . . . 0.0 114.314 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.8 -45.86 88.93 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 170.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . 0.264 41.0 m-85 -47.8 -39.39 18.07 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 119.73 3.233 . . . . 0.0 119.73 166.507 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -66.93 -35.59 80.33 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.724 1.21 . . . . 0.0 109.211 177.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -94.35 -0.7 54.74 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 123.24 1.495 . . . . 0.0 113.127 -173.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.334 8.3 m-20 56.6 36.52 27.75 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 127.726 2.411 . . . . 0.0 116.482 -166.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 61.8 mt -100.26 4.86 44.47 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 29.1 p-80 -61.48 -38.74 88.39 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 128.714 2.806 . . . . 0.0 116.232 -173.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 14.7 mt -70.04 -49.37 19.05 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-O 114.492 -2.671 . . . . 0.0 110.477 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -58.01 -33.32 97.09 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 O-C-N 125.758 2.452 . . . . 0.0 117.228 174.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 37.8 tp -74.62 -45.82 42.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 113.433 -3.175 . . . . 0.0 114.814 173.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 56.8 mt -54.24 -42.3 69.73 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 126.387 2.304 . . . . 0.0 115.927 168.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -62.45 -41.25 98.61 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 31.5 tp -72.47 -36.19 68.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 115.392 -2.242 . . . . 0.0 111.928 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 22.3 mmt -88.78 -19.46 25.99 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 115.656 -2.116 . . . . 0.0 112.52 -170.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 17.1 mt -134.99 146.11 48.75 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 126.761 2.538 . . . . 0.0 111.236 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' THR . . . . . 0.641 ' HB ' ' HD2' ' B' ' 45' ' ' PRO . 30.0 p -88.18 158.1 49.95 Favored Pre-proline 0 N--CA 1.449 -0.482 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -176.056 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 45' ' ' PRO . . . . . 0.641 ' HD2' ' HB ' ' B' ' 44' ' ' THR . 74.6 Cg_exo -36.58 -47.46 1.31 Allowed 'Trans proline' 0 N--CA 1.447 -1.207 1 C-N-CA 127.046 5.164 . . . . 0.0 115.823 173.317 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.89 -29.74 63.4 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 173.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -70.13 -42.49 72.52 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 126.903 3.24 . . . . 0.0 110.911 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -66.13 -51.37 58.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.452 -2.655 . . . . 0.0 112.967 178.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -55.45 -41.2 72.55 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.796 2.438 . . . . 0.0 114.457 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.0 -28.88 60.71 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.5 mt -67.11 -44.14 80.7 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 116.162 1.912 . . . . 0.0 116.162 169.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.86 -46.01 69.12 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.584 166.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 17.9 m -63.6 -51.96 62.98 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 113.834 -2.984 . . . . 0.0 107.627 -175.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -40.9 -33.82 0.34 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.585 2.754 . . . . 0.0 112.424 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 40.7 t -65.1 -42.17 93.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-O 116.27 -1.824 . . . . 0.0 107.302 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 38.4 mtp180 -72.31 -33.06 67.09 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 120.172 1.351 . . . . 0.0 111.334 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 59.5 mt -54.17 -62.62 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 123.449 2.84 . . . . 0.0 112.007 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.338 77.1 t -66.7 -33.07 61.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 C-N-CA 126.212 1.805 . . . . 0.0 110.77 -170.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.93 -28.49 68.97 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 115.223 -2.322 . . . . 0.0 116.928 165.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . 0.291 20.7 tp10 -90.07 -27.36 19.73 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 127.929 3.268 . . . . 0.0 113.157 -179.054 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 56.9 mt -65.87 -30.41 71.01 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 114.989 -1.005 . . . . 0.0 112.153 166.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 24.0 mt -77.85 -41.74 35.92 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.126 1.371 . . . . 0.0 113.66 170.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 28.5 ttm105 -77.13 -64.07 1.22 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 115.144 -2.36 . . . . 0.0 113.612 -174.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.66 93.25 0.04 OUTLIER Glycine 0 CA--C 1.521 0.45 0 C-N-CA 129.847 3.594 . . . . 0.0 114.172 -165.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -134.48 -60.04 0.8 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 130.762 3.625 . . . . 0.0 114.505 168.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 38.6 mtt -64.08 139.27 58.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 115.875 1.805 . . . . 0.0 115.875 -164.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 82.9 p -72.45 161.5 30.73 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 118.124 2.639 . . . . 0.0 118.124 156.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -54.16 -32.5 55.53 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 117.677 2.473 . . . . 0.0 117.677 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -65.39 -46.77 78.75 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 114.614 -2.612 . . . . 0.0 111.046 173.012 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -62.48 -43.92 97.65 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 127.063 2.727 . . . . 0.0 116.795 172.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 70.3 mt -56.27 -39.67 73.01 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 117.765 -1.112 . . . . 0.0 112.092 174.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -83.84 -20.91 32.33 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 121.417 1.917 . . . . 0.0 112.648 -171.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -111.67 -34.98 5.89 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 115.57 -2.157 . . . . 0.0 109.113 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -91.29 -24.63 19.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 18.6 mt -112.35 -7.84 13.95 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 130.616 3.566 . . . . 0.0 111.375 169.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.59 18.67 72.19 Favored Glycine 0 C--N 1.336 0.564 0 CA-C-N 121.815 2.098 . . . . 0.0 114.556 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.03 130.1 46.99 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -165.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.85 165.91 44.34 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 128.265 2.84 . . . . 0.0 115.276 169.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 43.1 mt -61.43 -50.7 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-O 118.483 -0.77 . . . . 0.0 112.459 -170.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.13 73.65 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.004 1.483 . . . . 0.0 115.004 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 16.1 m -62.41 -44.37 96.59 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 116.244 -1.836 . . . . 0.0 111.03 174.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 36.2 mm -73.15 -38.97 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 CA-C-N 121.911 2.141 . . . . 0.0 112.449 -178.097 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 30.2 m -62.38 -45.52 92.76 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 125.199 1.4 . . . . 0.0 111.878 178.005 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -53.77 -26.05 21.79 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 130.502 3.521 . . . . 0.0 109.751 171.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.14 -43.96 62.13 Favored Glycine 0 C--N 1.337 0.617 0 CA-C-O 124.817 2.343 . . . . 0.0 116.392 177.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . 0.381 7.1 p -61.26 -39.88 91.99 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 117.81 2.522 . . . . 0.0 117.81 175.049 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -67.79 -25.89 65.82 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.191 2.182 . . . . 0.0 112.899 168.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 44.9 m -78.64 -41.34 31.68 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 103.792 -2.67 . . . . 0.0 103.792 -174.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 mt -68.84 -27.2 65.62 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 117.123 -3.486 . . . . 0.0 108.901 178.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -65.1 -46.22 81.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 124.334 3.243 . . . . 0.0 115.976 174.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.33 -4.28 50.15 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 108.678 -3.874 . . . . 0.0 114.85 174.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.23 156.39 81.42 Favored Pre-proline 0 N--CA 1.449 -0.479 0 CA-C-N 122.66 2.482 . . . . 0.0 114.512 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -59.99 129.88 32.25 Favored 'Trans proline' 0 N--CA 1.45 -1.045 1 C-N-CA 126.345 4.697 . . . . 0.0 110.353 164.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.253 2.7 m -72.29 -17.09 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 116.174 -1.869 . . . . 0.0 114.314 -171.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 13.8 pm0 -74.15 -21.86 59.68 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 125.445 1.715 . . . . 0.0 113.583 171.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.6 tp -70.32 -42.0 72.52 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 118.276 -1.37 . . . . 0.0 112.624 173.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -52.47 -51.64 58.32 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 128.113 2.565 . . . . 0.0 109.371 177.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -56.27 -41.93 76.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.056 -1.429 . . . . 0.0 112.385 172.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 17.1 t90 -70.59 -42.66 70.73 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 118.32 -2.738 . . . . 0.0 112.933 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 100' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' B' ' 100' ' ' LEU . 17.4 mt -78.03 -25.42 47.86 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -168.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -49.6 -34.93 19.22 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.674 1.99 . . . . 0.0 113.296 158.071 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -100.4 -32.11 10.98 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 118.853 0.751 . . . . 0.0 112.643 -175.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 56.7 t -91.87 -8.91 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -177.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 40.4 mt -103.58 -43.39 5.39 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 120.293 -1.504 . . . . 0.0 114.302 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 57.5 mt -90.07 -24.7 21.08 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.848 -154.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.46 -11.79 60.58 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 113.574 -3.107 . . . . 0.0 111.356 168.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 51.2 m -76.08 5.58 6.52 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 123.533 2.879 . . . . 0.0 115.027 169.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 . . . . . 0 C--O 1.249 1.05 0 N-CA-C 121.58 3.919 . . . . 0.0 121.58 174.992 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 53.2 ttm . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 125.853 2.74 . . . . 0.0 108.229 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -53.87 139.8 32.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 -159.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -100.95 126.17 47.58 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 116.955 -3.59 . . . . 0.0 116.413 -158.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -130.24 122.27 27.74 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 129.574 3.15 . . . . 0.0 111.589 -168.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 80.7 p -151.5 146.2 18.66 Favored Pre-proline 0 N--CA 1.45 -0.429 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -171.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.45 -30.58 72.11 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 122.751 2.3 . . . . 0.0 112.987 175.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -139.49 156.56 46.85 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 117.797 -3.064 . . . . 0.0 111.316 171.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 10.7 t -148.11 132.19 17.28 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.23 -1.804 . . . . 0.0 110.674 171.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.26 -28.06 59.68 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.846 -1.549 . . . . 0.0 112.164 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.23 -38.86 88.92 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.437 1.926 . . . . 0.0 112.757 172.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 57.3 mtt -70.27 -40.07 74.56 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.158 0.983 . . . . 0.0 108.796 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.45 -24.1 60.18 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 119.998 3.333 . . . . 0.0 119.998 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -71.56 -45.79 61.27 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.131 0.972 . . . . 0.0 110.605 163.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -59.16 -32.68 70.11 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 123.888 1.804 . . . . 0.0 111.817 174.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -38.94 65.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 117.466 -3.271 . . . . 0.0 113.782 169.042 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -54.16 -43.15 70.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 118.44 2.755 . . . . 0.0 118.44 164.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -69.21 -39.12 78.78 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 116.102 -1.904 . . . . 0.0 112.444 172.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -60.39 -43.03 97.02 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.172 -1.871 . . . . 0.0 110.152 174.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 19' ' ' TRP . . . . . 0.498 ' CZ2' ' HD2' ' D' ' 48' ' ' ARG . 19.9 t-105 -69.3 -40.89 77.4 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 122.179 2.263 . . . . 0.0 111.661 176.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.62 -17.01 64.03 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 119.255 -2.153 . . . . 0.0 114.728 173.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -65.7 -34.68 78.76 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 118.552 2.797 . . . . 0.0 118.552 159.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -59.24 -43.72 92.38 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 121.762 2.074 . . . . 0.0 115.583 176.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 11.7 t -56.9 -53.59 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 O-C-N 124.41 1.069 . . . . 0.0 112.606 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -75.1 -30.93 61.04 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 126.894 2.621 . . . . 0.0 110.747 -171.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 43.3 tp -67.94 -36.09 79.52 Favored 'General case' 0 N--CA 1.453 -0.321 1 O-C-N 116.061 -4.149 . . . . 0.0 112.531 170.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . 0.284 53.4 tp -74.62 -28.57 60.94 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 130.573 3.549 . . . . 0.0 108.339 174.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -60.58 -34.33 74.03 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 124.858 3.481 . . . . 0.0 110.844 168.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -73.24 -36.88 66.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 125.787 2.708 . . . . 0.0 112.434 176.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.68 -24.4 58.78 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 112.852 -1.976 . . . . 0.0 113.331 -169.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -65.09 -21.42 66.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 119.442 -2.036 . . . . 0.0 111.797 171.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -71.78 -33.74 68.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 119.955 1.252 . . . . 0.0 113.065 -178.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -123.98 33.45 5.29 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 124.557 2.123 . . . . 0.0 115.379 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.34 0.5 OUTLIER 59.76 13.38 3.47 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 118.704 2.853 . . . . 0.0 118.704 178.01 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 34' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' C' ' 34' ' ' LEU . 18.0 mt -87.59 6.58 33.78 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 123.804 0.69 . . . . 0.0 110.399 -177.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -67.71 -32.17 72.63 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.081 0.952 . . . . 0.0 110.239 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 mt -80.18 -50.44 1.16 Allowed Pre-proline 0 N--CA 1.453 -0.298 0 O-C-N 117.346 -3.346 . . . . 0.0 111.627 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -50.23 -44.32 39.01 Favored 'Trans proline' 0 N--CA 1.446 -1.273 1 C-N-CA 126.6 4.867 . . . . 0.0 112.629 171.421 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 33.2 tp -63.72 -51.31 65.53 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 121.562 -0.711 . . . . 0.0 112.448 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 75.7 mt -49.05 -34.76 14.2 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 121.377 3.843 . . . . 0.0 121.377 160.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -71.22 -25.52 62.53 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 121.036 1.744 . . . . 0.0 114.704 167.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 33.3 tp -76.19 -55.5 5.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 21.1 mmt -68.86 -35.17 76.6 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 123.752 1.739 . . . . 0.0 114.696 -165.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 3.8 mp -113.33 130.53 56.25 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 119.411 -2.055 . . . . 0.0 107.113 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 49.8 p -54.83 155.9 7.42 Favored Pre-proline 0 N--CA 1.448 -0.538 0 O-C-N 128.551 3.657 . . . . 0.0 111.931 164.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . 0.305 2.1 Cg_endo -54.86 -26.92 50.68 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 124.347 3.365 . . . . 0.0 116.466 168.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -61.65 -57.06 13.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 124.321 1.013 . . . . 0.0 111.148 166.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -65.39 -27.44 68.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 -178.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 69.8 mtm-85 -77.08 -47.3 20.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 123.133 1.444 . . . . 0.0 107.188 174.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -55.55 -36.72 67.1 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.586 -3.196 . . . . 0.0 113.61 171.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.16 -45.09 86.35 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 119.852 -1.78 . . . . 0.0 112.679 176.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 51' ' ' LEU . . . . . 0.521 HD13 ' CE1' ' D' ' 22' ' ' PHE . 32.5 mt -65.12 -31.05 72.06 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 121.995 2.179 . . . . 0.0 111.918 175.305 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.71 -17.31 66.92 Favored Glycine 0 N--CA 1.444 -0.809 0 O-C-N 117.77 -3.081 . . . . 0.0 119.459 163.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 6.6 m -89.54 -43.53 10.74 Favored 'General case' 0 N--CA 1.45 -0.425 0 O-C-N 127.147 2.322 . . . . 0.0 109.069 178.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -67.44 -26.96 66.66 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 115.578 1.695 . . . . 0.0 115.578 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 4.6 t -62.75 -24.39 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 120.415 1.461 . . . . 0.0 111.066 168.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -97.81 -27.83 14.13 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 117.657 -3.152 . . . . 0.0 109.148 -175.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . 0.294 9.9 mt -49.23 -51.04 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 C-N-CA 127.045 2.138 . . . . 0.0 114.419 159.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 82.6 t -59.79 -64.12 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-N 113.482 -1.69 . . . . 0.0 109.839 170.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -43.87 -50.21 8.05 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 114.907 -2.473 . . . . 0.0 117.07 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -73.8 -19.24 60.81 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 112.798 -3.477 . . . . 0.0 115.712 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 16.4 mt -73.88 -36.15 64.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 128.333 2.653 . . . . 0.0 114.269 162.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 94.8 mt -73.02 -39.36 66.06 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.897 2.079 . . . . 0.0 111.318 169.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 38.0 ttm105 -70.31 -44.21 68.76 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 116.082 -1.913 . . . . 0.0 112.477 171.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.44 15.73 68.55 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 126.101 1.81 . . . . 0.0 116.425 171.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -85.26 42.45 0.95 Allowed 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 116.716 -3.814 . . . . 0.0 113.016 -177.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 46.6 mtt -125.36 143.69 50.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 117.509 2.411 . . . . 0.0 117.509 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 7.3 p -72.89 175.54 6.48 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 119.716 -1.865 . . . . 0.0 108.828 171.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -65.3 -34.9 79.44 Favored 'General case' 0 N--CA 1.45 -0.449 1 O-C-N 116.177 -4.077 . . . . 0.0 111.116 172.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 20.6 ttp-105 -55.98 -60.63 3.2 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 130.704 3.602 . . . . 0.0 110.525 172.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -60.25 -35.54 75.72 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 125.726 1.61 . . . . 0.0 115.291 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 48.5 mt -56.09 -51.84 66.46 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 125.705 1.878 . . . . 0.0 112.579 167.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -67.11 -33.12 74.78 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 118.132 -2.855 . . . . 0.0 113.356 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -95.61 14.34 23.26 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.973 -171.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -150.6 -40.06 0.13 Allowed 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 116.39 -3.944 . . . . 0.0 111.688 -165.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mp -84.29 -33.23 24.02 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.909 -1.12 . . . . 0.0 113.105 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 52.97 -159.29 3.54 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 115.34 -2.922 . . . . 0.0 117.832 -173.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.57 -18.61 62.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 120.483 3.512 . . . . 0.0 120.483 -174.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.7 -20.84 62.25 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 129.542 3.448 . . . . 0.0 114.039 172.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 19.3 tt -46.73 -29.88 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 126.656 2.033 . . . . 0.0 116.4 171.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -85.24 -8.47 58.53 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.563 3.145 . . . . 0.0 108.339 -173.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 70.0 m -76.46 -43.64 39.08 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.564 -3.21 . . . . 0.0 112.469 172.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 31.4 mm -81.99 -39.61 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 112.508 -2.133 . . . . 0.0 115.11 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . 0.292 13.9 p -95.72 -11.8 26.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 120.774 3.62 . . . . 0.0 120.774 -175.573 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -114.09 146.26 40.49 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 117.526 -3.234 . . . . 0.0 109.988 175.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 99.48 -175.91 28.42 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 129.724 3.535 . . . . 0.0 117.276 169.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 3.6 m -68.78 -21.21 64.36 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 126.57 1.948 . . . . 0.0 116.243 -168.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -101.81 -3.0 28.76 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 25.5 p -67.39 162.19 23.54 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 124.04 1.876 . . . . 0.0 112.167 -163.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 7.8 tp -52.82 -39.38 62.38 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 120.365 3.468 . . . . 0.0 120.365 -164.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.353 90.5 mttt -69.97 -28.9 65.92 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 118.693 -2.505 . . . . 0.0 116.551 168.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.49 -24.94 17.08 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -166.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.23 163.2 19.12 Favored Pre-proline 0 N--CA 1.447 -0.594 0 C-N-CA 128.148 2.579 . . . . 0.0 113.44 -159.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.62 134.46 46.73 Favored 'Trans proline' 0 N--CA 1.445 -1.377 0 CA-C-N 126.066 3.202 . . . . 0.0 112.069 176.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 18.1 t -53.17 -37.9 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 130.495 3.518 . . . . 0.0 109.384 -177.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pm0 -79.01 -14.09 59.4 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 128.809 2.844 . . . . 0.0 113.353 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 37.2 tp -86.99 -47.51 8.89 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 118.971 -2.33 . . . . 0.0 111.76 166.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 34.4 mtp-105 -56.93 -43.41 81.46 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 113.03 -1.896 . . . . 0.0 114.2 171.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . 0.28 90.4 mt-30 -59.1 -26.56 64.77 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 117.135 -3.478 . . . . 0.0 117.543 168.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -86.17 -47.89 9.07 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 116.3 -4.0 . . . . 0.0 110.936 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 32.4 mt -53.07 -31.93 44.32 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 116.818 -3.676 . . . . 0.0 114.235 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -75.64 -31.25 59.75 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 122.47 2.396 . . . . 0.0 112.349 172.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -75.42 -22.18 57.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 125.178 2.418 . . . . 0.0 115.165 178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 39.2 t -98.34 -49.95 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 O-C-N 117.295 -3.378 . . . . 0.0 114.927 172.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 60.6 mt -82.42 -19.29 39.32 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 116.075 -1.917 . . . . 0.0 113.97 -171.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 88.0 mt -127.97 18.32 6.65 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 125.639 1.837 . . . . 0.0 109.456 -174.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 47.5 pttt . . . . . 0 N--CA 1.449 -0.517 0 N-CA-C 119.712 3.227 . . . . 0.0 119.712 178.053 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 54.0 p . . . . . 0 N--CA 1.453 -0.283 0 CA-C-O 115.213 -2.327 . . . . 0.0 113.602 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -82.07 -37.74 0.23 Allowed 'Trans proline' 0 N--CA 1.448 -1.185 0 C-N-CA 124.326 3.351 . . . . 0.0 114.42 -177.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -143.68 139.37 29.51 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 114.656 -2.592 . . . . 0.0 114.192 -172.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 14.5 t -59.24 123.95 18.38 Favored 'General case' 0 N--CA 1.451 -0.396 1 CA-C-N 126.513 4.233 . . . . 0.0 114.359 171.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.32 -28.85 69.6 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 128.313 2.645 . . . . 0.0 109.749 173.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.8 -50.33 51.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 130.889 3.676 . . . . 0.0 105.587 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 11.1 mmt -61.45 -37.4 83.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.7 -42.43 83.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 117.999 -1.0 . . . . 0.0 113.468 174.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -65.24 -62.47 1.52 Allowed 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 168.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -44.71 -30.83 1.01 Allowed 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 120.511 1.505 . . . . 0.0 114.841 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.385 0.0 OUTLIER -83.72 -14.74 50.93 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 118.789 -2.444 . . . . 0.0 116.569 -174.401 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -82.76 -32.8 27.63 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 127.249 2.22 . . . . 0.0 111.869 157.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -74.82 -40.46 61.07 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 126.044 2.09 . . . . 0.0 111.023 -175.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -69.9 -6.99 36.65 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 125.92 2.013 . . . . 0.0 115.678 169.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -85.27 -52.7 5.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 128.735 2.814 . . . . 0.0 110.715 170.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 65.6 mt -57.07 -18.5 14.65 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 118.996 2.962 . . . . 0.0 118.996 168.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 59.5 ttt180 -66.94 -31.2 71.63 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 127.531 2.332 . . . . 0.0 109.197 169.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 22' ' ' PHE . . . . . 0.521 ' CE1' HD13 ' C' ' 51' ' ' LEU . 86.5 t80 -87.59 -30.03 20.8 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 126.715 2.51 . . . . 0.0 108.89 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 81.5 t -65.78 -33.72 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 118.144 -2.848 . . . . 0.0 110.948 169.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -73.16 -46.07 52.95 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 127.918 2.487 . . . . 0.0 112.343 169.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 15.5 tp -56.74 -40.77 76.35 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 120.653 1.57 . . . . 0.0 113.626 175.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 tp -77.95 -39.54 42.29 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 115.744 -2.074 . . . . 0.0 114.849 175.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp -53.12 -57.24 11.12 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 122.362 2.346 . . . . 0.0 117.249 165.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -57.95 -32.81 68.19 Favored 'General case' 0 N--CA 1.446 -0.634 1 O-C-N 129.913 4.508 . . . . 0.0 111.456 173.315 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.48 -23.8 50.3 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 121.285 1.857 . . . . 0.0 113.525 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -64.34 -34.15 77.49 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 124.08 3.127 . . . . 0.0 110.72 162.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -89.23 3.5 51.79 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 129.677 3.191 . . . . 0.0 114.279 -173.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 57.3 p30 -135.28 13.68 3.53 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 119.331 0.968 . . . . 0.0 112.945 155.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.262 0.6 OUTLIER 54.24 38.6 29.62 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 117.114 -1.422 . . . . 0.0 111.471 -178.704 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 92.6 mt -86.0 13.68 7.27 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.404 2.366 . . . . 0.0 116.778 155.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.21 -47.7 55.86 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 125.395 1.478 . . . . 0.0 112.086 -164.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 3.6 mt -64.14 -52.32 56.12 Favored Pre-proline 0 N--CA 1.448 -0.53 0 CA-C-O 114.733 -2.556 . . . . 0.0 111.283 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.61 -34.21 14.74 Favored 'Trans proline' 0 N--CA 1.447 -1.233 0 C-N-CA 124.487 3.458 . . . . 0.0 116.642 166.247 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 51.9 tp -85.8 -34.04 21.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.863 2.172 . . . . 0.0 116.863 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 19.9 mt -71.34 -34.31 70.41 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 126.436 3.017 . . . . 0.0 111.676 169.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 19.5 m-20 -72.68 -35.31 67.64 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 117.626 -3.171 . . . . 0.0 111.913 174.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 14.6 tp -68.2 -38.72 82.27 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 123.746 1.736 . . . . 0.0 109.584 169.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.2 mmt -79.03 -38.15 37.26 Favored 'General case' 0 N--CA 1.452 -0.371 1 O-C-N 116.171 -4.081 . . . . 0.0 115.198 -176.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 17.2 mt -109.94 140.22 44.17 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.251 1.42 . . . . 0.0 112.839 -179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 64.0 p -68.51 168.12 15.73 Favored Pre-proline 0 N--CA 1.453 -0.282 0 C-N-CA 128.1 2.56 . . . . 0.0 112.451 167.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -57.8 -42.24 61.33 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.552 3.501 . . . . 0.0 115.831 177.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -81.99 -18.27 43.98 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 126.2 2.187 . . . . 0.0 114.791 -175.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -71.12 -44.21 66.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 170.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 48' ' ' ARG . . . . . 0.498 ' HD2' ' CZ2' ' C' ' 19' ' ' TRP . 41.1 mtm-85 -68.36 -40.42 81.47 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 171.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.06 -38.28 79.04 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 116.377 1.991 . . . . 0.0 116.377 167.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.329 . . -61.51 -43.23 99.24 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.956 -1.715 . . . . 0.0 113.135 168.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.27 -45.77 92.15 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.773 -1.829 . . . . 0.0 115.282 175.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.26 -40.12 91.28 Favored Glycine 0 CA--C 1.525 0.658 0 O-C-N 126.762 2.539 . . . . 0.0 114.279 169.003 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 8.1 m -61.7 -43.53 98.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.286 1.835 . . . . 0.0 114.661 166.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.274 96.7 mtt180 -59.69 -41.98 91.93 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 175.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 55' ' ' VAL . . . . . 0.426 ' H ' HG23 ' D' ' 55' ' ' VAL . 9.1 t -41.28 -59.87 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 O-C-N 120.316 -1.49 . . . . 0.0 113.851 164.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -72.32 -24.11 61.26 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 55.9 mt -71.0 -46.22 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 C-N-CA 127.338 2.255 . . . . 0.0 107.545 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . 0.322 18.7 t -62.68 -39.19 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 174.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -66.91 -52.1 47.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 119.666 -1.896 . . . . 0.0 111.57 170.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -62.38 -31.18 71.8 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 33.1 mt -61.28 -40.45 94.18 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 118.126 2.639 . . . . 0.0 118.126 167.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 42.1 mt -69.84 -34.47 73.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 116.953 -3.592 . . . . 0.0 111.241 167.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 63' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' D' ' 63' ' ' ARG . 30.5 ttm180 -64.96 -47.56 77.18 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 117.351 -3.343 . . . . 0.0 114.945 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 44.93 62.57 2.93 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-O 124.512 2.173 . . . . 0.0 116.884 -174.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -124.63 -35.37 2.74 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.0 -3.059 . . . . 0.0 112.888 170.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 28.6 mtt -75.97 58.75 1.21 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 124.284 3.22 . . . . 0.0 106.797 155.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 88.5 p -82.3 168.1 17.92 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 119.542 -1.974 . . . . 0.0 113.785 -175.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.298 8.0 tp60 69.54 -53.62 0.6 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 120.842 3.645 . . . . 0.0 120.842 167.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . 0.285 74.1 ttt180 -120.92 -33.12 3.82 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.396 2.279 . . . . 0.0 112.567 171.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.77 -26.73 40.58 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 122.675 2.489 . . . . 0.0 112.557 -167.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mt -63.23 -52.78 60.82 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.949 0.9 . . . . 0.0 111.39 174.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -68.19 -26.55 65.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 116.604 -3.81 . . . . 0.0 115.156 173.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -109.86 -26.1 9.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 124.977 3.535 . . . . 0.0 118.502 -173.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -104.52 -44.9 4.78 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 116.422 -1.751 . . . . 0.0 115.599 176.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.77 -41.09 88.27 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 124.29 0.994 . . . . 0.0 110.666 158.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 93.6 -171.05 31.56 Favored Glycine 0 C--N 1.337 0.597 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 155.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -40.13 -32.39 0.17 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 129.281 3.032 . . . . 0.0 117.357 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.73 -23.13 49.29 Favored Glycine 0 C--N 1.338 0.676 0 CA-C-O 116.52 -2.267 . . . . 0.0 118.334 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 6.5 tt -50.01 -16.25 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 131.163 3.785 . . . . 0.0 117.611 170.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . 0.276 . . -84.75 -42.46 15.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 116.546 -3.846 . . . . 0.0 114.052 174.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 96.8 m -59.17 -27.55 65.78 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 125.348 2.499 . . . . 0.0 111.754 171.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 39.0 mm -100.12 -25.32 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 O-C-N 120.204 -1.56 . . . . 0.0 112.262 -170.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 44.9 p -109.54 5.19 22.94 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 173.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 41.4 mtp85 -125.05 159.96 30.13 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.664 0.745 . . . . 0.0 109.844 172.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 87.98 151.66 22.58 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-O 125.247 2.582 . . . . 0.0 113.236 -170.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 35.7 p -84.68 2.47 41.63 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 109.58 -3.31 . . . . 0.0 116.971 -153.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -123.41 29.5 6.62 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.268 1.027 . . . . 0.0 112.888 159.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 2.1 p -63.16 173.86 1.34 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 117.198 -1.801 . . . . 0.0 114.571 169.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.6 -21.82 54.39 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 119.846 3.276 . . . . 0.0 119.846 163.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -78.49 -12.41 60.01 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 122.78 1.276 . . . . 0.0 113.328 169.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -123.75 1.07 8.76 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 113.331 -1.759 . . . . 0.0 112.536 -169.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 92' ' ' ALA . . . . . 0.472 ' HB1' HG22 ' D' ' 94' ' ' VAL . . . 39.55 95.86 0.04 OUTLIER Pre-proline 0 N--CA 1.451 -0.392 0 C-N-CA 127.727 2.411 . . . . 0.0 108.76 144.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 93' ' ' PRO . . . . . 0.47 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 84.9 Cg_exo 32.15 35.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.257 0 N-CA-C 119.587 2.88 . . . . 0.0 119.587 32.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 94' ' ' VAL . . . . . 0.472 HG22 ' HB1' ' D' ' 92' ' ' ALA . 39.8 t -60.32 -25.9 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-O 117.263 -1.351 . . . . 0.0 107.665 -176.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.9 -25.21 28.08 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 126.252 2.22 . . . . 0.0 110.886 -171.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 29.4 tp -72.42 -35.75 68.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 124.038 0.836 . . . . 0.0 113.092 162.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -62.61 -53.15 58.93 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 123.205 1.478 . . . . 0.0 113.789 176.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -51.88 -39.94 59.83 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 118.776 -2.453 . . . . 0.0 111.031 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -73.4 -33.39 64.97 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 120.44 -1.412 . . . . 0.0 108.298 -166.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 61.2 mt -81.11 -31.98 34.05 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -174.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.19 -31.12 72.18 Favored 'General case' 0 N--CA 1.447 -0.577 1 CA-C-O 111.471 -4.109 . . . . 0.0 109.828 175.346 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -89.76 -36.71 15.0 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 126.727 2.517 . . . . 0.0 111.12 -177.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.377 41.8 t -78.8 -36.0 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 C-N-CA 128.508 2.723 . . . . 0.0 113.509 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 60.5 mt -96.15 -39.09 9.87 Favored 'General case' 0 N--CA 1.447 -0.61 1 CA-C-O 111.285 -4.198 . . . . 0.0 108.109 -175.26 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 17.6 mt -90.93 14.74 12.96 Favored 'General case' 0 N--CA 1.452 -0.347 1 CA-C-N 127.333 4.606 . . . . 0.0 113.453 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -44.46 156.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 162.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -7.76 52.48 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 127.917 3.722 . . . . 0.0 117.148 -160.131 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 129.555 3.142 . . . . 0.0 109.434 -179.772 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.6 ttp . . . . . 0 N--CA 1.45 -0.442 0 N-CA-C 111.216 0.08 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.58 -54.44 45.9 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -51.15 -44.04 61.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.229 2.611 . . . . 0.0 114.054 166.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -66.7 -41.02 88.7 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 113.317 -3.23 . . . . 0.0 111.951 173.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -67.47 -23.27 65.48 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 122.756 2.525 . . . . 0.0 112.647 168.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 25.1 t60 -71.82 -44.38 64.0 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 119.06 2.985 . . . . 0.0 119.06 177.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -56.15 -26.64 51.16 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 166.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -70.85 -36.9 73.07 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 123.308 2.776 . . . . 0.0 111.302 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -58.92 -42.6 90.09 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 125.944 1.698 . . . . 0.0 114.845 166.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.8 mt -70.3 -8.69 52.34 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 -71.45 -36.74 71.35 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.784 1.633 . . . . 0.0 107.996 177.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.66 -51.24 58.39 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.977 1.711 . . . . 0.0 111.886 174.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 t -57.39 -41.07 77.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 117.952 2.575 . . . . 0.0 117.952 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -61.19 -50.45 73.1 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 118.29 2.7 . . . . 0.0 118.29 161.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.9 tp -58.28 -36.55 73.45 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.115 -1.857 . . . . 0.0 109.589 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 54.2 tp -72.98 -43.93 61.66 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 116.345 -1.788 . . . . 0.0 108.846 -177.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -44.62 -60.8 1.82 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.854 1.262 . . . . 0.0 109.42 167.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -71.32 -19.2 62.34 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -171.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.54 -33.06 62.66 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 117.708 -3.12 . . . . 0.0 111.861 173.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -63.43 -26.07 68.56 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 116.762 -1.59 . . . . 0.0 112.823 170.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -91.38 12.95 18.87 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.128 1.786 . . . . 0.0 111.48 -176.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -137.9 3.16 2.44 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 130.14 3.376 . . . . 0.0 112.695 173.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 61.77 32.12 18.29 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 120.564 -1.335 . . . . 0.0 111.765 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.274 28.6 mt -105.54 -0.78 25.51 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 126.045 1.738 . . . . 0.0 114.306 172.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -58.35 -42.01 85.92 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 114.941 -2.457 . . . . 0.0 116.212 -176.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.292 6.5 mt -66.54 -47.89 56.45 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-N 123.281 2.764 . . . . 0.0 111.618 172.16 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -49.2 -46.63 25.05 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 122.496 2.13 . . . . 0.0 115.616 163.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . 0.265 26.4 tp -68.63 -41.23 79.74 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.986 1.374 . . . . 0.0 110.741 -177.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.8 mt -74.8 -14.36 60.68 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 117.975 -2.953 . . . . 0.0 116.862 175.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . 0.351 3.9 m-80 -72.44 -23.99 61.15 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 117.503 -3.248 . . . . 0.0 112.727 163.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.0 tt -85.7 -52.49 5.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 128.863 2.865 . . . . 0.0 112.808 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.323 83.4 mmm -68.42 -42.84 78.37 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 109.891 -3.322 . . . . 0.0 112.46 -168.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.9 mt -110.4 142.51 42.01 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.939 1.296 . . . . 0.0 109.406 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 p -84.75 151.64 58.48 Favored Pre-proline 0 N--CA 1.447 -0.579 0 C-N-CA 127.888 2.475 . . . . 0.0 113.787 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -58.34 -40.71 73.07 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 CA-C-N 126.351 3.304 . . . . 0.0 116.756 -157.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -65.34 -16.31 63.46 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 116.901 -3.624 . . . . 0.0 113.483 172.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -87.64 -28.66 21.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 119.796 1.18 . . . . 0.0 112.711 169.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 38.0 mtm-85 -75.18 -44.93 43.83 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 124.523 1.139 . . . . 0.0 108.225 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.72 -38.48 69.79 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 116.341 1.978 . . . . 0.0 116.341 167.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.64 -37.95 62.63 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.451 HD22 ' CE2' ' B' ' 22' ' ' PHE . 73.5 mt -62.3 -32.98 73.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 114.796 -2.526 . . . . 0.0 115.058 166.232 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.72 -32.0 68.74 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 123.065 2.666 . . . . 0.0 109.614 168.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.1 m -89.62 -28.42 19.53 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 115.578 -2.449 . . . . 0.0 110.149 -164.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -62.48 -21.23 65.31 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 126.152 2.158 . . . . 0.0 111.244 174.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.81 -49.39 82.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 115.178 -2.344 . . . . 0.0 109.76 169.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -68.33 -24.66 64.86 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 126.272 2.233 . . . . 0.0 116.711 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 55.8 mt -73.26 -47.57 46.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 116.539 -1.696 . . . . 0.0 109.267 168.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 17.1 t -65.12 -20.52 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 122.784 2.538 . . . . 0.0 110.958 171.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -74.73 -49.84 19.62 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 117.982 -2.949 . . . . 0.0 109.64 167.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -79.39 -25.67 42.08 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 120.375 1.443 . . . . 0.0 111.168 -169.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.31 -43.1 98.78 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.081 1.352 . . . . 0.0 111.266 161.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 51.7 tp -76.29 -38.69 55.78 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 123.083 2.674 . . . . 0.0 109.037 -172.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.1 ttm105 -60.34 -31.68 70.54 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 117.254 2.316 . . . . 0.0 117.254 165.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.27 2.36 4.03 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 120.877 3.111 . . . . 0.0 120.877 177.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -85.48 -47.78 9.59 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 129.927 3.291 . . . . 0.0 110.695 -166.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 36.3 ttm -73.65 142.29 46.47 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 126.509 2.38 . . . . 0.0 110.484 167.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.2 p -102.27 170.1 8.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 119.581 3.178 . . . . 0.0 119.581 175.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -58.12 -38.14 75.94 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 113.707 1.002 . . . . 0.0 113.707 -174.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -63.48 -39.84 95.51 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 116.879 2.177 . . . . 0.0 116.879 175.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -70.73 -35.14 72.55 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 127.495 2.318 . . . . 0.0 113.493 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . 0.285 56.0 mt -63.15 -40.94 99.04 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 123.284 1.516 . . . . 0.0 111.795 175.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -63.5 -17.72 63.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 114.049 -2.881 . . . . 0.0 111.251 -175.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -89.63 -64.34 1.15 Allowed 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 120.54 1.518 . . . . 0.0 109.5 158.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -65.98 -21.0 66.38 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 118.472 2.768 . . . . 0.0 118.472 -159.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.5 mt -130.49 7.33 4.89 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.875 1.27 . . . . 0.0 110.77 168.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.33 31.73 80.32 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-O 114.852 -3.193 . . . . 0.0 113.132 173.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -94.21 118.48 31.64 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.084 2.554 . . . . 0.0 110.18 -168.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.09 125.78 38.48 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 128.655 3.026 . . . . 0.0 108.477 172.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 92.3 mt -54.84 -47.08 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 120.3 2.05 . . . . 0.0 112.055 -163.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -50.73 -41.0 55.9 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 122.197 2.271 . . . . 0.0 114.564 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 19.1 p -69.83 -25.89 63.97 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 127.61 2.364 . . . . 0.0 113.719 -174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 25.7 mm -76.5 -40.16 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 165.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.6 m -62.66 -31.36 72.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.695 -2.503 . . . . 0.0 109.21 -173.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -78.81 -40.05 33.97 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 124.878 2.275 . . . . 0.0 111.962 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.61 -26.14 72.87 Favored Glycine 0 N--CA 1.449 -0.491 0 O-C-N 119.653 -1.904 . . . . 0.0 114.393 175.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.5 m -64.45 -48.33 75.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.496 2.318 . . . . 0.0 112.807 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.461 ' HA ' ' HB2' ' A' ' 90' ' ' LYS . 75.2 m-20 -75.49 -21.08 58.35 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 114.711 -2.796 . . . . 0.0 114.514 173.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.3 m -73.69 -28.93 61.99 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 117.601 -3.187 . . . . 0.0 114.571 168.16 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.3 tp -77.52 -27.38 51.72 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 117.631 -3.168 . . . . 0.0 109.138 172.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.461 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 41.3 mttm -69.05 -20.43 64.11 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 112.138 -3.792 . . . . 0.0 108.398 166.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -99.37 -26.9 13.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 125.579 3.809 . . . . 0.0 119.27 177.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.27 140.81 97.75 Favored Pre-proline 0 N--CA 1.449 -0.481 0 O-C-N 125.685 1.866 . . . . 0.0 108.56 168.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -83.83 158.42 13.89 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 121.537 1.491 . . . . 0.0 111.974 -165.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.6 m -61.11 -35.08 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 114.572 -2.632 . . . . 0.0 112.887 178.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.446 24.2 pm0 -53.05 -33.7 53.12 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 122.409 2.368 . . . . 0.0 116.378 163.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 15.6 tp -81.69 -51.12 8.52 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.908 -2.995 . . . . 0.0 108.453 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.3 mtm180 -60.35 -49.67 76.67 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.385 1.564 . . . . 0.0 112.933 -173.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.03 -17.8 64.93 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 126.288 2.947 . . . . 0.0 114.05 -177.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -91.44 -27.64 18.16 Favored 'General case' 0 N--CA 1.447 -0.602 1 O-C-N 114.885 -4.884 . . . . 0.0 110.366 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.5 mt -68.65 -18.01 64.21 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 118.11 2.633 . . . . 0.0 118.11 161.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -67.06 -28.04 67.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 120.36 1.437 . . . . 0.0 111.676 176.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -82.82 -4.51 58.13 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 118.757 -1.177 . . . . 0.0 113.99 -176.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 42.5 t -114.0 -47.71 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 124.443 1.097 . . . . 0.0 113.25 -173.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.5 mt -97.42 -23.67 15.97 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.319 1.048 . . . . 0.0 111.611 -172.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 14.5 mt -112.59 -25.57 9.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.1 tttp . . . . . 0 N--CA 1.45 -0.471 0 CA-C-N 122.245 2.293 . . . . 0.0 114.435 -165.033 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 116.767 2.136 . . . . 0.0 116.767 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 27.4 mtt -67.99 -36.1 79.43 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 122.228 2.285 . . . . 0.0 114.216 165.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.08 -49.37 60.8 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 118.216 2.673 . . . . 0.0 118.216 167.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 tp10 -57.48 -42.18 82.13 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 112.719 -2.037 . . . . 0.0 113.968 168.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -63.39 -42.49 98.8 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 112.657 -3.544 . . . . 0.0 112.028 176.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -69.88 -34.76 73.99 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.673 2.483 . . . . 0.0 114.405 174.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -60.61 -36.61 79.0 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.039 1.745 . . . . 0.0 110.998 170.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -83.85 -31.16 25.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 126.2 1.8 . . . . 0.0 109.635 -174.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -72.92 -34.22 66.46 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 115.491 -2.195 . . . . 0.0 107.902 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -67.34 -25.81 66.18 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 122.329 2.331 . . . . 0.0 112.975 167.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 49.7 mt -65.18 -23.04 66.99 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 123.212 2.733 . . . . 0.0 115.095 176.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -72.49 -20.86 61.3 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.119 1.767 . . . . 0.0 113.208 174.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' PHE . . . . . 0.451 ' CE2' HD22 ' A' ' 51' ' ' LEU . 84.7 t80 -71.61 -47.87 51.76 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 117.571 -1.205 . . . . 0.0 112.11 168.21 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 33.8 t -61.96 -41.57 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 C-N-CA 126.439 1.896 . . . . 0.0 113.908 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -68.28 -45.18 73.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 173.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 37.2 tp -61.88 -42.28 98.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 -174.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 25.9 tp -76.21 -31.4 58.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.749 2.02 . . . . 0.0 108.628 -177.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -50.41 -42.72 54.22 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 123.406 2.821 . . . . 0.0 112.767 168.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -89.38 -9.42 50.4 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 127.452 2.97 . . . . 0.0 115.102 -177.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.59 -42.85 21.54 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.826 2.05 . . . . 0.0 110.261 178.066 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -63.36 -34.94 78.8 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 118.041 -2.912 . . . . 0.0 107.262 170.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -75.77 4.36 8.09 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 118.846 -2.409 . . . . 0.0 116.305 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -128.91 -1.03 5.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 113.889 -1.505 . . . . 0.0 110.235 168.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.417 46.5 m-20 64.7 23.04 12.71 Favored 'General case' 0 N--CA 1.447 -0.582 2 O-C-N 115.117 -4.739 . . . . 0.0 116.749 -168.33 . . . . . . . . 3 2 . 1 . 008 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.278 83.4 mt -99.02 5.48 47.08 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.063 1.745 . . . . 0.0 111.793 174.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 14.3 p-80 -58.14 -54.31 48.36 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.797 1.239 . . . . 0.0 113.435 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 28.0 mt -62.88 -47.82 86.29 Favored Pre-proline 0 N--CA 1.448 -0.526 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.67 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -60.02 -24.03 75.17 Favored 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 124.497 3.465 . . . . 0.0 116.057 171.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . 0.329 43.2 tp -76.03 -52.07 10.97 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 125.594 1.809 . . . . 0.0 114.779 169.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . 0.307 17.3 mt -53.28 -49.69 66.42 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 124.925 1.391 . . . . 0.0 110.833 174.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -64.64 -17.77 64.34 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 119.898 -1.751 . . . . 0.0 112.831 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 12.0 tp -93.67 -30.28 15.0 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 9.0 mmt -84.05 -26.13 29.31 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 5.0 mt -126.75 134.38 50.65 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 126.288 1.835 . . . . 0.0 111.688 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 81.5 p -85.17 160.3 54.99 Favored Pre-proline 0 N--CA 1.45 -0.434 0 C-N-CA 126.006 1.723 . . . . 0.0 107.758 176.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -52.11 -30.66 41.78 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 N-CA-C 121.111 3.466 . . . . 0.0 121.111 -172.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.62 -32.66 64.17 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 124.579 1.174 . . . . 0.0 110.788 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.33 -32.7 62.92 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.567 1.947 . . . . 0.0 109.339 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 -70.6 -45.04 66.03 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 127.663 2.385 . . . . 0.0 110.102 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -63.98 -38.36 90.79 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.6 1.56 . . . . 0.0 114.014 168.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.31 -53.56 56.9 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 120.632 1.56 . . . . 0.0 112.879 167.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 27.4 mt -52.22 -38.87 59.24 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 114.631 -2.604 . . . . 0.0 117.33 175.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.75 -56.65 24.11 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 127.679 2.561 . . . . 0.0 111.768 166.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 13.6 m -74.67 -22.82 58.68 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 124.419 2.057 . . . . 0.0 113.927 -169.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 58.8 mtt180 -58.38 -37.14 74.64 Favored 'General case' 0 N--CA 1.449 -0.486 1 O-C-N 114.887 -4.883 . . . . 0.0 113.352 169.09 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 97.9 t -68.91 -36.81 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 124.057 0.943 . . . . 0.0 109.757 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -75.72 -33.3 60.29 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.038 -1.039 . . . . 0.0 110.304 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 54.0 mt -69.62 -47.14 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 120.401 1.455 . . . . 0.0 110.611 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.258 59.5 t -74.86 -21.01 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 O-C-N 124.479 1.112 . . . . 0.0 113.527 177.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -72.44 -38.53 68.29 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 119.286 -2.134 . . . . 0.0 113.01 175.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -61.71 -30.62 70.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.562 1.145 . . . . 0.0 109.127 171.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 1.1 mt -78.49 -26.19 45.93 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 117.893 -3.004 . . . . 0.0 111.153 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 89.4 mt -83.93 -19.92 33.86 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 119.606 3.188 . . . . 0.0 119.606 166.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 23.5 ttm105 -89.53 -71.75 0.59 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 115.976 -1.964 . . . . 0.0 111.022 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.59 75.11 1.22 Allowed Glycine 0 C--N 1.335 0.478 0 C-N-CA 125.928 1.728 . . . . 0.0 109.68 -171.181 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -140.5 9.62 2.24 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 121.04 2.42 . . . . 0.0 112.338 173.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 22.1 mtt -119.02 143.77 46.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 116.368 -3.957 . . . . 0.0 114.266 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 26.7 p -77.61 162.25 27.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 130.71 3.604 . . . . 0.0 112.739 164.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . 0.258 45.4 mt-30 -67.08 -33.5 75.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 -171.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -58.86 -45.31 90.45 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 160.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -59.71 -36.9 77.46 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 121.075 1.761 . . . . 0.0 112.53 171.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.417 HD23 HD12 ' B' ' 75' ' ' LEU . 90.9 mt -63.49 -33.04 74.7 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.458 175.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -84.72 -31.5 24.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.91 2.084 . . . . 0.0 112.956 -177.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -130.54 -19.69 3.01 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 117.61 -3.181 . . . . 0.0 114.422 -167.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -87.17 -13.37 44.2 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 160.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.417 HD12 HD23 ' B' ' 71' ' ' LEU . 96.6 mt -132.56 -43.74 0.91 Allowed 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.671 -3.143 . . . . 0.0 114.848 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 98.69 4.04 57.09 Favored Glycine 0 CA--C 1.522 0.476 0 CA-C-O 124.136 1.964 . . . . 0.0 110.257 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.72 80.02 6.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 117.218 -3.519 . . . . 0.0 113.066 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.42 -179.33 5.22 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-O 126.593 3.33 . . . . 0.0 110.97 159.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 45.5 mt -61.68 -40.5 86.98 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 O-C-N 117.354 -3.439 . . . . 0.0 112.407 -168.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.26 87.77 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 120.667 -1.271 . . . . 0.0 114.208 171.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 21.6 m -66.43 -34.83 78.83 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.927 1.291 . . . . 0.0 114.121 -178.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mm -81.36 -41.01 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 115.278 -2.296 . . . . 0.0 106.731 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 4.7 m -64.25 -47.54 79.24 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 131.256 3.823 . . . . 0.0 113.055 174.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 19.4 ttt180 -57.59 -51.09 70.89 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 117.237 -1.785 . . . . 0.0 114.691 167.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -45.63 -44.87 12.33 Favored Glycine 0 C--N 1.334 0.471 0 CA-C-O 115.508 -2.829 . . . . 0.0 114.94 173.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 4.3 p -77.86 -36.93 49.3 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 126.542 1.966 . . . . 0.0 112.37 -176.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -62.63 -37.57 86.83 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 106.552 -1.648 . . . . 0.0 106.552 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 68.5 m -67.31 -29.03 68.5 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 126.934 3.254 . . . . 0.0 114.712 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 70.6 mt -77.7 -38.44 47.38 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 117.706 -3.121 . . . . 0.0 116.377 173.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 52.6 tttm -64.48 -41.76 96.28 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.309 1.444 . . . . 0.0 108.801 168.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.15 -23.08 62.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 118.591 -2.568 . . . . 0.0 113.474 177.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.41 147.56 98.56 Favored Pre-proline 0 N--CA 1.448 -0.575 0 CA-C-N 121.6 2.0 . . . . 0.0 113.474 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -72.03 162.11 42.79 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 123.989 3.126 . . . . 0.0 113.315 167.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 28.0 m -82.86 -16.31 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 1 O-C-N 115.586 -4.446 . . . . 0.0 117.274 -170.364 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -65.24 -8.15 16.28 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.779 1.632 . . . . 0.0 114.23 163.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 31.7 tp -112.66 -52.14 2.8 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 104.457 -2.423 . . . . 0.0 104.457 -177.276 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . 0.275 17.8 mtp180 -58.16 -37.29 74.41 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 124.437 1.086 . . . . 0.0 112.42 -175.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -79.41 -33.91 42.24 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 127.281 2.233 . . . . 0.0 112.822 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 81.3 t90 -71.59 -39.39 70.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 121.284 -0.885 . . . . 0.0 112.359 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 86.8 mt -63.3 -30.34 71.49 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.659 170.279 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -54.73 -40.75 69.59 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 119.192 3.034 . . . . 0.0 119.192 169.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -97.09 -1.61 44.91 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.521 1.528 . . . . 0.0 113.797 -170.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 25.8 t -113.59 -36.9 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 O-C-N 118.226 -2.797 . . . . 0.0 109.174 176.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 55.7 mt -84.26 -75.71 0.33 Allowed 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 119.979 -1.701 . . . . 0.0 107.18 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 20.9 mt -47.73 -41.1 22.17 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 -165.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.01 3.32 4.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 115.048 -2.406 . . . . 0.0 113.674 178.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 56.4 m -94.92 9.12 40.5 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 115.213 1.561 . . . . 0.0 115.213 166.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 . . . . . 0 C--O 1.251 1.146 0 O-C-N 117.709 -3.12 . . . . 0.0 115.433 164.584 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 22.6 ttt . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.66 172.58 10.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 118.097 2.629 . . . . 0.0 118.097 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -89.67 152.27 21.45 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 66.3 tt0 -130.66 141.13 50.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 120.623 1.556 . . . . 0.0 113.464 155.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 7.9 p -124.74 148.73 60.23 Favored Pre-proline 0 N--CA 1.448 -0.53 0 O-C-N 120.076 -1.64 . . . . 0.0 114.567 -173.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -67.18 -19.8 50.35 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.259 1.973 . . . . 0.0 115.848 169.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -156.02 148.48 23.72 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 128.546 2.738 . . . . 0.0 111.36 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.8 t -147.81 127.72 13.56 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 125.301 1.626 . . . . 0.0 113.021 174.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.78 62.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 126.953 2.658 . . . . 0.0 110.807 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.53 -22.48 63.57 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 129.368 3.067 . . . . 0.0 114.034 167.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 23.0 mtt -81.57 -44.3 17.48 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 118.123 -2.861 . . . . 0.0 113.202 164.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.55 69.18 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 118.998 2.962 . . . . 0.0 118.998 177.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -76.62 -38.67 54.33 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 113.808 -1.542 . . . . 0.0 113.213 168.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -56.54 -43.41 79.86 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.909 -2.369 . . . . 0.0 113.9 170.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -47.74 83.86 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 130.107 3.363 . . . . 0.0 113.538 168.181 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -45.78 -49.36 15.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 162.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -69.9 -33.98 72.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 176.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.22 -27.7 67.45 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 115.955 -2.298 . . . . 0.0 113.462 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -73.13 -52.75 13.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 126.671 1.988 . . . . 0.0 112.869 169.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . 0.272 1.0 OUTLIER -62.03 -18.91 62.11 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 115.551 -2.166 . . . . 0.0 110.085 178.598 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -81.55 -44.23 17.61 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 114.935 -2.46 . . . . 0.0 112.644 176.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -48.89 -38.84 23.78 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 118.629 2.826 . . . . 0.0 118.629 171.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 43.7 t -75.04 -34.65 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 C-N-CA 127.526 2.33 . . . . 0.0 113.673 177.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -74.86 -39.54 61.5 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 122.662 2.483 . . . . 0.0 115.908 172.095 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 37.4 tp -55.59 -34.18 64.61 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 117.631 -3.168 . . . . 0.0 114.661 169.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . 0.283 30.5 tp -71.72 -32.52 67.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.52 1.928 . . . . 0.0 113.166 170.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -69.15 -34.3 74.76 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 125.603 1.814 . . . . 0.0 111.911 172.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 30.1 m-20 -73.17 -38.17 66.27 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 116.448 -3.907 . . . . 0.0 109.627 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.4 -32.64 65.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.723 2.809 . . . . 0.0 118.171 176.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -68.11 -18.25 64.59 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.642 1.977 . . . . 0.0 115.341 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -76.08 -23.32 55.0 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -174.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 19.5 p-10 -141.06 39.08 1.78 Allowed 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 127.417 2.287 . . . . 0.0 112.432 -166.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.345 0.8 OUTLIER 31.86 46.86 0.06 Allowed 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 118.405 2.743 . . . . 0.0 118.405 -176.073 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 27.3 mt -99.3 -2.49 36.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.619 2.081 . . . . 0.0 116.619 163.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 -58.28 -49.73 76.11 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 126.726 3.155 . . . . 0.0 110.875 -174.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 18.6 mt -74.03 -41.1 5.16 Favored Pre-proline 0 N--CA 1.447 -0.604 0 O-C-N 116.325 -3.985 . . . . 0.0 110.633 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -56.93 -39.87 88.25 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 124.26 3.306 . . . . 0.0 108.536 170.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 54.7 tp -77.96 -29.14 49.68 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 117.554 2.428 . . . . 0.0 117.554 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 51.5 mt -67.03 -23.31 65.89 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 117.254 -1.355 . . . . 0.0 113.758 161.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -91.31 -25.12 19.59 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 118.773 -1.171 . . . . 0.0 111.605 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.32 -54.34 46.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 119.029 -2.294 . . . . 0.0 112.038 159.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 21.5 mmt -72.05 -36.92 69.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 119.169 3.025 . . . . 0.0 119.169 -171.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.2 mp -105.66 144.21 32.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 117.837 2.532 . . . . 0.0 117.837 -175.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 67.0 p -78.38 161.7 69.02 Favored Pre-proline 0 N--CA 1.448 -0.527 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 166.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -47.8 -43.31 29.39 Favored 'Trans proline' 0 N--CA 1.447 -1.255 0 C-N-CA 124.81 3.673 . . . . 0.0 112.725 166.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -58.0 -42.49 85.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 172.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -68.6 -35.43 77.33 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 127.296 3.427 . . . . 0.0 114.239 -174.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 39.5 mtm-85 -73.52 -37.64 65.58 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 118.901 -2.374 . . . . 0.0 111.735 172.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -66.04 -36.59 83.64 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 125.444 1.715 . . . . 0.0 114.818 170.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.08 96.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 128.998 2.919 . . . . 0.0 107.975 177.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 57.4 mt -84.86 -31.73 23.61 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 117.19 -3.444 . . . . 0.0 111.969 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.52 -37.85 50.38 Favored Glycine 0 CA--C 1.526 0.725 0 O-C-N 126.768 2.542 . . . . 0.0 115.049 158.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 25.8 m -77.49 -40.11 44.08 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 33.5 mtt180 -72.99 -24.95 60.83 Favored 'General case' 0 N--CA 1.448 -0.525 1 CA-C-O 110.55 -4.548 . . . . 0.0 113.405 -173.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 80.3 t -62.54 -41.93 93.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 122.623 2.465 . . . . 0.0 111.991 163.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -76.06 -29.58 58.05 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 118.574 2.805 . . . . 0.0 118.574 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 63.5 mt -59.14 -42.1 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 O-C-N 118.805 -2.434 . . . . 0.0 111.942 166.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 66.8 t -59.41 -49.26 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 C-N-CA 126.176 1.791 . . . . 0.0 111.591 174.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -64.51 -38.5 91.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 113.172 -1.831 . . . . 0.0 110.585 -172.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -73.08 -33.7 65.77 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 117.391 -3.318 . . . . 0.0 114.93 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 87.1 mt -76.36 -13.57 60.13 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 169.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 55.7 mt -93.07 -15.92 25.56 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 120.738 1.608 . . . . 0.0 108.759 170.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -94.41 -34.91 12.57 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 120.51 1.505 . . . . 0.0 113.121 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.71 3.9 74.48 Favored Glycine 0 C--N 1.339 0.739 1 CA-C-O 110.552 -5.582 . . . . 0.0 113.827 165.722 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -93.24 58.36 2.85 Favored 'General case' 0 N--CA 1.444 -0.758 1 CA-C-N 124.327 4.064 . . . . 0.0 112.365 -154.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 20.3 mtt -147.16 144.4 28.95 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 125.073 1.483 . . . . 0.0 111.62 -167.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . 0.275 83.0 p -64.83 162.2 16.69 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 158.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -52.21 -41.74 62.95 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 129.44 3.096 . . . . 0.0 112.952 166.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 34.0 ttp-105 -53.2 -62.98 1.3 Allowed 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 128.644 3.715 . . . . 0.0 110.022 170.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -51.84 -51.82 53.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 123.931 0.77 . . . . 0.0 113.034 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 53.7 mt -50.94 -48.46 60.86 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 121.417 1.917 . . . . 0.0 114.278 174.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 54.5 tttt -62.31 -46.78 87.2 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 121.465 1.939 . . . . 0.0 106.536 -171.118 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -77.18 -35.45 55.82 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 115.784 -2.055 . . . . 0.0 116.535 -177.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -79.67 -36.95 36.91 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 118.155 2.65 . . . . 0.0 118.155 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.252 7.3 mp -94.39 -27.81 15.86 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 126.011 2.07 . . . . 0.0 110.728 -176.425 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.18 -149.33 49.94 Favored Glycine 0 CA--C 1.523 0.581 0 O-C-N 119.946 -1.721 . . . . 0.0 113.134 -175.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -52.82 -23.06 6.19 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 116.062 1.875 . . . . 0.0 116.062 163.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.28 -7.61 84.96 Favored Glycine 0 C--N 1.337 0.595 0 CA-C-O 114.855 -3.192 . . . . 0.0 112.794 -169.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 7.4 tt -59.05 -44.15 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 1 CA-C-O 111.512 -4.089 . . . . 0.0 113.155 167.609 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.53 -22.66 60.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 124.682 3.401 . . . . 0.0 113.871 172.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 8.5 m -64.66 -39.14 93.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.882 1.273 . . . . 0.0 107.665 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 36.8 mm -83.11 -33.73 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 119.327 -2.108 . . . . 0.0 114.384 170.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.6 p -105.06 9.56 34.31 Favored 'General case' 0 N--CA 1.449 -0.482 1 N-CA-C 122.846 4.387 . . . . 0.0 122.846 -164.152 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 20.7 mtp85 -128.14 145.56 50.98 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 118.032 -2.917 . . . . 0.0 113.086 -178.046 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 96.01 166.95 34.46 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 67.3 m -65.29 -30.97 71.88 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -171.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -98.79 6.48 46.87 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -173.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 51.6 p -55.86 158.67 3.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 130.946 3.699 . . . . 0.0 114.627 165.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 48.9 tp -61.81 -32.57 72.89 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 129.664 3.186 . . . . 0.0 111.066 -151.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.25 87.1 mttt -98.59 12.39 35.43 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 120.006 3.336 . . . . 0.0 120.006 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -136.19 -11.45 1.93 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 130.457 3.503 . . . . 0.0 115.217 -179.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.5 161.38 0.33 Allowed Pre-proline 0 N--CA 1.45 -0.47 0 C-N-CA 129.815 3.246 . . . . 0.0 113.14 166.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -49.66 138.61 32.4 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 123.745 2.964 . . . . 0.0 113.46 162.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 87.5 t -61.89 -31.7 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 128.841 2.856 . . . . 0.0 110.021 -177.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 12.7 pm0 -67.44 -34.6 77.54 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 116.853 -3.654 . . . . 0.0 114.288 -176.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 9.2 tp -73.0 -42.91 62.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.689 1.996 . . . . 0.0 110.1 174.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 70.0 mtp180 -61.53 -49.43 76.72 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 125.654 1.846 . . . . 0.0 112.082 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -73.51 -37.69 65.6 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 127.406 2.282 . . . . 0.0 109.289 -176.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.1 t90 -51.6 -56.9 10.93 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 163.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 100' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' C' ' 100' ' ' LEU . 55.6 mt -65.75 -17.51 64.67 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 120.107 -1.621 . . . . 0.0 111.975 -174.201 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -88.98 -25.95 21.75 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 122.819 2.554 . . . . 0.0 114.954 166.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.46 -12.89 61.28 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 169.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.16 -48.7 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 C-N-CA 127.005 2.122 . . . . 0.0 113.659 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 96.1 mt -85.12 -31.02 23.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 121.888 2.131 . . . . 0.0 112.635 -169.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.1 27.74 8.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 121.034 1.743 . . . . 0.0 113.695 -168.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 14.8 pttp . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 117.214 -1.374 . . . . 0.0 113.049 -169.1 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 53.6 p . . . . . 0 N--CA 1.445 -0.697 0 CA-C-O 117.718 -1.134 . . . . 0.0 110.767 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . 0.275 15.7 Cg_exo -68.01 -24.25 39.46 Favored 'Trans proline' 0 N--CA 1.451 -0.992 1 C-N-CA 125.851 4.367 . . . . 0.0 114.147 177.171 . . . . . . . . 3 2 . 1 . 008 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -149.75 145.32 26.58 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-O 113.449 -3.167 . . . . 0.0 109.362 169.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 1.9 t -79.8 130.39 35.28 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 127.424 2.952 . . . . 0.0 108.112 173.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.37 -40.58 59.5 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 128.011 3.319 . . . . 0.0 110.905 162.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.03 -36.06 77.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 115.938 1.829 . . . . 0.0 115.938 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.269 14.0 mmt -62.05 -39.79 93.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.718 -1.134 . . . . 0.0 109.746 165.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.21 -20.46 62.81 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 122.371 2.35 . . . . 0.0 116.504 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -88.6 -44.6 10.52 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 119.152 -2.218 . . . . 0.0 107.381 171.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -62.0 -44.0 97.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.045 -1.659 . . . . 0.0 110.703 -172.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -27.97 69.78 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.27 1.952 . . . . 0.0 116.27 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -74.65 -34.21 62.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.107 1.763 . . . . 0.0 109.2 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -81.73 -23.11 36.91 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 118.003 -2.936 . . . . 0.0 112.123 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . 0.253 59.4 mt-10 -70.39 -26.03 63.52 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 117.836 -3.04 . . . . 0.0 111.848 161.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 5.9 t-105 -82.04 -35.89 28.31 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 117.019 -1.467 . . . . 0.0 113.44 174.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.49 -25.99 68.51 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 117.0 -1.476 . . . . 0.0 110.336 173.039 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -73.55 -20.77 60.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 130.58 3.552 . . . . 0.0 107.949 177.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -97.52 -24.66 15.47 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 120.965 1.711 . . . . 0.0 113.014 167.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 79.6 t -65.14 -41.65 92.3 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 O-C-N 117.936 -2.977 . . . . 0.0 110.252 169.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -65.95 -40.62 91.51 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 121.945 2.157 . . . . 0.0 115.351 171.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 16.3 tp -57.76 -43.84 85.74 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 120.095 -1.628 . . . . 0.0 111.274 174.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 23.8 tp -60.02 -45.75 91.76 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 ttpp -56.05 -45.0 79.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 126.564 3.078 . . . . 0.0 110.809 176.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -69.9 -15.67 63.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 112.139 -2.3 . . . . 0.0 114.574 174.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 29' ' ' ALA . . . . . 0.44 ' HB1' ' HA ' ' D' ' 35' ' ' HIS . . . -83.03 -34.87 26.17 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 127.911 2.484 . . . . 0.0 117.404 167.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -62.84 -33.45 75.28 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 121.049 -1.032 . . . . 0.0 111.416 170.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -73.8 -25.98 60.4 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 129.595 3.158 . . . . 0.0 115.489 -171.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.9 p30 -116.79 1.35 12.73 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.907 1.379 . . . . 0.0 112.788 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 70.01 29.01 4.0 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 129.825 3.25 . . . . 0.0 115.019 -178.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 61.3 mt -99.29 10.31 41.66 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 119.979 -1.701 . . . . 0.0 109.896 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 35' ' ' HIS . . . . . 0.44 ' HA ' ' HB1' ' D' ' 29' ' ' ALA . 0.0 OUTLIER -54.91 -57.95 9.55 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 3.1 mt -64.95 -36.93 17.93 Favored Pre-proline 0 N--CA 1.449 -0.509 0 O-C-N 121.221 -0.925 . . . . 0.0 110.786 -172.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.81 -40.25 65.18 Favored 'Trans proline' 0 N--CA 1.447 -1.221 0 N-CA-C 119.207 2.734 . . . . 0.0 119.207 162.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 16.5 tp -68.41 -43.07 78.02 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 117.073 -3.517 . . . . 0.0 112.096 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 77.1 mt -57.52 -48.38 79.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 126.515 2.384 . . . . 0.0 110.137 171.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -78.96 -29.24 43.8 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 117.439 -3.288 . . . . 0.0 108.734 -166.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.38 -54.8 41.24 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.181 0.992 . . . . 0.0 109.348 161.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 5.1 mmt -57.53 -49.16 77.24 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 114.424 -2.703 . . . . 0.0 114.624 -177.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 23.0 mt -111.09 133.03 53.78 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.464 1.906 . . . . 0.0 114.212 -164.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 76.5 p -68.1 151.0 97.53 Favored Pre-proline 0 N--CA 1.448 -0.543 0 O-C-N 126.061 2.101 . . . . 0.0 112.016 173.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -46.46 -43.82 21.64 Favored 'Trans proline' 0 N--CA 1.447 -1.215 1 C-N-CA 129.252 6.634 . . . . 0.0 114.904 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.89 -24.07 62.42 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 174.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -73.46 -25.3 60.43 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 114.187 -2.816 . . . . 0.0 112.986 166.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 26.0 mtm180 -89.31 -26.58 21.04 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 125.072 3.578 . . . . 0.0 111.743 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -51.78 -48.89 63.58 Favored 'General case' 0 N--CA 1.45 -0.455 1 C-N-CA 132.703 4.401 . . . . 0.0 111.761 159.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.3 -38.39 35.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 126.552 2.407 . . . . 0.0 115.272 -179.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.18 -34.74 78.29 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 118.214 2.672 . . . . 0.0 118.214 165.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.34 -41.62 99.74 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-O 117.665 -1.631 . . . . 0.0 115.86 166.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 52.1 m -59.58 -46.8 87.86 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 123.658 1.694 . . . . 0.0 110.016 168.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -59.16 -31.94 69.44 Favored 'General case' 0 N--CA 1.45 -0.453 2 O-C-N 114.297 -5.252 . . . . 0.0 111.011 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 99.0 t -57.37 -57.5 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 CA-C-N 122.116 2.234 . . . . 0.0 110.38 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -68.94 -27.24 65.56 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 115.63 -2.128 . . . . 0.0 114.451 176.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 79.6 mt -54.26 -66.14 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-N 121.27 1.85 . . . . 0.0 106.803 167.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 61.2 t -42.87 -51.01 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 O-C-N 120.818 -1.176 . . . . 0.0 113.765 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.36 -48.75 76.19 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 60' ' ' GLU . . . . . 0.43 ' HA ' ' HB3' ' D' ' 63' ' ' ARG . 29.3 mm-40 -68.35 -22.51 64.67 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 117.474 -1.251 . . . . 0.0 113.505 177.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 31.8 mt -77.33 -3.13 38.41 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 125.397 2.522 . . . . 0.0 116.96 174.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 77.6 mt -104.01 -28.63 11.42 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.573 1.949 . . . . 0.0 111.946 168.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 63' ' ' ARG . . . . . 0.43 ' HB3' ' HA ' ' D' ' 60' ' ' GLU . 39.4 ttm105 -77.49 -51.11 11.29 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.882 -3.011 . . . . 0.0 113.313 175.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.37 41.51 91.0 Favored Glycine 0 C--N 1.337 0.637 0 CA-C-O 116.173 -2.46 . . . . 0.0 111.362 163.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -115.95 -42.07 3.12 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 121.342 2.571 . . . . 0.0 108.212 -174.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 15.0 mmt -77.73 61.37 2.4 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 113.584 -1.644 . . . . 0.0 111.67 159.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 75.2 p -93.42 -176.49 4.13 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.192 1.397 . . . . 0.0 114.032 -173.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.371 2.8 tp-100 69.22 -109.0 0.08 Allowed 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 119.193 -2.192 . . . . 0.0 114.903 165.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -73.88 -37.29 64.78 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 116.545 -1.693 . . . . 0.0 110.477 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -69.84 -45.1 68.54 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 130.477 3.511 . . . . 0.0 113.631 -169.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.03 -18.03 59.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 113.824 -2.989 . . . . 0.0 111.377 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -106.25 -12.27 15.77 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 123.07 2.668 . . . . 0.0 116.318 174.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -119.76 -15.62 8.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 118.885 2.92 . . . . 0.0 118.885 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -124.59 -17.9 5.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 123.123 2.692 . . . . 0.0 112.204 172.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 75' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' D' ' 75' ' ' LEU . 4.4 mm? -84.99 -52.9 5.65 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.604 -1.665 . . . . 0.0 111.652 161.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 109.19 -167.14 12.81 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 119.257 -1.449 . . . . 0.0 112.206 146.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.09 -34.79 63.94 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -173.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -38.16 -24.14 0.02 OUTLIER Glycine 0 CA--C 1.523 0.548 0 CA-C-O 117.023 -1.987 . . . . 0.0 114.966 165.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 19.8 tt -60.64 -25.77 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 120.373 2.086 . . . . 0.0 112.847 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.85 -33.54 34.43 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 117.293 -1.337 . . . . 0.0 109.03 -176.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 33.9 m -70.57 -20.24 62.8 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 122.159 2.254 . . . . 0.0 109.929 170.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 25.1 mm -95.49 -30.64 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -173.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 7.1 p -105.19 -26.01 12.23 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 114.495 -2.669 . . . . 0.0 113.883 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.275 22.9 mtp85 -82.6 168.77 16.99 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 125.376 3.716 . . . . 0.0 112.493 167.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.92 154.24 29.37 Favored Glycine 0 C--N 1.337 0.618 0 CA-C-O 122.952 1.306 . . . . 0.0 114.617 177.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 92.5 p -74.17 -16.66 60.98 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.974 -1.113 . . . . 0.0 111.448 -147.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -135.3 64.48 1.58 Allowed 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 125.612 2.625 . . . . 0.0 107.735 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 24.8 p -97.62 -169.4 1.83 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 127.106 2.163 . . . . 0.0 112.389 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.21 -21.39 56.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 119.25 -2.156 . . . . 0.0 111.479 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 19.6 tttt -84.96 0.07 52.55 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.953 2.901 . . . . 0.0 109.748 174.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.45 -34.43 6.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 120.28 -1.513 . . . . 0.0 110.854 175.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 53.1 76.52 0.52 Allowed Pre-proline 0 N--CA 1.449 -0.519 0 CA-C-N 122.794 2.543 . . . . 0.0 111.389 164.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.283 98.5 Cg_exo 17.2 40.53 0.0 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.002 0 N-CA-C 116.941 1.862 . . . . 0.0 116.941 53.122 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 72.8 t -43.61 -26.33 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 128.564 2.746 . . . . 0.0 115.897 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.49 -30.29 8.01 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.695 1.998 . . . . 0.0 110.337 -160.165 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 24.2 tp -57.5 -46.4 83.81 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.744 -2.472 . . . . 0.0 111.223 147.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -60.38 -43.82 96.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 115.742 1.756 . . . . 0.0 115.742 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -62.62 -36.58 83.22 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.116 2.167 . . . . 0.0 113.616 166.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 80.6 t90 -65.45 -44.42 87.34 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 118.351 -2.718 . . . . 0.0 110.137 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 100' ' ' LEU . . . . . 0.4 ' HB3' HD12 ' D' ' 104' ' ' LEU . 47.2 mt -60.69 -36.3 78.45 Favored 'General case' 0 N--CA 1.446 -0.663 1 O-C-N 116.103 -4.123 . . . . 0.0 109.744 179.023 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -57.41 -29.26 63.97 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -101.74 -22.14 14.47 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 129.712 3.205 . . . . 0.0 110.79 -173.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 50.6 t -86.69 -38.53 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-O 123.78 1.752 . . . . 0.0 111.761 175.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 104' ' ' LEU . . . . . 0.4 HD12 ' HB3' ' D' ' 100' ' ' LEU 0.294 15.3 mt -96.58 -28.73 14.23 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 114.002 -2.904 . . . . 0.0 116.062 -175.479 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 12.3 mt -102.05 34.71 2.6 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.754 1.615 . . . . 0.0 107.883 172.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . 0.313 17.6 pttp -62.15 165.69 5.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.828 178.106 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.37 -42.48 15.05 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.668 3.587 . . . . 0.0 113.232 -177.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.249 1.032 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 176.756 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 17.0 ttp . . . . . 0 N--CA 1.451 -0.417 0 CA-C-O 122.74 1.257 . . . . 0.0 111.805 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.44 -31.62 68.87 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 114.121 -2.847 . . . . 0.0 110.499 -173.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.271 26.6 tp10 -58.97 -43.63 91.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 125.85 1.969 . . . . 0.0 114.334 168.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -59.8 -50.7 72.77 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 125.783 2.706 . . . . 0.0 114.554 174.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -62.78 -24.74 67.88 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 117.253 -3.404 . . . . 0.0 114.396 170.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . 0.271 1.8 t60 -66.99 -43.17 83.66 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.433 1.493 . . . . 0.0 113.38 171.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -76.38 -30.71 57.64 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 125.955 2.034 . . . . 0.0 107.749 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -65.86 -41.59 91.48 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 122.053 2.206 . . . . 0.0 111.448 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 12.8 t-105 -70.0 -52.96 19.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 127.651 2.38 . . . . 0.0 108.063 176.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 mt -62.17 -21.45 65.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 114.264 -2.779 . . . . 0.0 115.378 177.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -53.28 -43.04 67.15 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 118.439 2.755 . . . . 0.0 118.439 161.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -62.38 -39.31 92.77 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 129.17 2.988 . . . . 0.0 107.429 172.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.4 t -79.68 -24.11 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 120.465 1.484 . . . . 0.0 109.997 -176.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . 0.26 6.1 m-20 -59.92 -61.25 2.75 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 116.716 -3.74 . . . . 0.0 115.937 160.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 47.9 tp -44.73 -53.22 7.56 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 131.533 3.933 . . . . 0.0 114.154 173.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.6 tp -67.24 -36.29 81.32 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -64.73 -38.37 90.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.349 176.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -75.06 -32.8 61.6 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 114.956 -2.45 . . . . 0.0 111.516 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.96 -25.14 52.46 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 120.763 1.62 . . . . 0.0 114.863 172.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -59.8 -44.85 93.77 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 122.361 2.346 . . . . 0.0 112.042 162.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -78.31 16.68 0.74 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 113.978 -2.915 . . . . 0.0 113.348 176.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -131.76 7.39 4.42 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 121.461 1.937 . . . . 0.0 113.659 162.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.28 14.3 m-20 46.58 32.6 1.71 Allowed 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 128.138 2.575 . . . . 0.0 117.576 -165.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.1 mt -90.09 4.42 50.37 Favored 'General case' 0 N--CA 1.452 -0.368 1 O-C-N 115.877 -4.264 . . . . 0.0 113.235 166.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 p-80 -58.11 -43.73 87.31 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 116.968 -3.583 . . . . 0.0 115.164 -177.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 56.7 mt -64.06 -47.02 80.53 Favored Pre-proline 0 N--CA 1.452 -0.326 0 CA-C-O 117.087 -1.435 . . . . 0.0 111.676 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 15.0 Cg_exo -53.09 -40.2 77.54 Favored 'Trans proline' 0 N--CA 1.448 -1.187 1 C-N-CA 125.667 4.245 . . . . 0.0 114.471 174.512 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 24.7 tp -74.19 -39.4 63.19 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 117.196 -3.44 . . . . 0.0 110.277 -175.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.8 mt -83.44 3.06 33.63 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 126.334 2.271 . . . . 0.0 112.837 176.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -103.96 -9.04 19.17 Favored 'General case' 0 N--CA 1.446 -0.635 1 O-C-N 115.398 -4.564 . . . . 0.0 116.225 162.13 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 tt -97.0 -55.77 2.76 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.827 2.051 . . . . 0.0 108.385 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 57.8 mmm -72.69 -10.9 60.34 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 123.693 1.711 . . . . 0.0 115.41 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.5 mt -134.82 135.07 41.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 118.404 -2.685 . . . . 0.0 110.62 -176.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 74.2 p -87.27 162.18 43.9 Favored Pre-proline 0 N--CA 1.448 -0.536 0 O-C-N 116.744 -3.723 . . . . 0.0 111.64 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -56.7 -51.83 8.22 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 124.139 3.226 . . . . 0.0 112.593 -169.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -68.94 -16.76 63.83 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 127.454 2.302 . . . . 0.0 113.452 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -87.14 -39.41 15.56 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 118.237 -2.789 . . . . 0.0 112.344 170.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.266 78.5 mtm-85 -64.2 -40.5 96.2 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 117.386 -3.321 . . . . 0.0 114.205 167.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.44 ' HG3' ' HD2' ' B' ' 15' ' ' ARG . 23.2 tt0 -61.4 -45.65 93.44 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 116.054 -1.927 . . . . 0.0 111.946 176.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.28 -37.78 78.03 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 128.778 3.799 . . . . 0.0 112.247 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 70.6 mt -69.34 -26.08 64.52 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 121.236 1.834 . . . . 0.0 114.401 172.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.84 -45.49 57.58 Favored Glycine 0 C--N 1.336 0.537 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 173.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.1 m -64.15 -30.26 71.34 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 115.795 -2.05 . . . . 0.0 113.18 171.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.484 HH12 ' CD ' ' B' ' 47' ' ' GLU . 32.0 ttm180 -56.8 -34.78 68.02 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 120.438 1.472 . . . . 0.0 113.099 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 65.5 t -59.03 -37.41 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 116.411 -1.757 . . . . 0.0 113.019 172.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -67.63 -31.84 72.14 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 122.749 2.522 . . . . 0.0 114.236 171.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.276 64.4 mt -63.57 -39.42 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 O-C-N 120.019 -1.676 . . . . 0.0 107.846 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.6 t -79.13 -37.19 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 127.648 2.379 . . . . 0.0 113.369 -177.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -47.16 -60.9 2.16 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 125.711 1.882 . . . . 0.0 110.87 158.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -70.6 -14.05 62.33 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 126.685 3.136 . . . . 0.0 116.204 -175.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.406 HD21 HG22 ' A' ' 82' ' ' ILE . 93.9 mt -82.45 -39.35 22.68 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 116.739 -3.726 . . . . 0.0 111.673 167.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 tp -68.96 -47.48 65.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.354 1.433 . . . . 0.0 111.439 172.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.1 ttm105 -57.21 -62.19 1.94 Allowed 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.521 -3.237 . . . . 0.0 108.39 173.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.06 7.53 64.05 Favored Glycine 0 CA--C 1.522 0.506 0 O-C-N 119.756 -1.84 . . . . 0.0 117.404 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -97.11 -12.7 22.82 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 -165.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 22.1 ttm -138.41 134.68 34.42 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 127.394 2.933 . . . . 0.0 114.285 -167.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -97.56 157.9 15.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.099 -2.251 . . . . 0.0 115.845 -152.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -48.67 -37.19 17.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -174.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.3 tpt85 -75.83 -13.78 60.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 118.18 -2.825 . . . . 0.0 113.509 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -102.0 -36.56 8.55 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 117.159 -3.463 . . . . 0.0 105.778 -173.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 29.0 mt -67.78 -22.11 65.21 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 117.87 -3.019 . . . . 0.0 116.32 170.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.0 tptt -50.44 -29.98 11.53 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 115.502 1.668 . . . . 0.0 115.502 159.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -103.94 -50.74 3.31 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 174.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -66.46 -16.0 63.78 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 116.89 2.181 . . . . 0.0 116.89 -175.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 95.7 mt -129.63 -5.54 4.67 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 115.313 -2.279 . . . . 0.0 112.299 170.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 73.79 6.48 72.52 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-N 119.989 1.268 . . . . 0.0 115.839 -172.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.15 157.09 22.91 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 124.321 2.01 . . . . 0.0 113.404 -160.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.71 130.12 9.61 Favored Glycine 0 N--CA 1.446 -0.689 0 O-C-N 120.436 -1.415 . . . . 0.0 115.971 172.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 16.4 mt -61.32 -38.32 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 128.346 2.658 . . . . 0.0 114.12 -168.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.12 -13.15 62.27 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 117.686 2.476 . . . . 0.0 117.686 171.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.0 p -82.67 -48.3 11.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 120.83 -1.169 . . . . 0.0 111.992 169.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.406 HG22 HD21 ' A' ' 61' ' ' LEU . 6.5 mm -49.13 -39.42 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 123.147 1.451 . . . . 0.0 114.013 164.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.0 m -68.55 -49.2 61.31 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 120.74 -1.225 . . . . 0.0 108.496 -174.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.9 ttt180 -64.2 -37.32 87.04 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 125.411 1.695 . . . . 0.0 113.816 174.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.38 -47.48 62.3 Favored Glycine 0 C--N 1.338 0.64 0 C-N-CA 127.18 2.324 . . . . 0.0 109.791 172.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.6 m -58.99 -54.19 49.92 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 118.966 2.95 . . . . 0.0 118.966 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -59.13 -27.53 65.7 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 126.126 1.77 . . . . 0.0 113.49 168.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 56.1 m -67.0 -43.88 81.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 120.931 1.696 . . . . 0.0 112.011 168.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 89' ' ' LEU . 12.7 tp -62.33 -41.94 98.97 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.811 2.044 . . . . 0.0 109.2 176.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -60.37 -34.97 74.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 124.405 3.275 . . . . 0.0 110.29 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.33 -5.72 59.23 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.735 -1.853 . . . . 0.0 115.956 177.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.86 140.52 58.42 Favored Pre-proline 0 N--CA 1.449 -0.521 0 O-C-N 125.207 1.567 . . . . 0.0 110.605 -176.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -57.98 139.12 89.29 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 C-N-CA 125.218 3.946 . . . . 0.0 110.037 173.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.9 m -57.23 -29.52 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 119.705 -1.872 . . . . 0.0 111.738 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -70.16 -36.49 74.75 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 124.362 1.039 . . . . 0.0 113.145 -177.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 14.8 tp -60.18 -49.61 76.93 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 166.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -54.15 -42.52 69.66 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.61 1.564 . . . . 0.0 107.928 177.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -74.53 -31.1 62.03 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 123.571 1.653 . . . . 0.0 114.131 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . 0.296 65.4 t90 -70.73 -42.42 70.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 116.411 -3.93 . . . . 0.0 109.884 173.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.1 mt -60.83 -37.28 81.5 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 118.75 -2.469 . . . . 0.0 116.88 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . 0.274 44.2 mt-10 -60.65 -14.06 18.3 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 118.407 2.743 . . . . 0.0 118.407 -178.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -99.38 -12.81 19.94 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.433 2.293 . . . . 0.0 113.782 176.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.4 t -117.99 -31.98 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 O-C-N 118.106 -2.871 . . . . 0.0 116.807 -174.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.2 mt -84.08 -35.04 24.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 126.309 2.957 . . . . 0.0 118.808 174.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.283 21.3 mt -112.02 -18.83 12.53 Favored 'General case' 0 N--CA 1.448 -0.553 1 N-CA-C 122.516 4.265 . . . . 0.0 122.516 -160.289 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.6 tttt . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 117.843 2.535 . . . . 0.0 117.843 -176.943 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.275 . . . . . . . 0 N--CA 1.453 -0.308 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 90.4 mtp -74.67 -47.58 30.98 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 120.503 -1.373 . . . . 0.0 110.204 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.4 -37.73 70.53 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 170.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -73.88 -33.62 64.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.779 2.082 . . . . 0.0 116.133 172.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -55.58 -59.11 5.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 163.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.44 ' HD2' ' HG3' ' A' ' 49' ' ' GLU . 35.4 mmt180 -48.75 -33.19 9.82 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 120.462 3.504 . . . . 0.0 120.462 172.268 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -60.27 -40.27 89.78 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 121.269 1.85 . . . . 0.0 112.664 170.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -72.6 -38.61 67.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 118.06 2.615 . . . . 0.0 118.06 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -59.87 -23.49 63.47 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.263 -0.975 . . . . 0.0 113.532 169.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 6.4 t-105 -82.22 -46.74 13.33 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.72 2.408 . . . . 0.0 109.167 172.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 76.9 mt -57.82 -27.21 62.96 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 119.567 -1.958 . . . . 0.0 115.727 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -59.5 -45.32 92.04 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 119.154 -2.216 . . . . 0.0 111.963 174.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -59.31 -51.58 69.32 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 114.942 -2.456 . . . . 0.0 110.96 176.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 89.1 t -67.6 -27.54 38.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 O-C-N 127.957 3.286 . . . . 0.0 110.327 -173.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -77.21 -39.74 47.6 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 116.547 -3.846 . . . . 0.0 111.397 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 31.7 tp -70.07 -37.24 75.44 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 117.659 -3.151 . . . . 0.0 110.961 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.61 -47.57 85.05 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 118.793 2.886 . . . . 0.0 118.793 165.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -61.02 -29.66 69.85 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 128.338 3.524 . . . . 0.0 111.698 173.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -91.57 -24.69 19.52 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 117.073 2.249 . . . . 0.0 117.073 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.41 -26.34 63.15 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.253 1.946 . . . . 0.0 116.253 164.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -61.56 -32.09 72.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 126.205 1.802 . . . . 0.0 115.547 169.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -81.64 -2.16 49.29 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 123.744 1.735 . . . . 0.0 111.52 -170.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -128.71 7.96 5.75 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 119.039 -2.288 . . . . 0.0 109.893 -173.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.392 14.5 m-20 58.36 21.58 8.49 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 119.732 -1.855 . . . . 0.0 115.144 -167.185 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 mt -102.26 20.02 17.61 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 120.582 3.549 . . . . 0.0 120.582 178.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -76.52 -46.46 26.46 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 118.692 -2.505 . . . . 0.0 112.779 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 25.7 mt -63.57 -41.66 67.66 Favored Pre-proline 0 N--CA 1.448 -0.569 0 CA-C-N 121.737 2.062 . . . . 0.0 113.18 174.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.287 40.1 Cg_exo -49.08 -47.97 19.93 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 124.941 3.76 . . . . 0.0 115.887 162.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -65.78 -35.01 79.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.267 -2.771 . . . . 0.0 108.688 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 57.2 mt -70.04 -40.75 74.95 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 118.087 2.625 . . . . 0.0 118.087 177.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -52.03 -25.54 8.77 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.4 1.88 . . . . 0.0 113.129 162.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 19.0 tp -91.96 -35.31 14.07 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.587 1.555 . . . . 0.0 112.853 178.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 21.8 mmt -94.46 -8.88 37.22 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 118.507 2.78 . . . . 0.0 118.507 -176.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 53.4 mt -141.94 126.85 18.24 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.786 1.634 . . . . 0.0 113.501 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 44.7 p -61.08 154.93 58.37 Favored Pre-proline 0 N--CA 1.449 -0.501 1 O-C-N 113.841 -5.537 . . . . 0.0 110.541 169.196 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -50.28 -22.8 8.96 Favored 'Trans proline' 0 N--CA 1.447 -1.213 0 N-CA-C 120.498 3.23 . . . . 0.0 120.498 174.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -81.68 -36.77 28.36 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 117.483 -3.261 . . . . 0.0 114.554 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 47' ' ' GLU . . . . . 0.484 ' CD ' HH12 ' A' ' 54' ' ' ARG . 19.5 mt-10 -62.23 -43.63 98.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 114.469 -2.682 . . . . 0.0 111.366 162.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -65.81 -33.99 77.13 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 125.587 1.804 . . . . 0.0 112.045 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -60.48 -43.45 96.94 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.885 -1.052 . . . . 0.0 113.276 168.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . 0.347 . . -65.91 -56.56 11.15 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 115.72 -2.086 . . . . 0.0 109.677 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.302 10.6 mt -59.0 -30.95 68.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 121.196 1.816 . . . . 0.0 111.427 -178.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.03 -52.86 44.65 Favored Glycine 0 CA--C 1.523 0.582 0 CA-C-O 114.747 -3.252 . . . . 0.0 110.929 170.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 25.8 m -66.78 -28.63 68.54 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.189 2.195 . . . . 0.0 108.713 -174.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -63.08 -26.03 68.64 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.937 1.695 . . . . 0.0 111.809 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 79.6 t -64.89 -48.89 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 125.032 1.457 . . . . 0.0 111.225 169.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 24.7 mtp180 -66.33 -33.53 75.95 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 118.121 -2.862 . . . . 0.0 109.624 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 85.2 mt -64.07 -59.27 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 O-C-N 121.022 -1.049 . . . . 0.0 111.7 172.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 39.6 t -56.33 -40.01 63.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 O-C-N 121.399 -0.813 . . . . 0.0 111.449 178.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -67.01 -32.43 73.65 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.228 -0.92 . . . . 0.0 111.828 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -80.79 -18.78 46.45 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.828 1.299 . . . . 0.0 108.935 176.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . 0.334 76.1 mt -88.93 10.18 22.28 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 114.699 -2.572 . . . . 0.0 110.95 170.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 15.1 mt -112.8 -29.33 7.44 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 118.931 2.937 . . . . 0.0 118.931 150.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.37 21.5 ttm105 -58.83 -70.0 0.17 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 127.533 2.333 . . . . 0.0 111.639 176.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.67 27.89 9.35 Favored Glycine 0 C--N 1.336 0.538 1 CA-C-O 112.905 -4.275 . . . . 0.0 112.273 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -113.41 -22.19 10.5 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 119.496 3.147 . . . . 0.0 119.496 -176.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . 0.277 13.5 mtt -84.82 147.48 26.8 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 126.364 2.29 . . . . 0.0 111.313 -174.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 87.4 p -95.1 169.55 10.03 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 116.799 -1.961 . . . . 0.0 112.322 168.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -62.56 -31.85 72.73 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 116.883 -1.532 . . . . 0.0 112.51 -176.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 31.3 ttt180 -63.1 -50.88 68.77 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 126.345 2.278 . . . . 0.0 106.052 176.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -61.53 -44.39 97.14 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 127.672 2.389 . . . . 0.0 109.232 -174.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 31.1 mt -63.49 -46.42 86.2 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.82 -1.086 . . . . 0.0 113.48 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -63.93 -43.14 96.78 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.725 1.266 . . . . 0.0 110.954 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -68.58 -59.35 3.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.102 0.961 . . . . 0.0 110.421 -176.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -93.21 -61.11 1.64 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.42 -1.276 . . . . 0.0 111.444 -161.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 30.1 mt -74.23 -14.66 60.96 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 92.89 -1.29 70.76 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-O 124.188 1.993 . . . . 0.0 112.033 162.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.07 114.72 26.67 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -162.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.7 171.1 53.65 Favored Glycine 0 C--N 1.332 0.312 0 O-C-N 119.42 -2.05 . . . . 0.0 116.074 -176.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 11.4 mm -52.91 -43.62 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-O 115.319 -2.276 . . . . 0.0 111.368 -174.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.58 -27.52 62.24 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 123.366 2.803 . . . . 0.0 113.91 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 30.3 m -67.45 -49.62 62.88 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 121.252 1.842 . . . . 0.0 112.822 173.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 15.6 mm -64.5 -39.6 86.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 C-N-CA 125.827 1.651 . . . . 0.0 112.777 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 98.3 m -49.25 -52.63 25.98 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 162.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 42.5 ttt180 -63.22 -34.56 77.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 125.91 1.684 . . . . 0.0 114.498 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -60.49 -46.76 93.76 Favored Glycine 0 CA--C 1.521 0.438 0 O-C-N 126.125 2.141 . . . . 0.0 114.198 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 2.4 p -76.02 -27.36 57.32 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.614 1.166 . . . . 0.0 107.855 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -67.26 -43.09 82.74 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 119.71 1.141 . . . . 0.0 112.314 170.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . 0.26 51.5 m -79.66 -22.6 43.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.728 2.411 . . . . 0.0 109.886 -168.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 15.0 mt -78.13 -39.92 39.68 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 118.993 -2.317 . . . . 0.0 109.102 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 47.8 tttm -70.44 -24.32 62.88 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.873 1.269 . . . . 0.0 110.483 -172.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.9 -23.67 31.11 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 115.25 -2.309 . . . . 0.0 113.502 166.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.93 150.2 88.48 Favored Pre-proline 0 N--CA 1.45 -0.46 0 CA-C-N 121.391 1.905 . . . . 0.0 115.098 -164.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -46.52 132.56 16.17 Favored 'Trans proline' 0 N--CA 1.451 -1.024 0 O-C-N 122.944 0.971 . . . . 0.0 110.641 163.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.422 ' H ' HG13 ' B' ' 94' ' ' VAL . 1.1 m -61.93 -26.38 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 O-C-N 119.583 -1.948 . . . . 0.0 113.322 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pm0 -67.84 -25.04 65.35 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 124.372 2.034 . . . . 0.0 114.829 176.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 21.3 tp -73.33 -46.94 46.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 117.046 -3.534 . . . . 0.0 109.478 167.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 48.8 mtp85 -60.75 -38.63 85.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 126.743 2.527 . . . . 0.0 115.386 -175.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -60.45 -45.14 94.78 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.967 2.107 . . . . 0.0 112.182 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -77.28 -46.19 23.88 Favored 'General case' 0 N--CA 1.449 -0.525 1 C-N-CA 131.731 4.013 . . . . 0.0 108.264 -170.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 38.3 mt -54.77 -49.23 71.39 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 174.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -49.24 -55.35 12.87 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 126.099 2.125 . . . . 0.0 109.614 172.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -72.59 -18.03 61.64 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 121.037 3.717 . . . . 0.0 121.037 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 56.3 t -87.8 -42.28 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 115.639 -2.124 . . . . 0.0 111.281 171.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 52.7 mt -88.19 -65.57 1.0 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 120.405 1.457 . . . . 0.0 112.752 -167.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 83.9 mt -57.0 -30.52 64.24 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 120.054 -1.654 . . . . 0.0 114.022 -167.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -66.38 -10.26 41.65 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 117.78 2.511 . . . . 0.0 117.78 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 45.8 m -104.81 7.07 34.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 124.38 2.038 . . . . 0.0 114.651 -177.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 . . . . . 0 C--O 1.25 1.119 1 O-C-N 115.555 -4.466 . . . . 0.0 113.697 163.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ttt . . . . . 0 N--CA 1.469 0.51 0 N-CA-C 104.306 -2.479 . . . . 0.0 104.306 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.24 155.68 20.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.502 1.921 . . . . 0.0 112.77 176.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -122.6 161.88 22.9 Favored 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 125.825 1.953 . . . . 0.0 110.219 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -123.59 164.64 18.62 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.737 1.215 . . . . 0.0 110.157 165.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -151.83 154.25 32.66 Favored Pre-proline 0 N--CA 1.447 -0.592 0 O-C-N 127.25 2.843 . . . . 0.0 115.479 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.92 -14.24 13.83 Favored 'Trans proline' 0 N--CA 1.446 -1.307 1 C-N-CA 125.591 4.194 . . . . 0.0 113.321 174.087 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -147.48 135.31 21.15 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.766 -2.459 . . . . 0.0 106.33 172.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 15.4 t -138.19 134.47 34.53 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 123.15 1.452 . . . . 0.0 109.819 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.38 -34.54 78.19 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 116.39 -3.944 . . . . 0.0 115.198 177.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.96 -35.38 72.14 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.622 1.569 . . . . 0.0 113.018 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 59.2 mtt -64.0 -40.71 96.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 122.264 1.03 . . . . 0.0 109.374 171.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.29 -20.46 61.5 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 176.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -66.14 -50.86 62.52 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 120.456 -1.403 . . . . 0.0 107.86 162.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -60.96 -40.42 93.3 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -170.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -44.57 83.08 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 128.737 2.815 . . . . 0.0 113.906 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -62.65 -28.83 70.19 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 170.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -68.68 -24.81 64.55 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 119.01 2.967 . . . . 0.0 119.01 169.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -80.92 -42.05 21.99 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 125.729 1.893 . . . . 0.0 110.544 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 19' ' ' TRP . . . . . 0.661 ' CZ2' ' HD2' ' D' ' 48' ' ' ARG . 28.9 t-105 -62.96 -46.7 86.47 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 125.674 1.59 . . . . 0.0 112.997 169.384 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 5.7 mp -60.89 -36.8 80.17 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 116.358 -1.782 . . . . 0.0 109.551 175.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -70.24 -31.59 69.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 118.852 2.908 . . . . 0.0 118.852 171.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -53.34 -42.93 67.25 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.564 1.945 . . . . 0.0 111.175 161.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.312 42.6 t -65.63 -50.23 72.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 124.89 1.369 . . . . 0.0 112.287 174.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -70.44 -29.54 66.14 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 117.569 2.433 . . . . 0.0 117.569 -175.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 24.0 tp -70.19 -61.2 1.87 Allowed 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 126.453 3.025 . . . . 0.0 104.501 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 36.0 tp -52.12 -30.35 25.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 118.155 -2.84 . . . . 0.0 113.695 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -62.52 -39.5 93.75 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.804 1.241 . . . . 0.0 113.631 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -81.71 -20.52 39.24 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 125.868 1.667 . . . . 0.0 111.265 178.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.14 71.26 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.377 1.071 . . . . 0.0 112.102 -176.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -61.03 -35.68 77.54 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 120.059 1.3 . . . . 0.0 112.406 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -59.42 -29.22 67.6 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 126.922 2.639 . . . . 0.0 110.552 -157.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 34.7 p-10 -128.68 35.36 4.37 Favored 'General case' 0 N--CA 1.447 -0.587 1 C-N-CA 132.886 4.474 . . . . 0.0 115.339 172.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.415 79.3 m-20 61.98 18.3 9.76 Favored 'General case' 0 N--CA 1.45 -0.472 1 N-CA-C 122.293 4.183 . . . . 0.0 122.293 175.543 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.309 45.6 mt -78.71 -4.31 48.51 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 118.072 -2.893 . . . . 0.0 116.343 174.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -71.39 -41.98 68.97 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 117.081 -1.438 . . . . 0.0 111.892 -170.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 36' ' ' LEU . . . . . 0.449 ' HB2' ' HD3' ' C' ' 37' ' ' PRO . 12.9 mt -64.2 -51.23 63.5 Favored Pre-proline 0 N--CA 1.446 -0.669 0 CA-C-O 116.017 -1.944 . . . . 0.0 110.923 174.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 37' ' ' PRO . . . . . 0.449 ' HD3' ' HB2' ' C' ' 36' ' ' LEU . 7.7 Cg_exo -45.22 -36.5 12.4 Favored 'Trans proline' 0 N--CA 1.452 -0.963 1 C-N-CA 130.296 7.331 . . . . 0.0 116.495 167.069 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.79 -44.84 22.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 116.552 -1.689 . . . . 0.0 110.019 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 36.2 mt -69.63 -28.88 66.29 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 126.21 2.194 . . . . 0.0 110.67 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -79.29 -14.8 58.78 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.918 2.487 . . . . 0.0 110.493 -177.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 41' ' ' LEU . . . . . 0.53 HD13 ' HA ' ' D' ' 88' ' ' SER . 58.4 tp -101.71 -42.74 6.08 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.034 3.334 . . . . 0.0 111.808 172.115 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 12.0 mmt -62.99 -22.65 66.99 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 175.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mp -125.3 155.51 40.09 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.936 2.094 . . . . 0.0 115.092 -175.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -90.54 167.4 16.61 Favored Pre-proline 0 N--CA 1.45 -0.45 0 C-N-CA 129.136 2.975 . . . . 0.0 115.555 163.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -56.65 -38.36 95.75 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 N-CA-C 115.689 1.38 . . . . 0.0 115.689 177.088 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -68.76 -37.11 79.12 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 128.553 2.741 . . . . 0.0 108.442 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -71.66 -26.11 62.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 116.193 -1.86 . . . . 0.0 112.104 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . 0.256 34.0 mtm-85 -64.99 -47.48 77.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.688 2.395 . . . . 0.0 115.96 168.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.27 -49.3 77.62 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.587 1.955 . . . . 0.0 108.406 176.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -45.94 -52.91 10.82 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 126.225 2.203 . . . . 0.0 112.491 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 92.0 mt -66.89 -45.58 77.6 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 126.346 1.858 . . . . 0.0 113.03 -177.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.17 -29.03 67.62 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 121.433 1.924 . . . . 0.0 109.269 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 94.0 m -82.47 -41.42 19.81 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 121.175 -1.191 . . . . 0.0 110.249 -174.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.35 55.2 mtt180 -44.95 -38.27 4.58 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 116.045 1.869 . . . . 0.0 116.045 165.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 54.7 t -67.72 -38.3 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-O 114.093 -2.86 . . . . 0.0 109.547 174.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -70.79 -36.22 72.92 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 124.658 3.39 . . . . 0.0 113.799 170.415 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 70.5 mt -69.48 -27.7 35.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 122.336 2.335 . . . . 0.0 113.476 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 79.6 t -71.79 -29.49 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 117.056 2.243 . . . . 0.0 117.056 167.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -70.75 -43.36 68.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.766 2.826 . . . . 0.0 113.023 171.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -71.65 -42.42 67.57 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 119.548 1.067 . . . . 0.0 112.127 -176.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.8 -33.29 73.61 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 117.351 -1.309 . . . . 0.0 113.507 174.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . 0.392 72.0 mt -56.59 -51.7 67.64 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 121.775 2.08 . . . . 0.0 110.115 164.59 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -59.13 -45.2 91.56 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.36 56.65 10.41 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 106.75 -2.54 . . . . 0.0 106.75 174.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -125.45 57.96 1.31 Allowed 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 129.631 3.172 . . . . 0.0 103.719 168.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 34.0 mtt -136.69 142.61 43.15 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 127.618 2.367 . . . . 0.0 110.983 176.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 94.5 p -77.2 159.71 29.48 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 128.749 2.82 . . . . 0.0 115.711 163.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -58.73 -24.13 61.04 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.136 3.375 . . . . 0.0 111.325 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 31.3 ttp-105 -77.07 -35.0 56.96 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 167.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -75.23 -36.83 61.3 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 121.673 -0.642 . . . . 0.0 111.036 174.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.54 -14.46 42.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.081 -2.262 . . . . 0.0 113.947 171.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.7 tttt -94.4 -44.42 7.92 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 118.036 -2.915 . . . . 0.0 114.817 165.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -97.44 -23.28 16.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 126.893 2.077 . . . . 0.0 115.54 -163.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -94.35 -36.43 11.94 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 119.346 -2.096 . . . . 0.0 114.224 170.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 9.4 mp -88.25 -29.61 20.3 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.228 -1.844 . . . . 0.0 108.579 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 75.87 -154.25 44.85 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 122.038 2.199 . . . . 0.0 110.968 -176.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.71 -15.96 60.22 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 126.564 3.078 . . . . 0.0 111.959 174.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.79 -12.39 82.95 Favored Glycine 0 N--CA 1.446 -0.68 0 O-C-N 117.121 -3.487 . . . . 0.0 113.742 -166.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 13.9 tt -54.95 -40.07 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-O 115.471 -2.204 . . . . 0.0 110.989 170.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.24 -42.72 63.84 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 123.601 2.909 . . . . 0.0 112.652 174.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 3.4 m -50.47 -33.71 22.21 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 127.329 2.251 . . . . 0.0 115.726 176.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 32.1 mm -105.17 -10.68 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 126.539 1.936 . . . . 0.0 112.154 -171.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . 0.367 20.8 p -125.4 -15.97 6.01 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 119.344 3.091 . . . . 0.0 119.344 -167.335 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 38.9 mtp85 -110.83 164.94 12.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 O-C-N 119.799 -1.813 . . . . 0.0 112.468 162.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.88 160.48 17.85 Favored Glycine 0 C--N 1.339 0.72 0 C-N-CA 129.792 3.568 . . . . 0.0 111.44 -171.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 2.1 m -65.73 -7.31 14.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 116.858 2.17 . . . . 0.0 116.858 -173.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -105.47 7.24 32.99 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 -179.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 45.6 p -75.63 168.75 19.44 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 111.707 -3.996 . . . . 0.0 112.39 -170.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . 0.3 54.9 tp -65.93 -28.21 68.76 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 122.366 2.348 . . . . 0.0 113.454 -145.228 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 81.4 mttt -104.22 -14.54 15.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.998 1.272 . . . . 0.0 114.047 178.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.73 -38.12 88.29 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 117.21 -3.431 . . . . 0.0 115.066 155.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 92' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' C' ' 93' ' ' PRO . . . -47.33 153.46 0.95 Allowed Pre-proline 0 N--CA 1.449 -0.516 0 C-N-CA 128.868 2.867 . . . . 0.0 113.052 174.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 93' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' C' ' 92' ' ' ALA . 1.0 OUTLIER -65.7 149.98 86.63 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-O 124.838 1.933 . . . . 0.0 114.521 -172.547 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 94' ' ' VAL . . . . . 0.46 ' HA ' ' HB2' ' C' ' 97' ' ' ARG . 7.4 t -79.21 -24.07 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 114.559 -2.639 . . . . 0.0 106.913 -167.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 21.8 pm0 -75.24 -16.41 60.46 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 122.043 2.201 . . . . 0.0 113.488 171.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -86.41 -37.97 17.83 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 167.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 97' ' ' ARG . . . . . 0.46 ' HB2' ' HA ' ' C' ' 94' ' ' VAL . 66.6 mtp180 -68.12 -31.28 70.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 120.443 -1.411 . . . . 0.0 112.896 -170.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -84.72 -50.59 7.49 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.181 2.192 . . . . 0.0 110.118 -178.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 49.5 t90 -53.97 -40.4 66.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 172.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.42 -40.18 93.48 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 118.764 -2.46 . . . . 0.0 112.701 178.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -70.73 -33.85 71.27 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 120.519 1.509 . . . . 0.0 111.79 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -61.71 -27.25 68.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 116.516 2.043 . . . . 0.0 116.516 168.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 60.3 t -91.77 -53.28 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.756 -178.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 52.0 mt -91.99 -39.57 11.59 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 117.976 -1.489 . . . . 0.0 113.057 -166.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 11.0 mt -108.45 50.26 0.78 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 -173.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 21.1 pttp . . . . . 0 N--CA 1.446 -0.661 0 O-C-N 119.333 -2.104 . . . . 0.0 113.808 -173.018 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 96.2 p . . . . . 0 N--CA 1.449 -0.498 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -67.98 -32.86 27.56 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 N-CA-C 121.102 3.462 . . . . 0.0 121.102 -173.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -160.74 132.69 5.92 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 109.383 -3.553 . . . . 0.0 103.923 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.5 t -54.17 132.6 43.48 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 118.269 -2.769 . . . . 0.0 115.812 178.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.09 -34.62 73.73 Favored 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 117.58 -3.2 . . . . 0.0 114.737 176.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.98 -23.57 55.31 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 124.044 1.878 . . . . 0.0 111.173 -177.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -77.92 -35.7 50.25 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 117.128 -3.482 . . . . 0.0 111.095 173.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -41.6 98.29 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 121.986 0.898 . . . . 0.0 112.52 169.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -60.91 -52.18 66.14 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 113.71 -1.586 . . . . 0.0 108.644 169.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -55.1 -35.78 64.98 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 176.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.56 0.3 34.46 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 117.391 2.367 . . . . 0.0 117.391 172.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -101.69 -19.35 15.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 116.879 -1.928 . . . . 0.0 110.513 158.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 78.7 mm-40 -82.18 -31.4 30.43 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -66.55 -27.11 67.48 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 119.168 -2.208 . . . . 0.0 112.273 165.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -73.8 -44.5 55.67 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.045 0.841 . . . . 0.0 112.406 173.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 73.3 mt -59.85 -16.75 31.27 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 118.342 2.719 . . . . 0.0 118.342 165.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -75.17 -40.91 59.1 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 125.404 2.526 . . . . 0.0 109.17 169.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -65.51 -47.0 77.48 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.014 -3.554 . . . . 0.0 110.907 171.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 58.6 t -55.52 -53.36 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-O 116.479 -1.724 . . . . 0.0 110.236 178.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -55.43 -36.58 66.66 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 118.597 2.814 . . . . 0.0 118.597 175.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 31.3 tp -76.72 -44.78 31.93 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 113.594 -1.639 . . . . 0.0 114.132 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.01 -41.04 99.47 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 113.369 -3.205 . . . . 0.0 111.103 170.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 ttpp -53.83 -57.22 11.69 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.319 2.327 . . . . 0.0 113.42 165.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -42.81 -48.88 5.78 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 116.468 -1.729 . . . . 0.0 113.186 164.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.359 . . -58.26 -38.37 76.8 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 120.454 1.479 . . . . 0.0 114.74 175.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -59.54 -31.4 69.37 Favored 'General case' 0 N--CA 1.454 -0.268 1 O-C-N 115.045 -4.784 . . . . 0.0 111.439 174.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -86.53 -23.35 25.9 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.919 2.088 . . . . 0.0 111.672 -167.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 50.4 p30 -122.95 5.08 9.35 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.985 1.314 . . . . 0.0 108.991 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.385 11.9 m-20 74.88 25.74 1.4 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 114.529 -2.653 . . . . 0.0 117.593 176.122 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . 0.269 66.0 mt -96.78 5.74 50.03 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 126.456 2.348 . . . . 0.0 112.432 -172.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -80.49 -48.84 12.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.852 3.261 . . . . 0.0 111.72 -155.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 1.2 mt -50.77 -46.88 86.69 Favored Pre-proline 0 N--CA 1.451 -0.418 0 O-C-N 119.707 -1.87 . . . . 0.0 112.894 174.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.256 17.1 Cg_exo -70.23 -18.19 34.94 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 N-CA-C 117.731 2.166 . . . . 0.0 117.731 176.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 32.0 tp -77.32 -37.09 53.28 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.313 3.045 . . . . 0.0 108.886 167.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.13 -38.88 60.88 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 115.372 -2.252 . . . . 0.0 108.789 -179.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -75.43 -22.2 57.54 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 128.523 3.64 . . . . 0.0 112.312 174.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 18.6 tp -70.72 -42.98 69.87 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 115.898 -2.001 . . . . 0.0 111.338 171.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 19.8 mmt -84.74 -36.34 21.85 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 129.148 2.979 . . . . 0.0 114.846 -171.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mt -122.35 126.98 49.19 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 125.049 2.357 . . . . 0.0 109.208 -171.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 68.2 p -78.32 166.62 41.76 Favored Pre-proline 0 N--CA 1.448 -0.534 0 CA-C-N 111.2 -2.727 . . . . 0.0 113.352 -176.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_exo -59.07 -43.84 39.32 Favored 'Trans proline' 0 N--CA 1.447 -1.21 0 CA-C-N 121.575 1.598 . . . . 0.0 114.912 -162.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.274 48.7 m-20 -75.37 -17.28 60.26 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 117.558 -3.214 . . . . 0.0 109.238 -177.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -74.25 -37.52 63.74 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 124.912 2.292 . . . . 0.0 108.602 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 48' ' ' ARG . . . . . 0.661 ' HD2' ' CZ2' ' C' ' 19' ' ' TRP . 17.1 mtm180 -76.72 -31.07 56.91 Favored 'General case' 0 N--CA 1.45 -0.459 1 C-N-CA 132.386 4.275 . . . . 0.0 108.599 174.155 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -66.85 -38.34 86.18 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 122.566 2.439 . . . . 0.0 109.549 168.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.277 . . -79.71 -36.89 36.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 114.718 -2.563 . . . . 0.0 116.635 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 18.2 mt -61.16 -49.07 78.72 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 125.182 1.551 . . . . 0.0 114.418 164.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.37 -44.43 58.43 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 82.7 m -73.76 -23.33 59.72 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 127.212 2.205 . . . . 0.0 113.118 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -62.26 -20.69 64.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 117.428 -3.295 . . . . 0.0 115.288 166.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 43.7 t -66.59 -57.51 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 119.946 1.248 . . . . 0.0 108.216 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -69.31 -17.39 63.72 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.247 1.819 . . . . 0.0 112.837 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 31.8 mt -74.4 -44.2 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 O-C-N 118.055 -2.903 . . . . 0.0 110.803 173.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.45 -39.39 80.66 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 C-N-CA 128.274 2.63 . . . . 0.0 111.718 174.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -58.13 -49.44 76.97 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 117.931 -2.981 . . . . 0.0 109.731 176.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -70.42 -22.27 62.74 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 116.223 1.935 . . . . 0.0 116.223 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 46.1 mt -72.82 -28.51 62.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 121.44 1.927 . . . . 0.0 112.691 164.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 62' ' ' LEU . . . . . 0.415 HD22 ' HB2' ' D' ' 101' ' ' GLU . 78.9 mt -76.53 -36.89 57.43 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 120.835 1.652 . . . . 0.0 110.239 169.194 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -76.94 -33.88 57.67 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.437 0.695 . . . . 0.0 111.498 -173.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 45.31 52.46 8.58 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 121.909 3.523 . . . . 0.0 121.909 176.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -127.48 -12.69 5.55 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 119.232 -2.334 . . . . 0.0 109.701 173.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 16.4 mmt -87.85 59.36 5.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.093 1.357 . . . . 0.0 109.977 164.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 1.5 p -66.23 144.72 56.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 119.94 3.311 . . . . 0.0 119.94 -171.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 49.03 -101.41 0.08 Allowed 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 128.768 2.827 . . . . 0.0 109.355 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -58.42 -37.38 75.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 115.038 -2.411 . . . . 0.0 114.785 -174.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -70.79 -38.73 73.38 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.279 1.99 . . . . 0.0 111.708 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.75 -35.6 81.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 117.992 -2.943 . . . . 0.0 112.13 169.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -76.68 -25.13 53.34 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 121.119 1.781 . . . . 0.0 115.691 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -119.85 -30.78 4.66 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 113.103 -3.332 . . . . 0.0 111.95 -171.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . 0.258 17.5 tp10 -94.99 -45.54 7.21 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 123.453 2.842 . . . . 0.0 110.899 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 75' ' ' LEU . . . . . 0.462 HD13 ' HA ' ' D' ' 75' ' ' LEU . 4.3 mm? -73.87 -50.51 19.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 102.676 -3.083 . . . . 0.0 102.676 170.41 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 94.33 -141.28 15.47 Favored Glycine 0 N--CA 1.448 -0.506 1 CA-C-O 129.212 4.784 . . . . 0.0 118.298 153.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.61 -33.38 73.81 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.694 -2.651 . . . . 0.0 113.616 -167.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.18 -25.56 25.77 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 126.175 1.845 . . . . 0.0 116.166 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 5.2 tt -65.39 -15.29 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 119.732 1.766 . . . . 0.0 115.597 -173.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.23 -44.16 65.91 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.902 -1.047 . . . . 0.0 113.571 173.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 26.4 m -61.64 -39.63 91.99 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 170.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 45.6 mm -77.2 -34.98 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 O-C-N 120.864 -1.148 . . . . 0.0 111.131 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 70.0 p -104.01 -9.8 18.56 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 113.308 -3.234 . . . . 0.0 112.761 -174.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -96.16 -175.7 3.45 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 104.354 -2.461 . . . . 0.0 104.354 173.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 66.37 161.62 1.08 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 126.518 2.008 . . . . 0.0 112.445 -173.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 57.1 p -77.49 -22.5 51.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 116.142 1.905 . . . . 0.0 116.142 -148.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 72.0 m-80 -121.67 62.71 0.92 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 131.335 3.854 . . . . 0.0 111.093 175.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 88' ' ' SER . . . . . 0.53 ' HA ' HD13 ' C' ' 41' ' ' LEU . 84.0 p -85.41 175.92 8.58 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 125.821 2.724 . . . . 0.0 115.324 171.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.39 -11.56 60.28 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 118.933 -2.354 . . . . 0.0 110.977 161.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -71.22 -18.18 62.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 162.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -118.21 -23.38 7.34 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 116.947 2.202 . . . . 0.0 116.947 -165.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 42.62 85.85 0.15 Allowed Pre-proline 0 N--CA 1.449 -0.488 0 CA-C-O 124.298 1.999 . . . . 0.0 111.707 169.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 93' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo 20.11 45.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.123 0 O-C-N 116.84 -2.242 . . . . 0.0 114.45 51.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -58.95 -23.79 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 C-N-CA 127.363 2.265 . . . . 0.0 106.747 -175.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.53 -27.76 11.2 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 117.31 -1.329 . . . . 0.0 109.207 -160.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 34.5 tp -60.92 -54.24 47.51 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 128.486 2.715 . . . . 0.0 107.003 152.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 43.7 ttp180 -55.34 -52.81 62.29 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 124.739 3.427 . . . . 0.0 112.857 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -56.39 -24.78 46.84 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 124.2 3.182 . . . . 0.0 115.868 172.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 99' ' ' TRP . . . . . 0.429 ' CZ2' HG21 ' D' ' 103' ' ' VAL . 84.6 t90 -85.11 -40.93 16.2 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 123.238 1.494 . . . . 0.0 112.475 176.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.06 -35.25 79.61 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 118.331 -2.73 . . . . 0.0 108.967 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 101' ' ' GLU . . . . . 0.415 ' HB2' HD22 ' D' ' 62' ' ' LEU . 18.1 tt0 -68.08 -4.84 14.85 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 112.635 -2.075 . . . . 0.0 114.051 176.216 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -119.21 -33.63 4.08 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 119.331 -0.948 . . . . 0.0 108.599 177.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 103' ' ' VAL . . . . . 0.429 HG21 ' CZ2' ' D' ' 99' ' ' TRP . 25.4 t -77.34 -36.21 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 116.169 1.915 . . . . 0.0 116.169 171.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 24.6 mt -80.24 -39.38 29.13 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 127.923 2.489 . . . . 0.0 112.659 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 15.1 mt -110.84 37.41 2.8 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 126.62 3.105 . . . . 0.0 111.622 -174.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -58.08 165.71 1.81 Allowed 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.526 -2.609 . . . . 0.0 112.113 176.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 59.6 m -44.79 -36.48 3.25 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 129.258 3.023 . . . . 0.0 114.692 173.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 . . . . . 0 C--O 1.253 1.242 0 C-N-CA 129.175 2.99 . . . . 0.0 115.48 -178.612 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.39 -41.72 88.92 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 125.735 2.683 . . . . 0.0 114.014 171.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -71.5 -32.62 68.43 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 127.22 2.208 . . . . 0.0 112.105 171.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -60.33 -46.89 88.29 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.498 -2.001 . . . . 0.0 113.145 165.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.7 mmt-85 -70.32 -31.6 68.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 115.762 -2.066 . . . . 0.0 112.581 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.8 t60 -58.06 -50.88 71.91 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.038 -1.934 . . . . 0.0 111.796 165.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -53.53 -41.08 66.01 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.164 1.785 . . . . 0.0 113.421 174.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.254 34.7 tt0 -60.19 -49.86 75.95 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.187 1.795 . . . . 0.0 110.013 170.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -57.77 -61.07 2.78 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.394 -2.691 . . . . 0.0 117.014 172.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.8 mt -55.88 -29.17 59.56 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -175.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -47.89 -43.48 28.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 128.547 2.739 . . . . 0.0 111.023 168.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -67.15 -43.23 82.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 119.72 -1.862 . . . . 0.0 110.198 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.7 t -66.23 -36.81 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-O 113.722 -3.037 . . . . 0.0 111.171 175.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -61.99 -58.33 8.29 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.168 1.804 . . . . 0.0 109.67 168.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 36.8 tp -47.12 -54.62 10.08 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.171 -1.581 . . . . 0.0 113.17 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 36.3 tp -62.35 -39.95 94.8 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 124.137 3.153 . . . . 0.0 113.271 176.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -54.87 -35.77 64.4 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 127.003 3.287 . . . . 0.0 111.406 170.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -90.48 -6.28 55.01 Favored 'General case' 0 N--CA 1.452 -0.341 1 O-C-N 116.208 -4.057 . . . . 0.0 112.244 -177.518 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.0 -31.67 17.99 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 119.376 0.989 . . . . 0.0 111.961 163.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -50.95 -37.1 42.34 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.238 -2.163 . . . . 0.0 111.63 165.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -81.64 -10.46 59.41 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 121.91 2.141 . . . . 0.0 116.309 -174.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -109.76 -1.44 17.95 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.678 1.191 . . . . 0.0 113.771 172.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.442 12.4 m-20 63.94 34.52 11.51 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.822 2.049 . . . . 0.0 114.574 -175.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.6 mt -107.14 13.72 27.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.748 2.819 . . . . 0.0 113.978 174.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.3 p-80 -63.24 -60.04 3.93 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 116.091 1.886 . . . . 0.0 116.091 172.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.27 14.3 mt -59.92 -43.18 94.01 Favored Pre-proline 0 N--CA 1.449 -0.494 0 O-C-N 125.056 1.472 . . . . 0.0 112.734 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -45.46 -57.63 2.04 Favored 'Trans proline' 0 N--CA 1.448 -1.164 0 C-N-CA 123.216 2.611 . . . . 0.0 117.48 160.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.52 -40.38 92.9 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 117.605 -3.184 . . . . 0.0 117.375 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.3 mt -53.79 -35.18 61.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 115.793 -2.051 . . . . 0.0 110.434 169.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 -81.2 -10.45 59.62 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 120.789 1.631 . . . . 0.0 112.475 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.5 tt -92.68 -32.75 14.62 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 116.976 -3.578 . . . . 0.0 114.839 169.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 94.8 mmm -92.01 -17.59 24.86 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 120.065 3.358 . . . . 0.0 120.065 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.5 mt -120.6 129.83 53.92 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 169.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.9 p -70.34 154.11 94.71 Favored Pre-proline 0 N--CA 1.449 -0.481 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -49.01 -51.37 10.69 Favored 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 124.739 3.626 . . . . 0.0 119.089 -172.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.42 -9.59 58.74 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 116.863 -3.648 . . . . 0.0 115.269 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -81.92 -43.03 18.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 117.616 -3.177 . . . . 0.0 110.889 168.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 78.6 mtm-85 -54.28 -41.83 69.33 Favored 'General case' 0 N--CA 1.445 -0.693 1 O-C-N 114.666 -5.021 . . . . 0.0 112.226 171.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -65.83 -50.02 66.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 110.672 -2.967 . . . . 0.0 110.829 174.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.95 -33.6 62.49 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.953 2.101 . . . . 0.0 113.187 174.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.5 mt -88.75 -21.74 23.67 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 114.674 -2.584 . . . . 0.0 108.785 -175.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.93 -46.85 92.72 Favored Glycine 0 C--N 1.337 0.626 0 CA-C-N 121.391 1.905 . . . . 0.0 111.098 162.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.6 m -61.76 -28.67 69.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.132 -2.393 . . . . 0.0 110.462 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -60.68 -33.4 72.78 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 115.551 -2.166 . . . . 0.0 113.485 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.2 t -65.63 -40.33 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 121.592 1.996 . . . . 0.0 112.809 169.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -66.2 -23.17 66.39 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 122.641 2.473 . . . . 0.0 116.961 170.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.279 72.7 mt -64.67 -52.84 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 125.188 2.423 . . . . 0.0 109.101 168.306 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.4 t -68.55 -29.33 43.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-N 113.208 -1.815 . . . . 0.0 111.879 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -63.59 -44.98 92.45 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 118.604 -2.56 . . . . 0.0 112.816 174.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -83.9 -10.97 57.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -178.154 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 21.5 mt -78.74 -41.23 31.3 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 120.542 -1.349 . . . . 0.0 109.878 166.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.2 -43.44 17.66 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 115.475 -2.203 . . . . 0.0 107.476 -166.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -62.59 -36.97 84.41 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.317 2.261 . . . . 0.0 112.258 166.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.84 14.29 81.67 Favored Glycine 0 C--N 1.336 0.568 0 CA-C-N 122.392 2.36 . . . . 0.0 116.082 162.235 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -81.58 -28.58 33.75 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 129.255 3.022 . . . . 0.0 112.955 173.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.8 mtt -100.69 141.39 33.64 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 123.9 1.809 . . . . 0.0 108.399 -174.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 93.2 p -93.95 165.17 12.79 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.778 165.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -56.35 -35.48 67.71 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 125.72 2.676 . . . . 0.0 116.094 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.1 tpt85 -73.59 -21.23 60.39 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.808 -2.433 . . . . 0.0 110.532 -177.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -79.22 -42.53 25.79 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 113.911 -2.947 . . . . 0.0 110.55 166.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 57.4 mt -70.77 -18.36 62.76 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 115.612 -2.435 . . . . 0.0 114.752 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -57.25 -34.75 68.93 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.736 2.014 . . . . 0.0 111.804 169.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -90.83 -59.57 2.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.186 1.794 . . . . 0.0 107.914 167.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -62.32 -26.71 68.57 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 128.552 2.741 . . . . 0.0 117.829 -166.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.5 mt -122.82 11.35 9.68 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.393 1.877 . . . . 0.0 114.383 165.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 57.52 20.53 38.46 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 120.309 1.413 . . . . 0.0 114.26 -171.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -79.99 139.03 37.17 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.128 1.771 . . . . 0.0 114.051 -161.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.42 103.57 1.53 Allowed Glycine 0 CA--C 1.523 0.56 0 C-N-CA 127.908 2.671 . . . . 0.0 109.571 172.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 67.6 mt -37.61 -48.83 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 128.877 2.871 . . . . 0.0 112.347 -179.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.32 -34.45 74.66 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 129.731 3.212 . . . . 0.0 110.972 -172.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.3 p -65.31 -45.81 82.85 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 119.24 -2.162 . . . . 0.0 111.788 167.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.0 mm -63.64 -32.06 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 O-C-N 117.604 -3.185 . . . . 0.0 110.952 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -49.97 -52.52 33.03 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 118.645 -2.534 . . . . 0.0 115.137 165.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -59.55 -42.29 92.05 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 125.32 1.638 . . . . 0.0 110.729 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.86 -40.67 99.15 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 113.06 -1.882 . . . . 0.0 113.65 -177.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.9 m -61.74 -34.9 76.65 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 113.529 -3.129 . . . . 0.0 110.877 171.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -75.8 -30.17 58.97 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 120.771 1.623 . . . . 0.0 114.561 177.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 17.8 m -68.39 -34.97 76.99 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 115.902 -1.999 . . . . 0.0 109.967 171.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.9 tp -77.58 -45.61 24.72 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 117.255 -1.355 . . . . 0.0 111.41 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -53.76 -45.64 70.69 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 130.264 3.425 . . . . 0.0 108.262 169.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.25 -34.94 75.97 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.073 1.749 . . . . 0.0 115.302 176.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.05 171.87 4.19 Favored Pre-proline 0 N--CA 1.447 -0.614 0 O-C-N 119.496 -2.003 . . . . 0.0 113.321 -168.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . 0.317 28.5 Cg_exo -67.79 131.74 24.95 Favored 'Trans proline' 0 N--CA 1.447 -1.258 1 C-N-CA 126.847 5.032 . . . . 0.0 116.615 178.514 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 m -45.08 -39.93 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 N-CA-C 117.838 2.533 . . . . 0.0 117.838 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.1 pm0 -75.93 -31.84 59.31 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 118.26 -2.775 . . . . 0.0 110.796 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.495 HD12 HD13 ' B' ' 34' ' ' LEU . 15.7 tp -64.87 -41.95 95.24 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 112.696 -3.526 . . . . 0.0 111.394 164.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 89.1 mtm-85 -64.53 -43.47 93.91 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 126.167 2.167 . . . . 0.0 111.572 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -56.32 -20.86 20.87 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.376 2.27 . . . . 0.0 113.752 170.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -94.78 -46.26 6.98 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 127.562 3.553 . . . . 0.0 110.378 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 29.2 mt -56.32 -26.69 53.2 Favored 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 115.373 -4.579 . . . . 0.0 111.263 171.515 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -70.65 -24.85 62.78 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 118.11 -2.869 . . . . 0.0 117.433 170.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -101.41 -4.17 27.4 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.29 1.836 . . . . 0.0 111.968 176.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . 0.301 59.6 t -122.67 -36.66 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -170.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.2 mt -82.36 -54.83 4.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 117.866 -3.021 . . . . 0.0 115.135 165.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.7 mt -70.08 -3.89 18.63 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.747 2.019 . . . . 0.0 112.832 -167.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.264 28.9 tttt . . . . . 0 N--CA 1.448 -0.568 0 C-N-CA 129.597 3.159 . . . . 0.0 113.694 -166.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.496 0 CA-C-O 122.387 1.089 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 36.9 mtt -69.73 -34.77 74.31 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 114.152 -2.832 . . . . 0.0 110.402 176.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.68 -40.68 93.05 Favored 'General case' 0 N--CA 1.449 -0.509 1 O-C-N 130.196 4.685 . . . . 0.0 111.766 177.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 32.1 tp10 -65.46 -29.56 70.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 126.474 3.035 . . . . 0.0 116.86 171.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -68.36 -37.99 81.0 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 125.326 2.489 . . . . 0.0 116.761 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 51.9 mmt-85 -81.34 -20.0 41.61 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 115.036 -2.411 . . . . 0.0 111.078 176.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -61.53 -57.24 12.91 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 122.502 2.41 . . . . 0.0 108.064 162.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.35 -31.68 72.98 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 123.107 2.685 . . . . 0.0 116.767 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.69 -39.25 83.93 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 117.648 2.462 . . . . 0.0 117.648 165.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 11.8 t-105 -74.69 -46.91 34.64 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.708 2.003 . . . . 0.0 107.385 175.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 83.7 mt -58.93 -17.94 29.04 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 118.105 -2.872 . . . . 0.0 114.996 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . 0.381 49.4 ttt180 -67.55 -45.04 76.79 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.172 1.789 . . . . 0.0 113.527 168.014 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -60.03 -39.66 86.67 Favored 'General case' 0 N--CA 1.451 -0.4 1 O-C-N 115.997 -4.189 . . . . 0.0 119.492 165.026 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.01 -34.14 67.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-O 122.656 1.217 . . . . 0.0 110.738 176.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -61.88 -47.91 82.86 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 116.719 -3.738 . . . . 0.0 110.771 173.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 51.6 tp -62.79 -41.58 99.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.974 1.845 . . . . 0.0 109.061 -173.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.327 14.1 tp -76.46 -28.49 56.54 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 124.003 1.859 . . . . 0.0 115.917 -178.034 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -62.98 -37.52 87.46 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 119.04 -2.287 . . . . 0.0 111.987 164.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -79.41 -23.29 43.33 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 119.622 -1.924 . . . . 0.0 110.727 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.49 -32.34 32.5 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -69.61 -35.79 75.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 124.107 3.14 . . . . 0.0 113.921 167.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.33 -8.97 4.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 120.469 3.507 . . . . 0.0 120.469 159.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . 0.266 65.2 m-80 -128.74 9.79 5.95 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 116.389 -3.945 . . . . 0.0 110.002 -175.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.489 5.2 m-20 55.65 9.7 0.44 Allowed 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 121.137 3.754 . . . . 0.0 121.137 -168.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.495 HD13 HD12 ' A' ' 96' ' ' LEU . 25.3 mt -82.04 10.0 7.41 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 113.654 -1.612 . . . . 0.0 115.078 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . 0.266 18.5 p-80 -61.3 -49.92 75.07 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 119.801 -1.812 . . . . 0.0 112.783 -170.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.337 54.8 mt -63.07 -55.29 38.57 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-O 115.724 -2.084 . . . . 0.0 113.679 176.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -42.23 -36.24 4.01 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 N-CA-C 118.918 2.622 . . . . 0.0 118.918 168.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 58.6 tp -87.23 -28.35 22.42 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.141 0.428 . . . . 0.0 111.291 -176.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 19.8 mt -79.9 -34.07 39.37 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 120.833 -1.167 . . . . 0.0 113.362 172.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ASN . . . . . 0.44 ' HA ' ' NH1' ' B' ' 48' ' ' ARG . 86.8 m-20 -60.8 -42.97 98.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 113.309 -3.234 . . . . 0.0 108.032 167.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -61.89 -55.59 28.07 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 126.245 2.216 . . . . 0.0 112.14 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.0 mmt -82.85 -31.5 27.98 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 126.398 2.311 . . . . 0.0 114.759 -165.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 33.4 mt -108.3 127.13 53.59 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 104.715 -2.328 . . . . 0.0 104.715 -179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 24.3 p -69.59 157.4 89.64 Favored Pre-proline 0 N--CA 1.448 -0.538 0 C-N-CA 125.393 1.477 . . . . 0.0 113.741 172.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.67 -29.79 63.08 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 123.68 2.92 . . . . 0.0 115.721 -176.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.05 -21.04 43.91 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 125.244 1.59 . . . . 0.0 114.429 178.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -84.15 -28.11 27.65 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 169.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' ARG . . . . . 0.44 ' NH1' ' HA ' ' B' ' 40' ' ' ASN . 25.1 mtm180 -70.86 -46.77 62.09 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 117.703 -3.123 . . . . 0.0 107.076 171.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -58.72 -37.61 76.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.102 1.501 . . . . 0.0 114.007 170.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.88 -45.32 95.03 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 119.666 -1.896 . . . . 0.0 114.31 169.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 12.0 mt -68.51 -43.42 76.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 117.33 -1.748 . . . . 0.0 112.426 -174.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.11 -30.27 60.54 Favored Glycine 0 CA--C 1.525 0.715 0 O-C-N 125.427 1.704 . . . . 0.0 115.485 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.6 m -73.85 -44.41 55.66 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 174.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 38.2 mtt180 -60.56 -27.9 68.04 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.064 -3.523 . . . . 0.0 110.74 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 90.9 t -41.76 -62.75 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 123.245 2.748 . . . . 0.0 114.5 162.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 -71.13 -29.09 64.81 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -166.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 19.1 mt -71.45 -44.51 71.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 C-N-CA 126.795 2.038 . . . . 0.0 112.572 177.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 93.7 t -66.76 -41.8 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 124.332 2.015 . . . . 0.0 111.232 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -52.67 -49.19 65.75 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 115.343 1.608 . . . . 0.0 115.343 168.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . 0.254 22.8 tp10 -68.35 -30.45 69.42 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 113.169 -3.3 . . . . 0.0 109.798 174.605 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 8.5 mt -66.58 -25.11 66.47 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 123.353 2.797 . . . . 0.0 111.568 172.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 48.4 mt -86.61 -28.68 23.11 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 124.52 1.138 . . . . 0.0 109.614 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 28.5 ttm105 -83.02 -44.86 14.74 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 118.855 2.909 . . . . 0.0 118.855 -171.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.79 64.19 3.72 Favored Glycine 0 CA--C 1.522 0.47 0 O-C-N 119.256 -2.152 . . . . 0.0 114.638 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -128.39 -36.13 1.92 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 127.298 2.239 . . . . 0.0 109.077 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 60.0 mtp -81.16 134.31 35.61 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 118.526 -2.609 . . . . 0.0 116.117 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 88.5 p -84.29 174.41 10.17 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 125.322 1.639 . . . . 0.0 113.255 168.497 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -64.47 -36.47 84.3 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.293 -2.129 . . . . 0.0 113.657 -169.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -72.25 -35.88 68.91 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 120.029 -1.669 . . . . 0.0 112.923 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.72 -40.75 79.79 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 113.457 -1.701 . . . . 0.0 109.051 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 87.5 mt -58.93 -61.45 2.63 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.181 2.192 . . . . 0.0 112.21 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -53.58 -50.55 65.35 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 128.342 2.657 . . . . 0.0 112.974 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -104.14 -7.44 20.18 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 128.129 3.393 . . . . 0.0 109.764 -165.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -118.47 -7.04 10.7 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 125.201 3.637 . . . . 0.0 111.466 173.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 36.4 mt -122.09 -17.24 7.28 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 113.985 -2.912 . . . . 0.0 115.316 168.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.56 16.85 78.68 Favored Glycine 0 C--N 1.336 0.533 0 CA-C-N 125.08 3.582 . . . . 0.0 119.376 -168.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -105.23 71.03 0.92 Allowed 'General case' 0 N--CA 1.447 -0.58 1 C-N-CA 132.278 4.231 . . . . 0.0 106.571 -160.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.92 179.58 44.54 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 119.805 -1.188 . . . . 0.0 115.749 172.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 51.2 mm -44.85 -51.27 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-O 115.788 -2.054 . . . . 0.0 114.089 -171.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.8 -32.02 73.39 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.272 2.323 . . . . 0.0 117.272 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 2.9 m -66.59 -43.07 85.88 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 31.4 mm -70.08 -42.25 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 130.228 3.411 . . . . 0.0 113.432 168.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 26.3 m -59.17 -51.04 71.71 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 118.284 -2.76 . . . . 0.0 109.52 172.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -63.11 -42.58 99.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 114.916 -2.469 . . . . 0.0 113.077 175.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.84 -45.16 90.05 Favored Glycine 0 CA--C 1.522 0.499 0 O-C-N 125.703 1.877 . . . . 0.0 115.779 -176.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 88.2 p -62.88 -39.85 95.72 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 164.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -68.07 -37.46 81.28 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 117.074 -3.516 . . . . 0.0 112.469 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 48.1 m -74.41 -0.75 18.34 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 171.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mt -95.77 -43.52 7.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 128.271 2.628 . . . . 0.0 116.548 167.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 54.8 tttm -68.84 -31.76 70.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 123.003 0.521 . . . . 0.0 110.698 169.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.74 -14.72 60.33 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 129.554 3.141 . . . . 0.0 117.227 166.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.38 148.36 98.71 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-N 121.599 2.0 . . . . 0.0 108.9 165.395 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -72.71 151.53 52.04 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 122.598 2.198 . . . . 0.0 115.308 169.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.323 31.4 m -62.71 -34.84 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 O-C-N 118.892 -2.38 . . . . 0.0 117.362 -166.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -50.62 -34.51 26.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 128.204 2.602 . . . . 0.0 111.63 172.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 7.0 tp -97.23 -38.61 9.62 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 115.952 -1.975 . . . . 0.0 108.333 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 26.0 mtp85 -47.87 -51.91 21.25 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 121.748 2.067 . . . . 0.0 111.552 171.011 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -62.86 -28.64 70.17 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 117.365 2.357 . . . . 0.0 117.365 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -71.26 -60.4 2.25 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.35 1.86 . . . . 0.0 110.702 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 96.4 mt -54.49 -43.79 72.09 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -66.48 -13.94 61.55 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -104.19 -8.51 19.34 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 126.478 1.911 . . . . 0.0 114.134 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 39.4 t -111.55 -43.55 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 123.38 1.562 . . . . 0.0 107.875 -177.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.96 -47.17 39.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 116.948 -3.595 . . . . 0.0 109.567 -178.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 84.0 mt -72.25 -24.25 61.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 117.75 -1.58 . . . . 0.0 112.701 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -90.25 -8.97 49.66 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 119.373 -2.08 . . . . 0.0 111.329 -178.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.3 m -71.89 -22.77 61.46 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 165.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.394 61.9 m-20 . . . . . 0 C--O 1.249 1.036 0 N-CA-C 117.117 2.266 . . . . 0.0 117.117 161.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ttt . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.61 170.36 15.93 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.454 -1.299 . . . . 0.0 113.832 172.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -130.81 149.72 52.32 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 113.485 -1.689 . . . . 0.0 108.542 177.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -121.48 153.49 37.86 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 124.155 3.161 . . . . 0.0 109.492 177.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 94.9 p -143.85 169.7 9.84 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 172.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -89.8 -27.24 0.34 Allowed 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 116.873 -1.618 . . . . 0.0 114.333 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -140.88 144.29 35.17 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 117.167 -1.397 . . . . 0.0 114.16 176.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.7 t -148.06 118.53 7.42 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 125.335 1.647 . . . . 0.0 113.243 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.71 -12.31 2.85 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 157.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.87 -40.76 95.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 123.485 2.857 . . . . 0.0 115.399 163.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 39.2 mtt -79.38 -36.98 38.4 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 124.067 1.889 . . . . 0.0 110.513 -172.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.06 -36.04 60.18 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 128.549 2.74 . . . . 0.0 112.158 175.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -79.58 -37.69 35.74 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 119.4 -2.063 . . . . 0.0 109.724 175.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -70.56 -43.79 68.77 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 120.36 1.437 . . . . 0.0 112.334 -178.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -30.69 71.59 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 119.269 -2.144 . . . . 0.0 114.09 174.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -72.78 -48.38 38.73 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 126.6 2.437 . . . . 0.0 110.964 171.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -61.47 -24.01 66.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 112.748 -3.501 . . . . 0.0 113.871 171.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -59.65 -39.01 82.98 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 123.794 2.997 . . . . 0.0 115.999 164.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -78.22 -41.3 34.8 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.067 -1.424 . . . . 0.0 110.58 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 4.8 mp -67.12 -17.69 64.98 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 119.927 -1.733 . . . . 0.0 110.715 174.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -82.98 -38.56 22.52 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 118.159 -2.838 . . . . 0.0 116.668 175.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 22' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' D' ' 51' ' ' LEU . 73.8 t80 -55.46 -38.79 69.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 113.383 -1.735 . . . . 0.0 110.405 165.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 5.6 t -70.6 -41.94 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 O-C-N 118.91 -2.369 . . . . 0.0 108.466 -177.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -72.71 -25.62 61.3 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 119.077 2.991 . . . . 0.0 119.077 176.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 49.1 tp -71.63 -40.49 69.71 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 52.7 tp -69.35 -40.28 77.61 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -44.0 -51.5 7.71 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 123.342 1.544 . . . . 0.0 114.187 178.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -79.67 -13.4 59.51 Favored 'General case' 0 N--CA 1.45 -0.425 0 O-C-N 119.311 -2.118 . . . . 0.0 113.269 -175.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.31 -28.49 61.19 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 120.977 1.717 . . . . 0.0 114.968 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -65.19 -22.97 66.97 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 117.867 -3.021 . . . . 0.0 109.598 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.79 -20.74 61.1 Favored 'General case' 0 N--CA 1.448 -0.564 1 O-C-N 113.869 -5.519 . . . . 0.0 110.947 -166.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -126.66 30.4 5.53 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 118.545 -2.597 . . . . 0.0 113.677 168.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 42.16 44.84 3.33 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 129.151 2.98 . . . . 0.0 115.262 -173.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.264 95.9 mt -93.55 -10.0 36.3 Favored 'General case' 0 N--CA 1.448 -0.549 1 C-N-CA 132.125 4.17 . . . . 0.0 109.71 172.801 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 29.4 p-80 -47.9 -41.81 25.39 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 130.947 3.699 . . . . 0.0 109.653 168.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mt -76.34 -52.35 2.37 Favored Pre-proline 0 N--CA 1.45 -0.452 1 O-C-N 115.612 -4.43 . . . . 0.0 117.074 174.181 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -49.43 -33.58 30.2 Favored 'Trans proline' 0 N--CA 1.448 -1.174 0 C-N-CA 123.751 2.967 . . . . 0.0 118.54 164.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 18.8 tp -65.74 -39.18 90.85 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.005 -2.309 . . . . 0.0 115.337 168.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 66.9 mt -84.8 -16.22 42.2 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.986 2.175 . . . . 0.0 115.422 172.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -85.38 -5.12 59.33 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 129.336 3.054 . . . . 0.0 113.816 163.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 54.7 tp -91.77 -64.59 1.1 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 116.025 -1.941 . . . . 0.0 110.971 156.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -83.46 -5.83 59.28 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 119.642 3.201 . . . . 0.0 119.642 -162.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mp -114.85 155.06 27.49 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 112.731 -2.032 . . . . 0.0 111.915 162.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 44' ' ' THR . . . . . 0.427 ' HB ' ' CD ' ' C' ' 45' ' ' PRO . 58.6 p -94.23 173.56 4.51 Favored Pre-proline 0 N--CA 1.449 -0.495 0 C-N-CA 129.965 3.306 . . . . 0.0 110.624 166.055 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 45' ' ' PRO . . . . . 0.427 ' CD ' ' HB ' ' C' ' 44' ' ' THR . 16.8 Cg_exo -70.91 -30.91 16.23 Favored 'Trans proline' 0 N--CA 1.451 -0.989 1 C-N-CA 125.815 4.344 . . . . 0.0 111.385 -168.109 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -43.59 97.01 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.073 2.149 . . . . 0.0 108.44 178.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -71.53 -24.12 61.89 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.132 1.373 . . . . 0.0 114.465 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 82.8 mtm-85 -80.28 -33.02 38.04 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 117.156 -3.465 . . . . 0.0 108.968 170.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -64.76 -42.77 94.89 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 123.226 1.488 . . . . 0.0 113.827 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.79 -56.58 18.79 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 128.705 2.802 . . . . 0.0 109.671 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 79.9 mt -56.6 -39.81 74.23 Favored 'General case' 0 N--CA 1.446 -0.641 1 O-C-N 116.146 -4.096 . . . . 0.0 116.823 170.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.63 -18.89 46.74 Favored Glycine 0 N--CA 1.448 -0.506 0 O-C-N 119.643 -1.91 . . . . 0.0 114.598 170.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 19.7 m -92.5 -43.54 9.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 112.945 -1.628 . . . . 0.0 110.714 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -63.68 -37.65 88.15 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.61 -2.138 . . . . 0.0 107.747 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 6.8 t -52.9 -47.49 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-N 124.332 3.242 . . . . 0.0 114.346 170.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -65.36 -38.39 89.92 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 115.68 -2.105 . . . . 0.0 114.254 173.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 20.8 mt -65.14 -45.43 94.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 123.294 2.77 . . . . 0.0 107.316 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 24.3 t -57.95 -37.87 63.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 115.503 -2.189 . . . . 0.0 112.171 167.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -70.92 -41.27 71.43 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 124.159 3.163 . . . . 0.0 113.324 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -66.48 -36.33 82.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 114.402 -2.713 . . . . 0.0 111.427 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 63.7 mt -70.94 -37.62 72.85 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 122.688 2.495 . . . . 0.0 114.276 172.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 35.8 mt -77.53 -22.23 51.44 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 114.645 -2.822 . . . . 0.0 109.9 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -67.34 -51.64 49.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.069 -2.269 . . . . 0.0 112.502 165.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.27 21.02 74.19 Favored Glycine 0 CA--C 1.521 0.429 0 O-C-N 117.824 -3.048 . . . . 0.0 118.483 177.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . 0.501 30.6 tt0 -83.48 40.35 0.72 Allowed 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 128.425 2.69 . . . . 0.0 113.995 171.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 23.2 mmt -110.42 119.19 38.39 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -173.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 85.1 p -80.75 160.06 25.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.291 -3.381 . . . . 0.0 113.46 161.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.98 -30.2 61.41 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 119.275 -2.141 . . . . 0.0 112.718 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . 0.253 35.9 ttp-105 -58.7 -45.21 90.03 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 119.966 3.321 . . . . 0.0 119.966 161.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -76.16 -29.58 57.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 126.569 2.418 . . . . 0.0 112.03 -177.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.92 -16.66 52.6 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 117.326 -3.359 . . . . 0.0 115.799 171.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -98.74 -69.58 0.76 Allowed 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 172.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -74.87 -10.92 59.96 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.618 -3.176 . . . . 0.0 113.679 -164.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -106.32 -35.57 7.11 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 120.301 1.41 . . . . 0.0 110.896 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.5 mp -88.81 -28.23 20.57 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 116.776 -1.583 . . . . 0.0 113.165 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 76' ' ' GLY . . . . . 0.436 ' O ' HG22 ' C' ' 79' ' ' ILE . . . 54.66 -122.85 26.56 Favored Glycine 0 C--N 1.336 0.577 1 C-N-CA 130.95 4.119 . . . . 0.0 114.79 -173.574 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.2 -23.99 37.76 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 126.121 1.768 . . . . 0.0 113.301 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.68 -14.7 77.86 Favored Glycine 0 CA--C 1.526 0.74 0 O-C-N 128.617 3.698 . . . . 0.0 117.198 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 79' ' ' ILE . . . . . 0.436 HG22 ' O ' ' C' ' 76' ' ' GLY . 17.4 tt -51.4 -55.94 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 155.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 80' ' ' ALA . . . . . 0.425 ' HB1' ' HD3' ' C' ' 84' ' ' ARG . . . -69.31 -25.85 64.43 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 119.327 -2.108 . . . . 0.0 111.724 -177.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 1.4 m -68.92 -27.91 66.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.916 1.686 . . . . 0.0 113.171 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 19.5 mm -98.33 -36.55 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 O-C-N 125.538 1.774 . . . . 0.0 114.075 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 78.1 p -91.95 -24.33 19.3 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -170.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 84' ' ' ARG . . . . . 0.425 ' HD3' ' HB1' ' C' ' 80' ' ' ALA . 71.9 mtp85 -93.6 161.09 14.49 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 130.654 3.582 . . . . 0.0 112.053 177.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.06 169.28 41.38 Favored Glycine 0 CA--C 1.524 0.642 0 O-C-N 118.706 -2.496 . . . . 0.0 116.879 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 25.5 m -64.26 -33.93 76.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 119.048 2.981 . . . . 0.0 119.048 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -93.78 28.66 2.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 126.649 2.468 . . . . 0.0 113.749 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 8.0 p -75.15 159.17 31.95 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.766 -2.459 . . . . 0.0 108.27 -172.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 30.3 tp -44.13 -54.7 5.35 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.833 2.453 . . . . 0.0 113.1 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -82.73 2.45 33.72 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 120.893 1.679 . . . . 0.0 112.663 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -124.03 -16.4 6.55 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.376 1.87 . . . . 0.0 113.054 -172.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.53 152.9 88.36 Favored Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 130.536 3.534 . . . . 0.0 114.822 163.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -66.01 158.98 51.44 Favored 'Trans proline' 0 N--CA 1.446 -1.295 0 O-C-N 115.515 -2.939 . . . . 0.0 117.926 -167.129 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 89.3 t -65.9 -43.63 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 117.948 -1.025 . . . . 0.0 108.648 -170.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.3 pm0 -60.88 -23.05 64.89 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 116.194 -1.86 . . . . 0.0 112.229 -178.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 18.3 tp -76.86 -49.71 15.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.254 1.822 . . . . 0.0 108.745 169.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 67.6 mtp180 -71.84 -42.44 66.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 118.695 -2.503 . . . . 0.0 111.208 -167.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -50.05 -50.0 49.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 128.794 2.838 . . . . 0.0 108.783 167.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 90.6 t90 -63.31 -41.25 98.91 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 127.998 3.311 . . . . 0.0 117.467 -178.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 81.3 mt -51.79 -36.67 48.54 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 117.077 -1.44 . . . . 0.0 114.349 168.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -80.94 -24.57 38.03 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.774 1.296 . . . . 0.0 113.708 172.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -71.12 -14.23 62.22 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 119.944 1.247 . . . . 0.0 111.162 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 72.9 t -112.03 -61.3 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-O 115.221 -2.324 . . . . 0.0 112.454 176.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 31.6 mt -66.05 -32.43 73.9 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 121.58 1.991 . . . . 0.0 115.398 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 84.9 mt -136.83 62.82 1.59 Allowed 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.662 1.585 . . . . 0.0 111.185 -168.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.281 15.2 pttp . . . . . 0 N--CA 1.452 -0.329 0 CA-C-N 112.262 -2.244 . . . . 0.0 112.595 -174.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 78.2 p . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -50.18 -38.71 51.47 Favored 'Trans proline' 0 N--CA 1.446 -1.322 1 C-N-CA 125.585 4.19 . . . . 0.0 109.728 170.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -153.24 147.22 25.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 128.325 2.65 . . . . 0.0 108.889 178.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 12.7 t -92.66 140.37 29.6 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 120.382 1.446 . . . . 0.0 113.935 -175.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.6 -17.47 64.13 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 120.558 -1.339 . . . . 0.0 112.939 173.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.28 -35.74 66.21 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 120.653 -1.28 . . . . 0.0 111.194 167.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 14.8 mmm -72.01 -47.86 48.85 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 127.311 2.244 . . . . 0.0 114.193 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.97 -59.97 2.05 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.279 2.632 . . . . 0.0 112.263 169.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -67.43 -37.56 83.19 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 116.648 -1.644 . . . . 0.0 113.909 173.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -57.69 -22.54 46.68 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 121.705 2.048 . . . . 0.0 114.286 164.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER -93.88 -4.67 49.56 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 125.13 3.605 . . . . 0.0 106.74 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -90.19 -21.13 22.33 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 122.683 2.492 . . . . 0.0 114.81 153.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . 0.305 75.3 mm-40 -92.41 -36.14 13.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 123.876 1.798 . . . . 0.0 110.13 -166.151 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -46.6 -36.27 6.75 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 127.201 2.201 . . . . 0.0 111.807 161.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 19' ' ' TRP . . . . . 0.456 ' CZ3' ' CD1' ' D' ' 22' ' ' PHE 0.254 4.7 t-105 -85.14 -36.32 21.16 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 118.778 -2.451 . . . . 0.0 114.658 -177.564 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 50.7 mt -70.95 -22.75 62.17 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 120.037 -1.664 . . . . 0.0 113.05 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -66.51 -32.19 73.38 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 164.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 22' ' ' PHE . . . . . 0.456 ' CD1' ' CZ3' ' D' ' 19' ' ' TRP 0.297 13.8 t80 -66.76 -55.26 15.79 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 121.049 1.75 . . . . 0.0 107.728 173.86 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 61.1 t -57.83 -36.33 55.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 117.057 -1.449 . . . . 0.0 110.123 -172.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . 0.281 22.1 t70 -84.92 -28.38 25.96 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 125.745 1.618 . . . . 0.0 112.637 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 23.8 tp -66.27 -53.59 35.0 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 170.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 26' ' ' LEU . . . . . 0.558 ' O ' ' HB3' ' D' ' 29' ' ' ALA . 57.7 tp -55.33 -38.55 68.87 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 114.386 -2.721 . . . . 0.0 112.123 -178.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp -66.96 -37.35 84.12 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 127.124 2.765 . . . . 0.0 112.895 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -72.17 -29.98 64.54 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 113.535 -1.666 . . . . 0.0 113.143 171.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 29' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' D' ' 26' ' ' LEU . . . -60.3 -35.91 76.66 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 126.217 1.807 . . . . 0.0 115.591 164.219 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -73.39 -11.03 60.34 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 123.553 1.645 . . . . 0.0 113.734 172.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -102.36 -2.47 28.85 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 112.308 -3.71 . . . . 0.0 116.266 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 52.1 p30 -137.4 10.63 2.97 Favored 'General case' 0 N--CA 1.448 -0.55 1 O-C-N 129.228 4.08 . . . . 0.0 117.857 169.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 66.28 33.93 6.84 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 117.627 2.455 . . . . 0.0 117.627 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 20.2 mt -103.24 7.69 38.45 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.553 1.541 . . . . 0.0 111.485 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.42 -49.18 77.07 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 130.762 3.625 . . . . 0.0 112.541 174.196 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 18.0 mt -71.37 -45.68 13.59 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-N 122.729 2.513 . . . . 0.0 110.486 -178.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.259 82.4 Cg_exo -61.26 -32.47 90.3 Favored 'Trans proline' 0 N--CA 1.45 -1.085 1 C-N-CA 125.465 4.11 . . . . 0.0 115.982 173.745 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 34.6 tp -72.46 -45.59 58.84 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 118.836 -2.415 . . . . 0.0 110.726 174.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 11.3 mt -70.02 -27.85 65.01 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 117.575 -3.203 . . . . 0.0 112.53 176.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -76.85 -30.39 56.29 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 118.046 -2.909 . . . . 0.0 115.195 172.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 56.9 tp -57.97 -46.43 85.15 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 157.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.0 mmt -82.59 -37.7 24.68 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.064 -1.023 . . . . 0.0 112.695 -165.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 64.0 mt -114.63 137.42 51.91 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 114.691 -2.576 . . . . 0.0 111.957 -165.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 42.7 p -78.27 168.16 29.72 Favored Pre-proline 0 N--CA 1.449 -0.493 0 O-C-N 125.421 1.701 . . . . 0.0 112.342 -176.003 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -52.34 -32.9 53.57 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-N 123.164 2.166 . . . . 0.0 117.631 -174.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -91.49 -32.12 15.7 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 127.028 2.131 . . . . 0.0 112.805 -172.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -58.36 -39.75 80.38 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.05 1.34 . . . . 0.0 113.318 168.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 31.2 mtm-85 -64.26 -52.6 57.89 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.589 2.356 . . . . 0.0 108.491 169.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -54.28 -35.99 63.18 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 127.535 3.022 . . . . 0.0 114.082 174.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.22 -36.91 66.55 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 119.615 -1.928 . . . . 0.0 114.374 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 51' ' ' LEU . . . . . 0.444 ' HB3' ' CE2' ' C' ' 22' ' ' PHE . 43.5 mt -72.15 -45.73 59.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 119.211 -2.181 . . . . 0.0 113.412 -179.082 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.3 -42.41 99.77 Favored Glycine 0 C--N 1.338 0.676 0 C-N-CA 125.16 1.362 . . . . 0.0 110.572 166.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 36.2 m -60.67 -33.86 73.47 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 124.175 3.988 . . . . 0.0 114.504 169.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.4 61.2 mtt180 -52.99 -27.12 17.67 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 118.038 -2.914 . . . . 0.0 116.993 166.328 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 76.4 t -69.2 -50.5 52.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-O 114.75 -2.548 . . . . 0.0 107.377 175.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 56' ' ' ARG . . . . . 0.4 ' HG2' ' H ' ' D' ' 56' ' ' ARG . 3.2 ptm180 -68.02 -35.9 79.05 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 125.601 3.819 . . . . 0.0 110.67 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 57' ' ' ILE . . . . . 0.41 HD13 HG21 ' D' ' 57' ' ' ILE . 59.4 mt -52.48 -53.8 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 120.56 1.527 . . . . 0.0 109.877 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 69.6 t -67.66 -44.96 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 O-C-N 117.136 -3.478 . . . . 0.0 106.234 -175.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -49.67 -41.72 43.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.043 -2.286 . . . . 0.0 116.427 168.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . 0.254 45.1 mm-40 -76.28 -24.3 54.44 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 125.802 1.939 . . . . 0.0 110.73 178.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 48.0 mt -76.74 -44.78 31.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 119.29 -2.131 . . . . 0.0 110.447 176.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . 0.261 30.6 mt -62.11 -25.79 67.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.957 1.703 . . . . 0.0 114.213 168.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 37.4 ttm180 -84.99 -41.41 15.86 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 119.924 -1.735 . . . . 0.0 111.547 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 41.03 64.71 1.21 Allowed Glycine 0 CA--C 1.522 0.478 0 C-N-CA 126.524 2.011 . . . . 0.0 116.797 -174.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -130.95 -36.81 1.33 Allowed 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 131.121 3.768 . . . . 0.0 112.457 177.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 13.4 mmt -85.37 49.08 1.68 Allowed 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 130.04 3.336 . . . . 0.0 108.322 166.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 53.3 p -69.64 165.3 21.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 124.549 2.119 . . . . 0.0 115.583 -168.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 56.62 -103.42 0.18 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 117.594 2.442 . . . . 0.0 117.594 158.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -53.44 -45.06 69.33 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 114.306 -2.759 . . . . 0.0 114.48 168.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -82.03 -40.1 22.55 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 123.682 2.946 . . . . 0.0 110.314 -166.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.63 -30.74 14.16 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 118.146 2.647 . . . . 0.0 118.146 165.35 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -86.2 -46.85 9.99 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 116.792 2.145 . . . . 0.0 116.792 169.129 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -74.74 -45.81 41.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 115.278 -2.296 . . . . 0.0 110.9 -175.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -119.0 -32.55 4.43 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 120.085 1.311 . . . . 0.0 112.788 -160.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.258 1.3 mm? -72.73 -28.85 62.89 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 116.131 -1.89 . . . . 0.0 109.24 157.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 105.68 -174.35 20.88 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-O 125.63 2.795 . . . . 0.0 106.959 151.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.254 . . -58.72 -9.2 1.61 Allowed 'General case' 0 N--CA 1.45 -0.47 1 C-N-CA 133.719 4.808 . . . . 0.0 119.596 171.2 . . . . . . . . 3 2 . 1 . 010 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.87 -21.79 65.81 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 115.243 0.857 . . . . 0.0 115.243 164.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 3.7 tt -38.06 -31.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 127.031 2.132 . . . . 0.0 115.672 172.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.54 -7.25 13.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 118.283 -2.761 . . . . 0.0 114.924 -171.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 47.3 m -66.89 -44.02 81.94 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.536 150.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 15.7 mm -68.09 -35.85 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 129.164 2.986 . . . . 0.0 114.328 168.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 68.4 p -119.75 8.1 11.12 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 123.868 3.031 . . . . 0.0 116.692 -175.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.2 mtp85 -115.76 170.54 8.38 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 121.744 2.066 . . . . 0.0 113.848 149.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.11 156.12 32.38 Favored Glycine 0 C--N 1.334 0.464 0 CA-C-O 123.794 1.775 . . . . 0.0 111.659 -166.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 53.1 p -78.16 -5.91 53.17 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 -156.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -138.89 41.24 2.14 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 128.839 2.856 . . . . 0.0 109.944 169.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 12.7 p -56.67 174.51 0.15 Allowed 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 129.271 3.028 . . . . 0.0 107.586 164.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp -66.38 -24.76 66.54 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 118.021 -2.925 . . . . 0.0 111.145 174.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 36.8 tttt -76.65 0.75 19.13 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 167.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -130.86 5.32 4.58 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 115.069 -2.396 . . . . 0.0 115.09 -176.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 92' ' ' ALA . . . . . 0.57 ' HA ' ' C ' ' D' ' 93' ' ' PRO 0.376 . . 48.33 76.5 0.54 Allowed Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 119.252 3.056 . . . . 0.0 119.252 140.939 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 93' ' ' PRO . . . . . 0.57 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 76.8 Cg_exo 33.01 28.4 0.0 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.985 0 CA-C-N 123.543 2.301 . . . . 0.0 113.665 36.617 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 94' ' ' VAL . . . . . 0.42 ' H ' ' C ' ' D' ' 92' ' ' ALA . 3.6 t -50.76 -21.93 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 C-N-CA 125.784 1.634 . . . . 0.0 108.781 166.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 95' ' ' GLU . . . . . 0.46 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.333 0.0 OUTLIER -103.47 -35.92 8.17 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.948 1.699 . . . . 0.0 111.919 -169.082 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 27.4 tp -50.86 -54.24 25.6 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 117.445 -1.702 . . . . 0.0 110.031 151.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 -60.48 -46.02 91.62 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 128.582 2.753 . . . . 0.0 113.816 -169.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -75.1 -12.99 60.43 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 116.957 -3.589 . . . . 0.0 116.927 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 64.5 t90 -77.47 -48.41 17.19 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 117.144 -1.408 . . . . 0.0 110.81 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 38.9 mt -58.24 -34.68 70.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 126.742 2.526 . . . . 0.0 108.33 169.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -60.97 -31.74 71.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.298 2.239 . . . . 0.0 114.018 175.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -97.97 -23.12 15.94 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 119.681 -1.887 . . . . 0.0 112.884 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.254 49.0 t -78.19 -23.57 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 CA-C-N 121.702 2.047 . . . . 0.0 111.488 167.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 78.7 mt -120.75 -20.1 7.13 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 -163.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 67.7 mt -115.44 29.72 7.82 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.252 2.221 . . . . 0.0 107.188 166.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -52.6 167.32 0.15 Allowed 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.713 2.805 . . . . 0.0 115.704 173.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 53.8 m -40.35 -50.26 2.81 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 119.524 3.157 . . . . 0.0 119.524 -175.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 . . . . . 0 C--O 1.245 0.832 0 C-N-CA 126.055 1.742 . . . . 0.0 113.944 177.54 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.2 ttt . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 121.038 0.447 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -37.62 74.78 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.215 -0.902 . . . . 0.0 112.915 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -64.97 -37.19 86.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 120.027 -1.671 . . . . 0.0 110.915 166.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -55.33 -49.34 72.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 117.231 -3.418 . . . . 0.0 111.141 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -74.53 -17.84 60.69 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.769 -177.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -65.84 -49.74 67.1 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 118.914 -1.115 . . . . 0.0 110.85 168.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -70.12 -24.78 63.24 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.332 2.345 . . . . 0.0 117.332 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -67.31 -41.93 84.54 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.756 2.423 . . . . 0.0 109.808 170.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . 0.261 3.0 t-105 -74.51 -44.1 52.86 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.977 -2.327 . . . . 0.0 113.456 174.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 15.4 mt -67.07 -29.27 68.99 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 117.527 -1.669 . . . . 0.0 112.061 -176.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 25.8 ttt180 -30.14 -63.05 0.14 Allowed 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 116.437 2.014 . . . . 0.0 116.437 153.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -53.95 -37.07 63.51 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 116.326 1.972 . . . . 0.0 116.326 173.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.279 2.7 t -69.51 -40.62 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 125.406 1.482 . . . . 0.0 112.282 -176.056 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -68.54 -50.68 50.13 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 116.203 -1.856 . . . . 0.0 109.329 167.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.429 ' CD1' HG11 ' B' ' 103' ' ' VAL . 22.0 tp -53.26 -40.15 64.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 123.536 2.88 . . . . 0.0 111.506 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.47 HD11 ' CE2' ' A' ' 30' ' ' TYR . 14.3 tp -76.74 -30.16 56.47 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 120.103 1.319 . . . . 0.0 111.526 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -62.74 -47.67 82.56 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 166.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -53.97 -38.81 65.39 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.38 -2.724 . . . . 0.0 111.028 165.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.94 -38.81 57.21 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 122.834 2.561 . . . . 0.0 110.964 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.47 ' CE2' HD11 ' A' ' 26' ' ' LEU . 28.2 m-85 -67.49 -35.42 79.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 118.732 -2.48 . . . . 0.0 109.02 176.056 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -66.59 -10.78 49.03 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 173.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -115.8 7.22 14.52 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.384 1.073 . . . . 0.0 112.242 177.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.28 24.7 m-20 60.88 14.91 5.56 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 121.474 3.879 . . . . 0.0 121.474 -171.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.1 mt -101.03 13.49 35.03 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 119.624 -1.922 . . . . 0.0 113.648 -175.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.434 ' CG ' ' CD1' ' A' ' 30' ' ' TYR . 19.8 p-80 -55.2 -53.38 56.8 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.822 -2.423 . . . . 0.0 113.381 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.9 mt -70.09 -47.33 21.74 Favored Pre-proline 0 N--CA 1.445 -0.716 0 CA-C-N 123.547 2.885 . . . . 0.0 111.039 -178.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -41.87 -47.81 6.28 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.299 2.666 . . . . 0.0 114.524 168.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 27.4 tp -66.56 -55.47 15.28 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 112.887 -1.96 . . . . 0.0 113.419 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 29.0 mt -61.71 -21.92 64.9 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 119.702 1.137 . . . . 0.0 112.37 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -73.63 -31.95 63.79 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.084 1.754 . . . . 0.0 109.549 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.87 -39.48 43.19 Favored 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 133.915 4.886 . . . . 0.0 115.993 169.229 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.3 mmm -73.58 -32.13 63.97 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 129.066 2.946 . . . . 0.0 113.241 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.4 mt -127.59 120.6 28.54 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.132 1.373 . . . . 0.0 108.724 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.4 p -53.79 163.01 1.19 Allowed Pre-proline 0 N--CA 1.45 -0.465 0 CA-C-N 114.836 -1.074 . . . . 0.0 113.418 172.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -64.86 -28.11 58.92 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 CA-C-N 121.965 1.737 . . . . 0.0 115.93 -172.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -77.23 -27.2 53.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.73 2.122 . . . . 0.0 116.73 177.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -72.17 -39.56 68.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.625 1.97 . . . . 0.0 114.07 172.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.6 mtm-85 -55.96 -46.58 78.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 168.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -49.26 -54.05 18.72 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 119.568 -1.958 . . . . 0.0 113.173 169.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.31 -50.08 55.98 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 114.934 -2.46 . . . . 0.0 107.464 -172.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.9 mt -54.4 -33.42 59.28 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 124.443 3.292 . . . . 0.0 115.707 171.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.24 -47.06 92.35 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 127.928 2.68 . . . . 0.0 114.566 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.0 m -60.11 -27.3 66.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 114.857 -2.497 . . . . 0.0 112.331 163.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -81.61 -23.49 37.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 125.429 1.706 . . . . 0.0 110.795 -173.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 51.6 t -57.36 -45.22 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-O 115.795 -2.05 . . . . 0.0 107.992 167.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.29 11.6 ttt180 -63.26 -37.75 88.45 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 126.779 2.032 . . . . 0.0 110.707 173.809 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 28.6 mt -57.79 -42.82 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 O-C-N 117.422 -3.299 . . . . 0.0 112.358 174.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.5 t -65.19 -48.25 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 O-C-N 119.178 -2.201 . . . . 0.0 112.458 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -57.27 -47.99 80.03 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.904 1.282 . . . . 0.0 110.526 178.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -69.0 -44.15 73.37 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 115.202 -2.333 . . . . 0.0 114.623 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.1 mt -67.63 -27.13 66.63 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 120.61 1.55 . . . . 0.0 113.997 177.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 tp -77.59 -47.66 18.84 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.359 1.464 . . . . 0.0 108.915 177.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.3 ttm105 -53.96 -35.42 61.75 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 169.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.33 -9.24 14.42 Favored Glycine 0 C--N 1.334 0.45 0 C-N-CA 129.25 3.309 . . . . 0.0 117.259 169.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -60.25 -22.51 63.15 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 127.458 2.303 . . . . 0.0 116.084 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 41.4 mtt -95.4 140.83 29.72 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 126.176 1.79 . . . . 0.0 114.915 175.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.8 p -93.44 176.87 6.22 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 127.628 2.371 . . . . 0.0 109.906 174.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -69.16 -31.88 70.83 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 119.368 -2.082 . . . . 0.0 111.482 169.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.5 tpt85 -62.27 -27.52 69.07 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 167.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -90.67 -40.04 12.11 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 117.265 -1.35 . . . . 0.0 111.763 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.4 mt -63.56 -30.21 71.36 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 120.153 1.342 . . . . 0.0 109.997 176.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -56.86 -25.48 56.63 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -95.79 -54.32 3.38 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 126.2 1.8 . . . . 0.0 111.861 172.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -65.73 -47.81 74.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 118.219 -2.801 . . . . 0.0 114.439 -170.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.3 mt -108.73 -0.34 20.07 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.535 -171.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.86 21.36 73.2 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 119.841 1.2 . . . . 0.0 114.106 -171.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.08 133.1 33.64 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 116.434 2.013 . . . . 0.0 116.434 -165.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.57 129.46 9.13 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-O 114.562 -3.354 . . . . 0.0 111.601 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 83.8 mt -61.48 -17.77 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 1 O-C-N 131.356 4.798 . . . . 0.0 111.477 -164.038 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -77.19 -28.38 53.93 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.852 2.569 . . . . 0.0 113.361 169.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 26.4 p -84.69 -25.38 28.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 118.067 -1.453 . . . . 0.0 109.855 -173.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 51.1 mm -69.92 -43.29 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-O 113.886 -2.959 . . . . 0.0 109.619 166.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.6 m -49.75 -52.05 34.5 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 122.981 2.628 . . . . 0.0 113.347 168.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.277 42.7 ttt180 -62.45 -29.62 70.65 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 113.779 -3.01 . . . . 0.0 115.396 175.063 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.64 -36.86 41.84 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 122.216 2.28 . . . . 0.0 117.696 166.028 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 16.3 m -61.35 -44.35 97.33 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 114.988 -2.434 . . . . 0.0 114.223 173.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -58.27 -37.85 75.8 Favored 'General case' 0 N--CA 1.448 -0.527 1 O-C-N 129.186 4.054 . . . . 0.0 112.02 165.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 64.5 m -70.55 -35.32 73.04 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 124.083 3.129 . . . . 0.0 117.709 172.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.4 tp -69.35 -40.12 77.7 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 128.176 3.422 . . . . 0.0 113.499 170.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 18.7 tttp -59.99 -36.99 78.38 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 120.575 -1.328 . . . . 0.0 113.252 176.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.13 -13.13 58.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 172.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.55 126.36 91.42 Favored Pre-proline 0 N--CA 1.449 -0.504 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -67.63 155.73 68.91 Favored 'Trans proline' 0 N--CA 1.446 -1.281 1 C-N-CA 126.786 4.991 . . . . 0.0 108.759 -172.089 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . 0.396 3.1 m -68.06 -34.03 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 113.288 -1.778 . . . . 0.0 113.906 -165.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.28 13.0 pm0 -61.29 -35.46 77.38 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 170.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 43.0 tp -70.34 -44.7 67.64 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 124.525 2.107 . . . . 0.0 108.618 173.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.5 mtm180 -70.09 -29.41 66.38 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 116.733 -3.729 . . . . 0.0 114.661 -168.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -80.1 -30.45 39.16 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 117.028 2.232 . . . . 0.0 117.028 168.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 85.7 t90 -73.12 -37.16 66.77 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 169.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.99 -24.31 67.67 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.489 1.516 . . . . 0.0 114.078 174.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -80.33 -8.61 59.56 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.922 2.489 . . . . 0.0 114.883 165.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -99.34 -38.61 8.78 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 112.019 -3.848 . . . . 0.0 105.904 173.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.8 t -83.88 -57.72 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 O-C-N 127.992 3.308 . . . . 0.0 106.879 -165.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.4 mt -85.25 -30.33 23.9 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 120.413 1.46 . . . . 0.0 114.04 -158.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mt -105.86 -27.64 11.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 124.686 2.184 . . . . 0.0 108.276 -148.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.8 tttt . . . . . 0 N--CA 1.452 -0.372 0 C-N-CA 128.568 2.747 . . . . 0.0 115.994 -159.943 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.657 0 CA-C-O 124.564 2.126 . . . . 0.0 108.332 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 21.7 mmt -74.32 -24.81 59.26 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 117.674 -3.141 . . . . 0.0 108.936 -178.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.94 -42.86 56.85 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 120.305 -1.497 . . . . 0.0 109.837 171.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -62.02 -40.56 96.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.075 1.75 . . . . 0.0 111.022 177.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -65.8 -39.25 90.75 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.577 2.351 . . . . 0.0 108.79 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -86.38 -14.54 43.15 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 118.027 -2.921 . . . . 0.0 112.824 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -51.7 -47.7 63.83 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 121.025 1.739 . . . . 0.0 114.757 149.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -64.68 -44.83 89.07 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 118.354 -2.716 . . . . 0.0 110.605 -177.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -53.94 -45.88 71.4 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.702 1.601 . . . . 0.0 112.425 174.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 28.0 t-105 -64.26 -58.91 5.19 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 170.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 73.8 mt -51.78 -25.84 8.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 116.721 -1.609 . . . . 0.0 110.651 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -65.08 -31.93 73.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 174.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -67.43 -53.84 25.56 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 121.048 1.749 . . . . 0.0 109.941 165.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.443 HG23 ' H ' ' B' ' 23' ' ' VAL . 29.7 t -46.11 -38.57 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 117.495 2.405 . . . . 0.0 117.495 171.089 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -75.07 -52.49 10.91 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.106 2.162 . . . . 0.0 106.61 171.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 46.2 tp -59.27 -34.08 71.83 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 124.891 3.496 . . . . 0.0 112.083 -175.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 27.8 tp -72.76 -37.58 67.62 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 114.503 -2.665 . . . . 0.0 115.39 173.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -65.14 -39.03 92.47 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 121.098 1.772 . . . . 0.0 113.363 176.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -71.59 -34.7 70.11 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 127.011 2.125 . . . . 0.0 108.484 173.23 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.51 -26.22 65.34 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 121.938 2.154 . . . . 0.0 113.098 175.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -70.77 -28.08 64.41 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.138 -2.226 . . . . 0.0 110.267 173.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -71.59 -13.08 61.66 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -123.55 -1.22 8.56 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 118.214 -2.804 . . . . 0.0 112.194 -172.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.332 0.3 OUTLIER 70.66 8.69 6.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.063 2.545 . . . . 0.0 116.556 -172.522 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.44 3.89 26.36 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 119.566 -1.959 . . . . 0.0 111.905 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -54.49 -47.86 72.53 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 177.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 27.8 tp -65.16 -61.9 5.47 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-O 116.167 -1.873 . . . . 0.0 111.23 -178.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -55.95 -31.47 81.96 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 CA-C-N 124.338 2.585 . . . . 0.0 118.687 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 46.5 tp -70.39 -42.11 72.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 113.623 -3.084 . . . . 0.0 114.22 170.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 21.8 mt -69.47 -33.59 73.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 123.403 2.819 . . . . 0.0 111.576 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -70.56 -26.88 63.75 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 125.144 1.528 . . . . 0.0 112.332 171.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . 0.282 11.7 tp -75.38 -33.48 61.03 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 116.543 -3.848 . . . . 0.0 115.277 164.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 24.4 mmt -84.2 -26.76 28.51 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -170.106 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 38.7 mt -122.82 136.92 55.03 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 124.242 0.964 . . . . 0.0 109.452 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 59.7 p -68.03 155.78 91.16 Favored Pre-proline 0 N--CA 1.447 -0.601 0 O-C-N 120.05 -1.656 . . . . 0.0 108.926 174.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -47.11 -38.84 25.43 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 122.886 2.391 . . . . 0.0 113.894 174.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -66.91 -45.41 78.05 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 115.592 -2.147 . . . . 0.0 114.902 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -64.1 -38.73 92.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 125.91 2.006 . . . . 0.0 115.118 171.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 42.2 mtm-85 -64.96 -37.95 89.35 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.052 -2.28 . . . . 0.0 111.595 170.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -69.46 -31.26 69.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 173.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.04 -62.42 1.71 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 114.622 -2.608 . . . . 0.0 109.218 170.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 7.2 mt -53.5 -35.7 60.9 Favored 'General case' 0 N--CA 1.447 -0.59 0 O-C-N 127.965 3.291 . . . . 0.0 117.548 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.17 -28.87 70.95 Favored Glycine 0 CA--C 1.522 0.494 0 O-C-N 125.446 1.716 . . . . 0.0 113.485 168.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.7 m -72.87 -34.72 66.91 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.716 -2.638 . . . . 0.0 110.099 166.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.471 ' HA ' ' HB ' ' B' ' 57' ' ' ILE . 95.4 mtt180 -69.79 -18.67 63.49 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 112.634 -3.555 . . . . 0.0 114.804 174.655 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.38 -59.15 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 122.145 2.248 . . . . 0.0 109.882 157.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -55.42 -34.71 64.67 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 122.437 2.381 . . . . 0.0 116.81 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.471 ' HB ' ' HA ' ' B' ' 54' ' ' ARG 0.347 45.1 mt -57.11 -70.09 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 124.763 2.22 . . . . 0.0 108.678 173.556 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 57.6 t -54.52 -38.15 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 125.382 1.473 . . . . 0.0 112.29 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -65.46 -39.48 92.03 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 119.32 3.082 . . . . 0.0 119.32 169.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -74.38 -31.55 62.41 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 119.533 -1.979 . . . . 0.0 111.096 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 3.6 mt -55.47 -33.77 63.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.442 1.897 . . . . 0.0 113.227 168.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . 0.284 73.3 mt -85.52 -45.84 11.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 116.384 -1.77 . . . . 0.0 108.625 174.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.319 5.0 ttm105 -62.17 -64.3 0.97 Allowed 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 130.035 3.334 . . . . 0.0 110.79 -169.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.91 44.87 13.19 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 119.375 2.51 . . . . 0.0 119.375 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -106.63 -36.48 6.72 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 112.538 -1.831 . . . . 0.0 115.075 168.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 52.2 mtt -70.77 145.6 50.32 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 116.836 2.162 . . . . 0.0 116.836 -173.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 83.3 p -78.46 161.59 26.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 119.77 -1.831 . . . . 0.0 112.738 164.135 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -68.25 -20.15 64.78 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 119.345 -2.097 . . . . 0.0 108.665 -175.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -64.26 -45.09 89.62 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 115.093 -2.384 . . . . 0.0 113.083 164.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -62.3 -36.94 83.69 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 125.173 1.545 . . . . 0.0 113.059 177.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 91.3 mt -73.01 -51.81 16.8 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.43 1.492 . . . . 0.0 113.554 173.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 18.0 tptp -65.92 -46.14 79.33 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 119.443 -2.036 . . . . 0.0 110.892 -174.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -100.93 -17.53 16.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 124.177 0.923 . . . . 0.0 111.004 -164.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . 0.296 34.9 mt-10 -121.92 -16.25 7.64 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 115.613 -2.137 . . . . 0.0 111.432 -172.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 81.7 mt -112.04 -5.03 14.32 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 117.589 2.44 . . . . 0.0 117.589 162.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.63 21.65 69.18 Favored Glycine 0 C--N 1.334 0.467 0 O-C-N 124.433 1.083 . . . . 0.0 111.758 -177.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -111.9 108.32 17.65 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.617 -0.931 . . . . 0.0 112.131 -172.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.5 -176.19 51.26 Favored Glycine 0 CA--C 1.523 0.558 0 O-C-N 126.374 2.296 . . . . 0.0 109.606 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 26.8 mm -53.68 -46.02 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-O 125.925 2.774 . . . . 0.0 112.833 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.38 -23.94 54.1 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 117.643 -3.16 . . . . 0.0 110.12 -171.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 5.6 m -79.1 -35.47 42.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 125.696 1.873 . . . . 0.0 109.919 177.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 38.5 mm -74.77 -52.03 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 C-N-CA 130.884 3.674 . . . . 0.0 110.549 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 30.9 m -57.61 -37.98 74.17 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 130.095 3.358 . . . . 0.0 113.34 173.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -66.75 -47.09 73.32 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.997 -1.001 . . . . 0.0 111.531 169.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -54.64 -36.97 59.98 Favored Glycine 0 CA--C 1.521 0.466 0 O-C-N 119.121 -2.237 . . . . 0.0 114.83 166.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 24.2 p -72.47 -29.19 63.43 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.223 1.011 . . . . 0.0 110.24 -178.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -70.77 -44.59 66.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.475 1.51 . . . . 0.0 114.821 166.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 70.5 m -57.85 -34.63 69.93 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 115.072 1.508 . . . . 0.0 115.072 177.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 89' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' B' ' 89' ' ' LEU . 16.8 mt -60.89 -24.64 66.13 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 127.599 3.062 . . . . 0.0 111.598 168.017 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -93.8 -43.35 8.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.697 1.999 . . . . 0.0 111.353 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.35 -1.21 1.56 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.398 1.879 . . . . 0.0 115.328 162.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.16 149.76 50.7 Favored Pre-proline 0 N--CA 1.447 -0.585 0 O-C-N 119.708 -1.87 . . . . 0.0 110.287 174.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -60.47 144.61 99.53 Favored 'Trans proline' 0 N--CA 1.448 -1.204 0 C-N-CA 122.857 2.371 . . . . 0.0 112.658 164.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 25.2 m -67.92 -23.72 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -178.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -68.84 -4.68 17.17 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 117.852 -3.03 . . . . 0.0 114.308 166.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 15.0 tp -99.5 -35.61 9.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 120.726 1.603 . . . . 0.0 110.338 170.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 57.9 mtp85 -54.55 -41.29 69.59 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 130.9 3.68 . . . . 0.0 113.959 173.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -74.44 -42.41 59.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.158 2.183 . . . . 0.0 110.409 167.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -52.81 -36.82 59.01 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 116.362 -1.78 . . . . 0.0 114.244 178.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 21.0 mt -83.76 -35.27 24.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.081 1.753 . . . . 0.0 113.606 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -61.91 -31.54 71.86 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 171.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -103.1 -15.49 16.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 125.493 1.746 . . . . 0.0 115.378 -175.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.429 HG11 ' CD1' ' A' ' 25' ' ' LEU . 53.9 t -85.1 -54.21 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 128.668 2.787 . . . . 0.0 110.879 167.141 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 14.0 mt -78.11 -44.36 26.34 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 116.886 2.18 . . . . 0.0 116.886 -168.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 88.3 mt -76.67 -22.72 53.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 127.308 2.88 . . . . 0.0 111.07 -169.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -86.58 -4.7 59.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 128.704 2.802 . . . . 0.0 112.255 170.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 17.6 m -104.49 3.57 32.17 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.304 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 19.1 t70 . . . . . 0 C--O 1.251 1.139 0 C-N-CA 128.704 2.802 . . . . 0.0 114.203 178.444 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ttt . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.86 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.275 . . -72.33 154.43 40.95 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 127.45 2.969 . . . . 0.0 113.35 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -126.94 145.74 50.57 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 126.193 1.797 . . . . 0.0 110.414 -177.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -121.14 126.17 49.06 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.935 1.294 . . . . 0.0 112.228 171.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 5' ' ' SER . . . . . 0.506 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 58.5 p -136.82 142.3 38.25 Favored Pre-proline 0 N--CA 1.445 -0.725 0 C-N-CA 128.117 2.567 . . . . 0.0 109.225 -179.659 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 6' ' ' PRO . . . . . 0.506 ' HD3' ' HA ' ' C' ' 5' ' ' SER . 53.3 Cg_exo -64.88 -14.99 48.12 Favored 'Trans proline' 0 N--CA 1.451 -1.013 0 N-CA-C 120.157 3.099 . . . . 0.0 120.157 -164.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -140.97 147.76 39.26 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.125 1.37 . . . . 0.0 114.29 176.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 9.1 t -140.84 133.65 28.98 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.222 1.963 . . . . 0.0 108.527 164.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.52 -25.05 53.75 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 111.981 -2.372 . . . . 0.0 113.576 173.339 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.19 -29.36 34.61 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 119.381 -2.074 . . . . 0.0 110.096 178.092 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 39.8 mtt -66.07 -38.32 88.0 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.174 2.19 . . . . 0.0 112.284 169.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.17 84.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 117.441 2.386 . . . . 0.0 117.441 164.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -73.01 -35.48 66.81 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 125.533 1.771 . . . . 0.0 106.467 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -63.51 -44.92 92.91 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.514 2.042 . . . . 0.0 116.514 166.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -32.33 73.83 Favored 'General case' 0 N--CA 1.448 -0.547 1 O-C-N 116.141 -4.099 . . . . 0.0 107.973 177.066 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -68.0 -54.09 21.08 Favored 'General case' 0 N--CA 1.453 -0.292 1 O-C-N 115.628 -4.42 . . . . 0.0 111.416 173.128 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.275 67.0 mm-40 -54.44 -35.78 63.35 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 114.867 1.432 . . . . 0.0 114.867 172.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -64.58 -35.04 79.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 172.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 -71.16 -37.51 72.23 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 124.257 1.98 . . . . 0.0 108.383 177.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . 0.285 9.7 mp -67.09 -16.87 64.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.628 177.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -93.31 -31.41 14.69 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 114.099 -2.857 . . . . 0.0 113.377 178.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -64.06 -33.9 76.81 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 126.518 2.386 . . . . 0.0 109.008 168.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.284 11.1 t -60.99 -44.31 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 O-C-N 118.562 -2.586 . . . . 0.0 114.917 168.137 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -71.7 -32.3 67.68 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 126.623 2.452 . . . . 0.0 117.229 -174.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 50.0 tp -68.37 -50.61 51.92 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 118.482 -1.287 . . . . 0.0 108.599 173.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 61.7 tp -57.23 -37.2 71.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 120.544 -1.347 . . . . 0.0 110.461 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -47.67 -55.66 8.94 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.789 2.436 . . . . 0.0 111.849 173.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -74.87 -25.13 58.74 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.192 -2.813 . . . . 0.0 107.57 -177.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.5 -26.12 68.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 118.818 2.896 . . . . 0.0 118.818 -175.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -64.01 -41.33 97.49 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 122.745 1.259 . . . . 0.0 114.343 171.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -61.34 -36.5 80.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.072 -1.422 . . . . 0.0 111.551 -174.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . 0.312 29.6 p-10 -108.29 9.31 27.95 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.13 2.172 . . . . 0.0 116.756 173.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.535 5.0 m-20 61.21 28.45 18.05 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 117.065 -3.522 . . . . 0.0 120.507 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.02 4.13 35.33 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 116.654 2.094 . . . . 0.0 116.654 165.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -67.59 -43.31 80.84 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 122.08 2.218 . . . . 0.0 115.212 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 80.6 mt -65.92 -50.21 54.12 Favored Pre-proline 0 N--CA 1.45 -0.432 0 O-C-N 117.747 -3.096 . . . . 0.0 112.449 166.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -42.82 -49.4 6.78 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 CA-C-N 124.176 2.527 . . . . 0.0 118.205 162.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 19.8 tp -63.36 -40.62 97.77 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.318 66.8 mt -70.77 -8.4 52.05 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 118.329 -2.732 . . . . 0.0 115.514 174.319 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -107.96 -1.49 20.58 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 130.997 3.719 . . . . 0.0 111.32 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 12.3 tp -104.98 -48.05 3.84 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 120.814 -1.179 . . . . 0.0 113.194 166.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 87.5 mmm -78.29 -2.53 38.41 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -170.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mp -138.75 154.84 48.56 Favored 'General case' 0 N--CA 1.452 -0.342 1 O-C-N 115.877 -4.264 . . . . 0.0 107.663 -172.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 54.6 p -79.67 160.25 69.94 Favored Pre-proline 0 N--CA 1.449 -0.521 0 C-N-CA 129.791 3.236 . . . . 0.0 112.655 163.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -48.52 -43.35 33.43 Favored 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 122.811 2.341 . . . . 0.0 114.907 169.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -40.35 94.9 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 118.091 -2.881 . . . . 0.0 108.717 175.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -66.94 -35.32 79.72 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 123.686 2.948 . . . . 0.0 113.346 -176.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 82.3 mtm-85 -64.8 -31.36 72.56 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 127.608 3.575 . . . . 0.0 115.132 165.093 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.78 -30.0 45.33 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 111.882 -2.417 . . . . 0.0 105.521 -172.095 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.46 -37.05 77.15 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 123.485 1.612 . . . . 0.0 114.613 175.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 68.6 mt -74.91 -25.63 59.05 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 117.724 2.49 . . . . 0.0 117.724 167.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.11 -45.88 94.49 Favored Glycine 0 CA--C 1.526 0.751 0 O-C-N 118.837 -2.414 . . . . 0.0 111.87 164.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 58.3 m -60.98 -57.16 13.8 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 130.249 3.42 . . . . 0.0 109.412 174.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.38 26.9 mtt180 -60.59 -31.37 70.52 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.025 -1.047 . . . . 0.0 113.452 -170.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 46.8 t -67.97 -45.47 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.251 0.62 . . . . 0.0 110.088 174.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.76 -1.96 6.27 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.549 -2.594 . . . . 0.0 115.329 171.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 53.1 mt -99.49 -34.13 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 120.557 1.526 . . . . 0.0 110.328 173.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 77.5 t -69.85 -41.49 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 117.592 -3.192 . . . . 0.0 113.852 172.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -64.02 -42.66 97.06 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 122.494 1.14 . . . . 0.0 111.944 176.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -64.34 -24.6 67.7 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 170.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 97.0 mt -90.73 -17.34 26.88 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 63.5 mt -84.81 -41.08 16.44 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.881 2.472 . . . . 0.0 111.482 163.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 29.7 ttm105 -61.88 -41.85 98.35 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 126.228 2.918 . . . . 0.0 112.373 175.028 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.35 12.99 61.96 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 119.682 2.633 . . . . 0.0 119.682 172.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -73.28 -31.49 64.09 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 118.442 -2.799 . . . . 0.0 111.604 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 17.3 mmt -72.04 141.53 49.29 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 126.503 3.049 . . . . 0.0 110.585 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 53.8 p -114.1 169.01 9.33 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 111.466 -2.606 . . . . 0.0 113.833 -171.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -43.43 -33.91 1.18 Allowed 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 126.668 2.48 . . . . 0.0 116.606 -170.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 26.2 ttp-105 -72.37 -51.68 19.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 126.252 1.821 . . . . 0.0 109.468 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -69.37 -40.78 77.24 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 128.523 2.729 . . . . 0.0 112.414 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 91.1 mt -52.28 -21.46 3.5 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 117.233 2.309 . . . . 0.0 117.233 167.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -106.16 -42.79 4.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 120.322 -1.486 . . . . 0.0 110.949 166.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -88.16 -8.21 55.72 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 120.927 -1.108 . . . . 0.0 112.788 -165.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -129.71 -47.31 1.15 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 116.185 -1.864 . . . . 0.0 114.342 -177.013 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 mp -64.71 -28.3 69.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 120.164 1.347 . . . . 0.0 111.336 163.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 57.09 -151.6 26.35 Favored Glycine 0 N--CA 1.447 -0.595 0 N-CA-C 117.214 1.645 . . . . 0.0 117.214 -168.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.03 -20.84 55.42 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 116.491 -3.947 . . . . 0.0 114.981 -168.119 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.32 -5.1 26.63 Favored Glycine 0 C--N 1.337 0.599 0 O-C-N 126.958 2.661 . . . . 0.0 115.618 -178.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 16.5 tt -64.4 -31.87 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 O-C-N 117.601 -3.293 . . . . 0.0 110.468 170.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.15 -18.44 36.72 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 122.326 2.33 . . . . 0.0 114.142 -177.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 55.1 m -73.99 -26.8 60.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.269 2.228 . . . . 0.0 112.841 170.1 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 24.4 mm -98.13 -6.39 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 O-C-N 117.134 -3.479 . . . . 0.0 110.954 178.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 80.8 p -125.01 4.95 7.96 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 118.584 -2.573 . . . . 0.0 116.586 -166.036 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -127.66 149.09 50.36 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.399 0.68 . . . . 0.0 111.952 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.61 178.15 42.55 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-O 117.194 -1.892 . . . . 0.0 114.77 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 18.4 m -71.16 -15.56 62.49 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 118.045 2.609 . . . . 0.0 118.045 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -96.15 -7.3 36.22 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 120.524 3.528 . . . . 0.0 120.524 170.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 8.4 p -42.96 158.71 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 123.209 1.48 . . . . 0.0 114.277 175.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 57.5 tp -54.59 -38.24 66.5 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 130.536 3.534 . . . . 0.0 109.119 -167.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -99.3 -1.15 39.7 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 122.126 2.239 . . . . 0.0 113.077 -175.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -116.4 -13.21 11.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.322 -0.853 . . . . 0.0 112.656 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.29 155.76 6.54 Favored Pre-proline 0 N--CA 1.454 -0.257 0 C-N-CA 126.628 1.971 . . . . 0.0 113.896 171.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.28 149.86 83.27 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.12 1.88 . . . . 0.0 112.73 178.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 29.3 t -65.88 -46.61 88.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 126.105 1.762 . . . . 0.0 109.614 -172.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -62.29 -25.85 68.08 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 113.172 -3.299 . . . . 0.0 117.684 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 15.8 tp -66.55 -48.37 69.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 125.793 1.933 . . . . 0.0 109.377 163.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -63.95 -51.01 66.35 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.355 -165.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -60.15 -29.76 68.86 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.819 2.048 . . . . 0.0 116.236 168.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.7 t90 -78.25 -30.11 48.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 122.384 2.357 . . . . 0.0 108.673 -177.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 16.2 mt -63.77 -40.54 96.93 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 116.815 -1.564 . . . . 0.0 115.121 177.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -70.18 -18.32 63.19 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 127.522 2.329 . . . . 0.0 111.552 177.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -85.7 -28.16 24.84 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 115.359 -2.258 . . . . 0.0 116.158 167.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 17.4 t -96.42 -51.03 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.99 2.632 . . . . 0.0 112.803 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 85.1 mt -76.58 -23.63 53.49 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.101 -175.373 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 71.6 mt -128.91 29.48 5.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.102 1.761 . . . . 0.0 110.494 -168.335 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 17.4 pttp . . . . . 0 N--CA 1.451 -0.422 0 CA-C-O 128.08 3.8 . . . . 0.0 117.518 -174.67 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' D' D ' 5' ' ' SER . . . . . 0.447 ' HB2' ' HD2' ' D' ' 6' ' ' PRO . 59.7 p . . . . . 0 N--CA 1.451 -0.388 0 CA-C-O 118.041 -0.981 . . . . 0.0 111.292 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 6' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' D' ' 5' ' ' SER 0.329 89.5 Cg_endo -78.74 -18.42 11.83 Favored 'Trans proline' 0 N--CA 1.45 -1.049 1 C-N-CA 126.943 5.095 . . . . 0.0 118.774 -166.822 . . . . . . . . 4 3 . 1 . 011 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -154.87 129.69 9.35 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.638 3.175 . . . . 0.0 106.513 156.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.9 t -64.81 124.74 22.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 118.432 2.752 . . . . 0.0 118.432 -174.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.82 -42.54 58.41 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 128.033 2.533 . . . . 0.0 110.37 166.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.38 -27.08 65.92 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.294 -2.129 . . . . 0.0 111.979 177.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.298 9.2 mmt -66.57 -49.09 67.55 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 112.956 -3.402 . . . . 0.0 113.882 161.319 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.14 -36.52 51.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 125.842 2.734 . . . . 0.0 115.126 175.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 35.7 tp10 -76.04 -47.9 22.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 116.406 -1.759 . . . . 0.0 108.899 174.302 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -55.55 -44.23 76.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 128.682 2.793 . . . . 0.0 110.668 176.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 15' ' ' ARG . . . . . 0.406 HH21 ' CD ' ' D' ' 18' ' ' GLU . 0.0 OUTLIER -64.66 -37.06 86.28 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.324 -2.735 . . . . 0.0 115.372 173.651 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -57.56 -45.39 85.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 119.809 1.186 . . . . 0.0 114.199 165.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -74.99 -35.04 62.04 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.639 -1.913 . . . . 0.0 114.305 -175.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 18' ' ' GLU . . . . . 0.406 ' CD ' HH21 ' D' ' 15' ' ' ARG . 79.0 mt-10 -62.0 -21.28 64.73 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 116.189 -1.862 . . . . 0.0 113.924 163.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -89.33 -26.72 20.95 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 127.22 2.825 . . . . 0.0 113.104 172.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 20' ' ' LEU . . . . . 0.479 HD23 ' HA ' ' D' ' 20' ' ' LEU . 20.4 mt -69.61 -30.23 67.93 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 123.788 1.756 . . . . 0.0 113.607 172.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 37.7 ttt180 -71.51 -24.79 62.03 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.317 -2.115 . . . . 0.0 112.261 168.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 22' ' ' PHE . . . . . 0.406 ' CZ ' HD22 ' D' ' 26' ' ' LEU . 69.3 t80 -74.06 -56.45 4.92 Favored 'General case' 0 N--CA 1.453 -0.318 1 O-C-N 115.746 -4.346 . . . . 0.0 108.972 167.406 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 23.4 t -58.76 -37.82 68.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 121.527 1.967 . . . . 0.0 114.476 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -61.19 -39.4 90.03 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 124.76 1.288 . . . . 0.0 114.442 166.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 16.6 tp -67.44 -41.67 84.38 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 119.937 -1.727 . . . . 0.0 112.466 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 26' ' ' LEU . . . . . 0.406 HD22 ' CZ ' ' D' ' 22' ' ' PHE . 55.0 tp -63.07 -49.36 74.8 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 113.53 -3.128 . . . . 0.0 112.07 171.082 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -48.91 -55.7 11.0 Favored 'General case' 0 N--CA 1.451 -0.389 1 CA-C-N 126.978 4.445 . . . . 0.0 111.561 167.601 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -52.81 -30.84 35.65 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 121.294 1.861 . . . . 0.0 112.655 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.88 -34.06 62.16 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 123.126 1.441 . . . . 0.0 112.746 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -68.78 -4.93 17.9 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.109 -3.494 . . . . 0.0 115.233 163.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -104.94 -6.97 19.63 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 117.347 -3.345 . . . . 0.0 113.054 176.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 50.2 p30 -132.97 9.75 4.18 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 128.251 2.62 . . . . 0.0 114.016 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.38 7.1 m-20 67.35 6.76 5.07 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 116.555 2.058 . . . . 0.0 116.555 173.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 32.1 mt -77.68 16.24 0.7 Allowed 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 116.484 -3.885 . . . . 0.0 115.2 166.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -81.19 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.872 2.469 . . . . 0.0 114.059 171.337 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 14.3 mt -48.58 -30.12 1.95 Allowed Pre-proline 0 N--CA 1.447 -0.615 0 O-C-N 116.613 -3.804 . . . . 0.0 114.085 -176.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -68.13 -48.17 1.42 Allowed 'Trans proline' 0 N--CA 1.447 -1.241 0 O-C-N 114.412 -3.52 . . . . 0.0 116.095 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . 0.261 63.6 tp -48.97 -50.74 34.15 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 116.558 -1.687 . . . . 0.0 108.713 170.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 2.8 mt -66.54 -39.32 88.5 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 113.69 -3.052 . . . . 0.0 106.299 -172.191 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 -84.22 -17.26 40.44 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 115.587 -2.149 . . . . 0.0 114.119 -176.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 39.9 tp -65.72 -54.5 26.49 Favored 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 125.01 1.444 . . . . 0.0 108.379 161.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 1.7 mmt -68.1 -39.52 82.81 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.101 -1.428 . . . . 0.0 108.43 -168.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 37.3 mt -119.59 137.32 53.93 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 -165.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 8.0 p -73.85 153.75 89.07 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-N 114.057 -1.429 . . . . 0.0 112.757 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -48.99 -37.15 36.66 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 124.97 3.78 . . . . 0.0 120.496 -174.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.365 24.5 m-20 -72.39 -23.16 61.07 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 115.069 -2.396 . . . . 0.0 111.189 176.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -85.1 -32.03 23.03 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 15.7 mtm180 -75.8 -37.1 59.46 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.597 1.559 . . . . 0.0 110.6 173.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -54.83 -47.21 74.4 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 129.401 3.081 . . . . 0.0 107.76 170.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.46 -46.18 80.86 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -178.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.71 -42.76 95.05 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 116.141 -1.885 . . . . 0.0 113.4 174.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.76 -27.07 65.97 Favored Glycine 0 C--N 1.338 0.643 0 CA-C-N 120.307 1.412 . . . . 0.0 116.063 167.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 95.7 m -82.99 -35.48 25.84 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 117.052 -3.617 . . . . 0.0 110.94 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -60.71 -33.39 72.81 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 116.841 -3.662 . . . . 0.0 108.519 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 43.9 t -64.27 -36.11 76.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 123.738 2.972 . . . . 0.0 114.124 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -80.56 -32.28 36.66 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 115.973 -1.965 . . . . 0.0 114.52 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 82.7 mt -49.0 -48.75 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 116.612 -1.661 . . . . 0.0 113.568 160.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 75.3 t -68.99 -43.77 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 O-C-N 124.578 1.174 . . . . 0.0 109.835 -178.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -59.13 -40.02 84.16 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -67.04 -25.86 66.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 116.213 -1.851 . . . . 0.0 112.35 175.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 mt -72.96 -13.35 61.22 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 122.152 2.251 . . . . 0.0 112.169 173.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 85.5 mt -111.85 -18.96 12.57 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 117.393 -1.289 . . . . 0.0 113.759 176.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 ttm105 -69.85 -47.49 62.46 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 162.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 44.55 66.02 1.54 Allowed Glycine 0 CA--C 1.52 0.381 0 C-N-CA 126.285 1.898 . . . . 0.0 110.156 -173.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -130.67 -29.78 1.91 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.023 0.929 . . . . 0.0 112.282 164.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 22.2 mmt -81.02 69.35 7.6 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 125.213 2.435 . . . . 0.0 108.342 165.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 89.6 p -79.16 145.68 33.55 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.593 1.957 . . . . 0.0 111.243 -162.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 56.55 -88.17 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.125 -2.307 . . . . 0.0 115.927 156.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -72.54 -33.46 66.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 169.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -64.66 -42.72 95.2 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.94 -41.09 77.62 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.58 1.8 . . . . 0.0 112.517 174.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 58.1 mtmt -77.71 -37.31 49.77 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 125.09 1.493 . . . . 0.0 112.088 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -83.34 -56.3 3.84 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 121.692 2.042 . . . . 0.0 111.441 -177.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -93.95 -38.69 11.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 125.126 1.516 . . . . 0.0 113.128 -162.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -90.21 -24.06 21.1 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.258 -1.353 . . . . 0.0 108.152 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 74.58 -153.76 46.38 Favored Glycine 0 C--N 1.335 0.52 0 O-C-N 118.356 -2.715 . . . . 0.0 118.187 141.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -34.83 -65.02 0.23 Allowed 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 129.228 3.011 . . . . 0.0 113.71 -165.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.73 -1.7 2.9 Favored Glycine 0 C--N 1.339 0.701 0 O-C-N 126.412 2.32 . . . . 0.0 116.851 -174.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 2.2 tt -47.53 -34.69 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 122.549 3.175 . . . . 0.0 111.181 164.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -91.63 -20.78 21.26 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 119.388 -2.07 . . . . 0.0 110.266 -169.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 81.9 m -65.55 -46.2 80.46 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.349 1.86 . . . . 0.0 110.695 163.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 mm -73.9 -33.89 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 125.347 1.459 . . . . 0.0 111.361 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 16.3 p -119.72 9.61 11.45 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 118.775 2.88 . . . . 0.0 118.775 -174.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 17.8 mtp85 -123.85 173.47 8.16 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 153.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.63 152.98 29.72 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-O 116.633 -2.204 . . . . 0.0 113.498 -154.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 9.6 p -61.44 -29.6 70.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -165.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -128.6 45.05 2.85 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 123.878 1.799 . . . . 0.0 112.18 -177.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 1.7 p -69.24 177.73 2.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 119.808 -1.808 . . . . 0.0 109.382 -178.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 tp -66.22 -24.05 66.54 Favored 'General case' 0 N--CA 1.451 -0.379 1 O-C-N 116.108 -4.12 . . . . 0.0 114.731 176.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -67.72 -7.81 30.24 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 118.394 2.739 . . . . 0.0 118.394 159.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -133.93 11.95 3.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 115.382 -2.247 . . . . 0.0 113.245 -168.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 92' ' ' ALA . . . . . 0.428 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 30.35 99.32 0.03 OUTLIER Pre-proline 0 N--CA 1.452 -0.343 0 N-CA-C 116.558 2.058 . . . . 0.0 116.558 134.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 93' ' ' PRO . . . . . 0.428 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.346 0.3 OUTLIER 39.33 43.98 0.0 OUTLIER 'Cis proline' 0 N--CA 1.445 -1.341 0 O-C-N 117.147 -2.08 . . . . 0.0 109.902 26.339 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.94 -21.11 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 O-C-N 119.508 -1.995 . . . . 0.0 111.26 170.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.304 0.0 OUTLIER -91.15 -26.16 19.23 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 125.462 1.726 . . . . 0.0 112.201 -171.414 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.21 -51.7 55.14 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 131.064 3.745 . . . . 0.0 108.495 162.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -58.94 -48.8 80.2 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 126.128 1.771 . . . . 0.0 113.802 -174.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -63.56 -29.14 70.44 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 125.423 1.702 . . . . 0.0 115.399 170.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 70.6 t90 -83.37 -27.31 29.76 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 121.335 1.88 . . . . 0.0 111.652 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 25.7 mt -69.59 -34.8 74.65 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.179 -3.451 . . . . 0.0 110.498 171.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -67.64 -20.52 65.34 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 116.812 -1.566 . . . . 0.0 112.769 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -104.74 -9.88 17.82 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 126.556 2.41 . . . . 0.0 116.765 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.439 3.2 t -106.74 -26.61 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-O 125.698 2.666 . . . . 0.0 116.141 171.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 36.0 mt -104.83 -19.24 13.96 Favored 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 116.611 -3.806 . . . . 0.0 114.545 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 5.1 mp -110.73 44.7 1.23 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.771 1.628 . . . . 0.0 110.495 153.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -62.83 167.71 4.44 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 117.835 2.532 . . . . 0.0 117.835 169.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.9 m -52.4 -42.23 63.85 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 119.314 -2.116 . . . . 0.0 115.08 -170.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.247 0.945 0 C-N-CA 128.612 2.765 . . . . 0.0 118.104 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.451 -0.408 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.32 -22.78 61.13 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 120.428 3.492 . . . . 0.0 120.428 167.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -69.78 -37.51 76.37 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 120.985 -1.072 . . . . 0.0 112.292 157.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -66.78 -37.25 84.22 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 116.645 -3.784 . . . . 0.0 109.414 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -76.97 -3.81 40.83 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 130.747 3.619 . . . . 0.0 116.683 169.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -83.0 -50.31 8.67 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 116.412 -2.115 . . . . 0.0 110.334 163.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -41.76 -41.19 2.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 119.37 3.1 . . . . 0.0 119.37 161.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -65.17 -36.9 85.66 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.032 1.333 . . . . 0.0 113.694 174.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 9.2 t-105 -72.44 -45.57 59.01 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 117.61 -1.186 . . . . 0.0 112.807 170.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.32 -27.52 67.4 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 117.696 -1.145 . . . . 0.0 113.002 178.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . 0.313 12.1 ttt-85 -60.24 -23.22 63.9 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 130.756 3.622 . . . . 0.0 115.329 169.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.252 61.6 t80 -79.79 -43.95 21.54 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 115.427 -2.509 . . . . 0.0 109.684 165.383 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 68.8 t -69.51 -35.99 69.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -168.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -60.96 -37.01 80.89 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 165.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.9 tp -72.61 -30.41 64.32 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.257 1.023 . . . . 0.0 112.298 -177.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 48.5 tp -82.28 -31.76 29.91 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 128.047 2.539 . . . . 0.0 106.056 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -62.73 -44.35 96.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 121.996 2.18 . . . . 0.0 108.261 175.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -68.39 -36.29 78.94 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 127.475 3.512 . . . . 0.0 109.65 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.83 -40.93 95.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 116.535 -3.853 . . . . 0.0 117.477 175.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -68.84 -33.48 73.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 120.544 1.52 . . . . 0.0 113.044 173.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -71.96 -21.24 61.62 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 117.161 -3.462 . . . . 0.0 116.39 170.082 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -101.26 11.72 38.81 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 114.04 -2.886 . . . . 0.0 114.512 168.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 48.67 42.94 20.27 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 125.225 1.578 . . . . 0.0 113.142 -175.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -114.28 -1.66 13.53 Favored 'General case' 0 N--CA 1.45 -0.458 1 C-N-CA 133.538 4.735 . . . . 0.0 113.314 176.072 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -56.81 -43.08 80.62 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 122.683 2.492 . . . . 0.0 112.951 -178.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.444 HD23 ' HA ' ' A' ' 36' ' ' LEU . 12.5 mt -64.17 -63.45 3.82 Favored Pre-proline 0 N--CA 1.447 -0.584 0 O-C-N 120.549 -1.344 . . . . 0.0 109.841 -175.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -70.17 -11.58 30.56 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 CA-C-O 115.462 -1.974 . . . . 0.0 112.716 -174.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.6 tp -70.52 -63.25 1.13 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 129.254 3.021 . . . . 0.0 105.105 167.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 37.0 mt -58.86 -34.5 71.67 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 119.571 -1.956 . . . . 0.0 114.537 -175.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -51.71 -50.76 59.88 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.479 1.112 . . . . 0.0 112.299 164.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.8 tt -64.32 -47.18 80.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 126.584 1.954 . . . . 0.0 109.869 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 65.9 mmm -83.86 -17.95 39.17 Favored 'General case' 0 N--CA 1.453 -0.295 1 CA-C-O 111.306 -4.188 . . . . 0.0 116.49 -167.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 mt -133.5 138.77 46.28 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 124.201 3.182 . . . . 0.0 108.444 170.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.9 p -73.5 155.5 89.41 Favored Pre-proline 0 N--CA 1.448 -0.544 0 CA-C-N 114.359 -1.291 . . . . 0.0 111.011 177.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -59.45 -29.24 89.55 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 CA-C-O 114.905 -2.206 . . . . 0.0 117.212 -170.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.49 -23.61 53.76 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 122.748 2.522 . . . . 0.0 107.372 178.059 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -81.26 -27.63 35.08 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 116.74 -3.725 . . . . 0.0 113.221 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.8 mtm-85 -69.73 -57.13 5.5 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 117.904 -2.998 . . . . 0.0 108.373 178.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . 0.275 24.4 tt0 -61.84 -27.18 68.59 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.365 1.866 . . . . 0.0 111.889 177.542 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.75 -38.05 70.44 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.62 2.368 . . . . 0.0 110.269 174.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.9 mt -70.62 -27.71 64.29 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 120.823 1.647 . . . . 0.0 115.199 166.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.5 -38.02 95.69 Favored Glycine 0 C--N 1.335 0.501 0 CA-C-N 122.094 2.225 . . . . 0.0 111.299 167.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.0 m -68.91 -39.87 79.42 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 119.614 3.19 . . . . 0.0 119.614 171.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -54.93 -24.13 22.21 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 114.829 -2.51 . . . . 0.0 115.724 163.115 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.3 t -60.93 -38.66 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 122.397 2.362 . . . . 0.0 113.17 164.182 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -77.74 -29.67 51.23 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 114.983 -2.436 . . . . 0.0 114.378 171.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 66.8 mt -74.74 -24.57 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 122.48 2.4 . . . . 0.0 112.556 172.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 4.3 t -71.12 -51.77 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 C-N-CA 124.789 1.236 . . . . 0.0 110.986 159.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -50.51 -67.99 0.21 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.067 1.747 . . . . 0.0 111.922 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -71.79 -34.93 69.82 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.611 2.365 . . . . 0.0 110.541 -165.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.66 -39.45 91.42 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 118.022 2.601 . . . . 0.0 118.022 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.89 -37.14 72.98 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.751 2.02 . . . . 0.0 113.877 177.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 34.8 ttm105 -66.76 -44.6 80.97 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 165.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.7 18.02 55.49 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 110.014 -3.266 . . . . 0.0 113.372 155.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.257 47.9 mm-40 -88.18 -27.22 21.98 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 120.595 2.198 . . . . 0.0 107.025 -179.084 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 57.3 mtt -91.91 124.95 36.4 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 125.098 1.499 . . . . 0.0 112.603 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.8 p -73.07 164.63 26.41 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.024 1.73 . . . . 0.0 112.589 166.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.404 ' HB3' HG23 ' A' ' 79' ' ' ILE . 54.3 mt-30 -59.4 -40.06 85.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 123.967 0.792 . . . . 0.0 112.999 166.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 42.2 tpt85 -57.63 -27.37 62.73 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 173.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -87.1 -34.99 18.93 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 117.063 2.245 . . . . 0.0 117.063 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 92.0 mt -58.6 -26.16 63.38 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 118.806 -2.434 . . . . 0.0 115.592 167.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -42.28 -44.67 3.92 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 115.663 1.727 . . . . 0.0 115.663 157.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -83.37 -46.12 12.93 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 174.141 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -62.53 -46.77 86.87 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 125.458 1.503 . . . . 0.0 111.148 -169.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.9 mt -119.09 9.21 11.73 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 111.787 -2.46 . . . . 0.0 109.042 -169.096 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.79 12.1 74.17 Favored Glycine 0 C--N 1.337 0.596 0 N-CA-C 117.985 1.954 . . . . 0.0 117.985 174.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -97.2 141.59 30.14 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 118.875 2.917 . . . . 0.0 118.875 -157.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.03 123.17 21.04 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-O 116.656 -2.191 . . . . 0.0 110.422 168.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.404 HG23 ' HB3' ' A' ' 68' ' ' GLN . 72.0 mt -53.88 -35.08 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 118.719 1.259 . . . . 0.0 112.387 -162.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.2 -14.36 61.78 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 119.308 -2.12 . . . . 0.0 114.491 -171.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 78.0 p -74.56 -44.6 50.2 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.9 mm -68.93 -29.23 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-O 115.091 -2.385 . . . . 0.0 107.453 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 99.0 m -60.89 -32.15 71.62 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 120.908 1.686 . . . . 0.0 114.009 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -69.69 -46.26 66.43 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.919 -1.113 . . . . 0.0 113.114 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.15 -26.97 65.05 Favored Glycine 0 CA--C 1.525 0.712 0 O-C-N 119.739 -1.851 . . . . 0.0 110.29 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.2 m -64.64 -38.93 92.68 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.854 0.862 . . . . 0.0 110.161 169.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -77.34 -30.03 53.72 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 118.697 -2.502 . . . . 0.0 110.757 175.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.7 m -67.43 -40.14 85.46 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 122.362 2.346 . . . . 0.0 112.938 170.29 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.4 tp -64.4 -41.7 96.5 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 117.626 2.454 . . . . 0.0 117.626 168.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -57.8 -39.53 77.79 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 119.756 -1.84 . . . . 0.0 111.04 165.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.71 3.59 44.2 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 121.422 3.86 . . . . 0.0 121.422 175.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.44 153.36 85.8 Favored Pre-proline 0 N--CA 1.449 -0.482 0 O-C-N 126.336 2.272 . . . . 0.0 108.782 178.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -67.12 148.57 81.28 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 N-CA-C 109.303 -1.076 . . . . 0.0 109.303 -175.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.14 -30.79 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 117.852 -1.071 . . . . 0.0 111.692 -163.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 16.1 pm0 -76.86 -7.96 56.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.267 2.227 . . . . 0.0 111.392 -177.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 49.3 tp -87.34 -46.85 9.29 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 124.794 1.309 . . . . 0.0 112.944 168.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 54.5 mtm-85 -56.86 -35.28 68.7 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 119.251 -2.156 . . . . 0.0 110.493 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -66.94 -20.61 65.93 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 116.844 -3.66 . . . . 0.0 117.69 171.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -90.27 -42.94 10.7 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 118.061 -2.9 . . . . 0.0 106.715 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.66 -20.45 64.83 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 126.12 1.768 . . . . 0.0 114.683 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -70.21 -48.53 56.69 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.861 -3.024 . . . . 0.0 108.677 170.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -71.44 -32.23 68.12 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.239 -175.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 80.8 t -81.37 -59.75 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-O 113.464 -3.16 . . . . 0.0 110.959 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.6 mt -96.28 -29.69 13.86 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 127.367 2.917 . . . . 0.0 113.268 -172.075 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 11.7 mt -107.46 -22.9 12.38 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 114.735 -2.786 . . . . 0.0 110.84 -159.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 71.7 tttt . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 125.319 2.485 . . . . 0.0 115.19 -175.314 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.423 0 N-CA-C 118.244 2.683 . . . . 0.0 118.244 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.86 -30.27 28.74 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.289 1.836 . . . . 0.0 108.097 172.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.77 -17.9 65.1 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 163.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -85.02 -46.14 11.47 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.508 1.123 . . . . 0.0 112.615 171.402 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 36.5 tp60 -63.77 -28.78 70.11 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 118.392 -0.813 . . . . 0.0 111.863 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.448 ' HD3' ' HA ' ' B' ' 15' ' ' ARG . 25.9 mmt180 -85.41 -16.21 40.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.774 -1.829 . . . . 0.0 113.793 173.138 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -80.69 -33.46 35.4 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 119.182 -2.199 . . . . 0.0 108.433 172.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -78.03 -13.52 59.84 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 118.185 -2.822 . . . . 0.0 110.852 175.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -72.91 -39.0 66.68 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 126.183 1.793 . . . . 0.0 113.321 160.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -62.05 -35.94 80.12 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.37 -2.081 . . . . 0.0 111.005 173.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 93.9 mt -70.01 -26.78 64.23 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 128.425 2.69 . . . . 0.0 113.963 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -54.0 -59.97 3.94 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 115.685 -2.102 . . . . 0.0 110.336 165.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -44.33 -45.74 8.94 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.011 2.187 . . . . 0.0 112.949 166.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 39.8 t -65.29 -48.42 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 -176.026 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.14 -33.74 73.93 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 117.427 -3.296 . . . . 0.0 113.5 172.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 48.6 tp -61.53 -47.03 87.44 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 177.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.261 65.3 tp -66.96 -39.56 87.27 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.308 -3.37 . . . . 0.0 116.066 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -56.3 -44.8 80.24 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 120.423 -1.423 . . . . 0.0 110.079 173.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -71.87 -30.08 65.04 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . 0.299 . . -68.14 -42.33 80.29 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 113.475 -3.155 . . . . 0.0 114.938 168.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -70.27 -10.59 59.38 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 116.617 2.081 . . . . 0.0 116.617 170.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -84.35 -13.3 52.72 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.845 1.258 . . . . 0.0 112.865 168.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -121.63 6.79 9.99 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 122.513 1.149 . . . . 0.0 112.747 176.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.294 1.7 m-20 57.04 30.12 17.66 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 119.429 -2.045 . . . . 0.0 115.496 -176.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 50.4 mt -102.3 14.21 32.57 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 128.886 2.874 . . . . 0.0 110.127 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -64.93 -38.57 91.39 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 114.583 -2.627 . . . . 0.0 117.764 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.26 34.0 tp -67.59 -55.1 15.33 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 126.007 2.067 . . . . 0.0 109.569 -175.176 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.31 -14.45 22.91 Favored 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 123.794 2.996 . . . . 0.0 114.025 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 40.4 tp -73.93 -41.74 61.61 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 119.405 -2.059 . . . . 0.0 112.511 163.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 46.3 mt -75.9 -25.57 56.18 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.917 -1.992 . . . . 0.0 115.144 175.341 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -67.76 -41.26 83.61 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.855 1.262 . . . . 0.0 110.345 163.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 26.7 tp -62.3 -46.38 89.02 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 117.671 -3.143 . . . . 0.0 107.283 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 23.7 mmt -77.57 -17.22 58.08 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.602 -2.561 . . . . 0.0 116.975 -169.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 mt -134.01 138.12 45.19 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 118.634 -2.541 . . . . 0.0 108.059 -175.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 64.8 p -89.01 164.98 29.05 Favored Pre-proline 0 N--CA 1.45 -0.467 0 C-N-CA 127.58 2.352 . . . . 0.0 109.607 -171.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -60.66 -27.99 85.78 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 124.215 3.277 . . . . 0.0 117.311 -172.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -76.49 -25.8 54.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 119.67 -1.894 . . . . 0.0 112.052 173.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -92.5 -33.7 14.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 116.628 -3.795 . . . . 0.0 110.168 -169.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 mtm-85 -70.88 -40.96 71.94 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 115.354 -2.26 . . . . 0.0 111.808 176.003 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -67.27 -30.78 70.76 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 119.891 1.223 . . . . 0.0 111.335 170.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.85 -34.08 60.05 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 120.003 -1.686 . . . . 0.0 115.044 177.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 28.3 mt -62.7 -44.59 95.83 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 118.694 -2.504 . . . . 0.0 110.635 166.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -42.65 -52.43 5.44 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-N 122.295 2.316 . . . . 0.0 114.411 163.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 6.2 m -74.74 -37.86 62.4 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.503 -0.848 . . . . 0.0 111.262 -170.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.42 ' HA ' HD12 ' B' ' 57' ' ' ILE . 89.7 mtt180 -57.48 -35.94 70.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 113.11 -3.329 . . . . 0.0 113.597 168.202 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 62.5 t -65.7 -35.25 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 114.241 -2.984 . . . . 0.0 106.749 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 48.6 mtp180 -74.98 -22.37 58.59 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 116.973 -1.489 . . . . 0.0 114.788 177.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.42 HD12 ' HA ' ' B' ' 54' ' ' ARG . 31.6 mt -70.17 -47.59 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 119.789 1.177 . . . . 0.0 108.767 173.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.283 47.1 t -73.84 -25.26 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 118.099 -2.876 . . . . 0.0 109.362 -175.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -64.34 -49.45 71.65 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 115.496 1.665 . . . . 0.0 115.496 166.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -64.68 -33.9 77.03 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 127.435 2.959 . . . . 0.0 110.858 175.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 52.1 mt -63.01 -21.22 66.0 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 122.567 2.44 . . . . 0.0 116.74 169.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 39.0 mt -89.05 -38.74 14.15 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 116.9 -1.524 . . . . 0.0 112.173 167.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.281 26.2 ttm105 -55.02 -53.13 59.67 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 123.964 1.84 . . . . 0.0 112.879 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.61 45.91 33.91 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-O 114.666 -3.297 . . . . 0.0 116.034 -172.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -118.26 -44.95 2.66 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 121.107 2.453 . . . . 0.0 115.018 -173.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 50.7 mtt -70.34 148.36 48.55 Favored 'General case' 0 N--CA 1.447 -0.586 2 O-C-N 113.286 -5.884 . . . . 0.0 114.43 179.372 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 73.0 p -74.96 161.36 29.57 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 128.063 2.545 . . . . 0.0 115.452 158.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -55.02 -24.42 24.46 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.557 0.694 . . . . 0.0 112.119 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 67.0 ttt-85 -77.1 -39.59 48.97 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 127.553 2.341 . . . . 0.0 110.61 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -70.68 -45.44 65.05 Favored 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 127.229 2.831 . . . . 0.0 108.229 174.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 44.7 mt -49.72 -41.02 42.49 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 117.451 2.389 . . . . 0.0 117.451 173.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 17.7 tptp -62.32 -43.91 97.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.479 2.311 . . . . 0.0 116.491 171.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -114.95 -24.09 8.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 126.02 1.728 . . . . 0.0 113.104 -158.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -105.7 -13.89 15.42 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 125.121 1.368 . . . . 0.0 113.862 175.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 57.4 mt -137.62 -3.6 1.87 Allowed 'General case' 0 N--CA 1.446 -0.628 1 O-C-N 116.044 -4.16 . . . . 0.0 108.398 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 84.46 2.75 88.89 Favored Glycine 0 C--N 1.336 0.561 0 O-C-N 120.033 -1.667 . . . . 0.0 113.902 164.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.54 133.76 52.24 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.602 -3.293 . . . . 0.0 118.306 -172.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.59 177.6 39.09 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 127.978 2.704 . . . . 0.0 114.471 174.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 40.6 mm -70.19 -35.86 65.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 O-C-N 118.071 -3.017 . . . . 0.0 111.513 -161.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.35 -36.62 81.77 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 113.894 -2.955 . . . . 0.0 113.127 170.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 74.9 m -54.89 -54.3 44.27 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 127.898 3.249 . . . . 0.0 114.1 172.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 20.4 mm -79.62 -37.05 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 112.527 -2.124 . . . . 0.0 112.391 -170.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 18.6 m -55.4 -47.39 75.96 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 116.154 -1.879 . . . . 0.0 109.724 168.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -55.68 -53.67 53.64 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 123.13 2.695 . . . . 0.0 116.198 173.117 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -49.24 -31.68 12.65 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 116.042 1.177 . . . . 0.0 116.042 166.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 60.4 p -81.83 -36.31 28.44 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.377 -2.249 . . . . 0.0 114.026 173.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -62.49 -30.48 71.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 115.847 -2.025 . . . . 0.0 114.778 167.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 50.7 m -66.84 -32.04 73.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 122.2 2.273 . . . . 0.0 112.079 171.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 5.7 mt -73.82 -35.27 64.84 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 115.68 -2.105 . . . . 0.0 112.409 168.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -66.82 -36.19 81.79 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 121.011 1.732 . . . . 0.0 114.635 164.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.24 -28.26 67.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 118.086 -2.884 . . . . 0.0 108.4 175.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.76 145.82 97.32 Favored Pre-proline 0 N--CA 1.446 -0.647 0 CA-C-N 123.811 3.005 . . . . 0.0 111.306 -170.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -72.9 153.89 53.16 Favored 'Trans proline' 0 N--CA 1.449 -1.122 0 C-N-CA 124.397 3.398 . . . . 0.0 111.526 173.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 16.7 m -64.47 -19.07 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 O-C-N 118.434 -2.666 . . . . 0.0 116.192 -177.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -77.18 -16.07 59.25 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.356 1.462 . . . . 0.0 113.738 173.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 18.0 tp -90.85 -47.57 7.53 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 118.209 -2.807 . . . . 0.0 114.248 161.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.1 mtp85 -57.75 -48.06 80.71 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 116.2 -1.857 . . . . 0.0 114.404 -176.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -78.82 -12.07 60.01 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 127.088 2.743 . . . . 0.0 115.063 177.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -76.69 -45.0 31.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.563 1.145 . . . . 0.0 109.744 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 11.4 mt -62.08 -42.95 99.74 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 118.726 -2.484 . . . . 0.0 113.528 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -58.95 -31.53 68.8 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 115.689 -2.404 . . . . 0.0 115.257 -178.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -92.74 -27.38 17.26 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 128.521 2.728 . . . . 0.0 118.156 -171.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.39 -42.05 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 O-C-N 119.086 -2.259 . . . . 0.0 110.351 168.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 75.9 mt -77.49 -77.04 0.16 Allowed 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 123.574 0.546 . . . . 0.0 112.125 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 13.3 mt -77.35 -24.83 50.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.204 1.401 . . . . 0.0 110.77 -153.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -61.03 -22.46 64.58 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 123.641 2.928 . . . . 0.0 110.896 171.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 49.5 m -110.85 8.93 22.45 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 129.588 3.155 . . . . 0.0 115.305 -177.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 26.5 t70 . . . . . 0 C--O 1.25 1.095 0 N-CA-C 116.102 1.89 . . . . 0.0 116.102 178.413 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 19.8 ttt . . . . . 0 N--CA 1.471 0.604 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.53 159.13 25.21 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 122.451 1.12 . . . . 0.0 110.419 -173.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -152.82 155.3 36.85 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.453 2.301 . . . . 0.0 107.745 -167.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -154.32 111.42 3.38 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -164.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 81.5 p -101.02 159.03 30.64 Favored Pre-proline 0 N--CA 1.444 -0.736 0 O-C-N 118.992 -2.318 . . . . 0.0 109.042 -175.389 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -63.5 -28.93 70.75 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 CA-C-O 115.851 -1.812 . . . . 0.0 112.977 -167.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -153.67 142.63 21.19 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 127.827 3.205 . . . . 0.0 111.957 176.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 44.5 t -133.81 118.77 18.41 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 125.665 2.65 . . . . 0.0 107.092 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.79 -20.2 60.54 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.482 -2.011 . . . . 0.0 109.333 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.19 -26.91 32.94 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 121.752 2.069 . . . . 0.0 112.84 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 17.9 mtt -70.1 -31.94 69.74 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 121.104 3.742 . . . . 0.0 121.104 151.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.84 -40.25 83.68 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 126.147 1.779 . . . . 0.0 112.352 163.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -71.72 -37.7 70.59 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 116.369 -2.132 . . . . 0.0 112.898 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -63.15 -29.76 71.05 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.911 1.284 . . . . 0.0 112.033 173.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . 0.28 0.0 OUTLIER -66.15 -39.3 89.71 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 118.36 -2.713 . . . . 0.0 112.826 163.037 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -68.16 -38.49 82.16 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 115.417 -2.23 . . . . 0.0 113.375 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.255 31.5 mm-40 -67.53 -37.47 82.79 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 172.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -61.19 -40.51 94.21 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 115.734 -2.079 . . . . 0.0 113.697 169.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 19' ' ' TRP . . . . . 0.498 ' CZ2' HD13 ' D' ' 39' ' ' LEU . 24.8 t-105 -63.89 -46.09 86.41 Favored 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 129.713 4.383 . . . . 0.0 113.519 177.015 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.44 -30.98 70.92 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 113.022 -1.899 . . . . 0.0 109.795 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -67.93 -27.67 66.83 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 118.557 -2.589 . . . . 0.0 115.484 172.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -61.21 -41.91 97.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 119.887 -1.758 . . . . 0.0 114.889 156.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 83.6 t -70.59 -41.76 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 C-N-CA 128.474 2.71 . . . . 0.0 112.0 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.61 -44.83 89.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 117.84 -1.076 . . . . 0.0 113.884 169.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 34.1 tp -56.79 -48.85 76.99 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 120.376 1.444 . . . . 0.0 111.651 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 25.9 tp -63.98 -34.8 78.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.394 1.878 . . . . 0.0 111.668 176.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -60.76 -39.0 87.12 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 118.224 -2.798 . . . . 0.0 114.348 -178.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -76.85 -19.13 57.86 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 125.529 1.768 . . . . 0.0 115.272 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 -22.1 35.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.148 -2.22 . . . . 0.0 113.877 -172.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -56.83 -46.64 81.57 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 116.363 -3.96 . . . . 0.0 104.534 170.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -58.67 -35.62 72.86 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 117.041 -3.537 . . . . 0.0 112.065 -170.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -106.26 9.04 32.16 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 117.425 2.38 . . . . 0.0 117.425 174.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.41 7.7 m-20 49.47 39.41 16.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 119.094 -2.254 . . . . 0.0 113.095 177.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 33.9 mt -86.43 -0.35 55.81 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.669 2.388 . . . . 0.0 110.937 160.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -53.65 -51.04 64.39 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 121.19 1.814 . . . . 0.0 109.374 -169.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 mt -62.05 -52.88 64.33 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-O 115.856 -2.021 . . . . 0.0 114.676 174.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . 0.282 70.5 Cg_exo -43.36 -47.11 9.28 Favored 'Trans proline' 0 N--CA 1.45 -1.054 1 C-N-CA 127.458 5.438 . . . . 0.0 116.259 166.567 . . . . . . . . 3 2 . 1 . 012 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 tp -64.99 -37.4 87.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 116.987 2.217 . . . . 0.0 116.987 171.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.292 33.0 mt -77.43 -25.14 50.43 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 127.545 3.028 . . . . 0.0 110.921 177.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -59.31 -44.54 92.55 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 117.733 -1.127 . . . . 0.0 108.779 166.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 41' ' ' LEU . . . . . 0.422 HD22 HD21 ' D' ' 96' ' ' LEU . 64.1 tp -75.71 -46.35 31.59 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.989 2.515 . . . . 0.0 111.506 -169.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 84.7 mmm -88.77 -14.77 36.32 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.912 -1.117 . . . . 0.0 113.187 -163.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mp -125.48 164.9 19.46 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 122.536 1.16 . . . . 0.0 109.092 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 69.7 p -97.22 169.37 8.74 Favored Pre-proline 0 N--CA 1.448 -0.564 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 175.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -54.51 -45.8 38.27 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.685 2.257 . . . . 0.0 113.668 174.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -42.92 97.19 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.542 1.937 . . . . 0.0 111.63 177.091 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -59.52 -32.18 70.07 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.417 1.487 . . . . 0.0 114.047 179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 95.9 mtm-85 -88.02 -34.93 17.84 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 127.665 2.386 . . . . 0.0 112.733 177.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -60.33 -41.18 93.01 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 117.092 2.256 . . . . 0.0 117.092 162.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.12 -53.92 15.01 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 119.425 -2.047 . . . . 0.0 115.303 169.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 26.3 mt -75.71 -32.66 60.16 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 126.371 2.295 . . . . 0.0 115.863 -174.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.9 -33.08 86.07 Favored Glycine 0 N--CA 1.448 -0.521 0 O-C-N 120.363 -1.46 . . . . 0.0 110.153 166.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 27.4 m -80.7 -47.26 14.26 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.85 0.825 . . . . 0.0 111.743 -178.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.304 89.0 mtt180 -53.39 -24.43 12.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 167.308 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 39.8 t -68.24 -38.87 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 O-C-N 117.078 -3.514 . . . . 0.0 113.157 169.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 33.9 mtp180 -81.53 -1.7 47.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 123.772 0.829 . . . . 0.0 109.001 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 57' ' ' ILE . . . . . 0.425 HG23 HD23 ' C' ' 75' ' ' LEU . 79.9 mt -95.17 -52.05 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 O-C-N 119.678 -1.889 . . . . 0.0 108.495 170.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 37.4 t -46.64 -52.58 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 C-N-CA 128.282 2.633 . . . . 0.0 116.949 166.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -56.04 -47.46 77.81 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 122.25 1.024 . . . . 0.0 112.223 173.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -72.53 -18.62 61.63 Favored 'General case' 0 N--CA 1.452 -0.364 1 O-C-N 115.175 -4.703 . . . . 0.0 113.083 -171.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 60.3 mt -87.5 -31.76 19.79 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 118.384 -2.698 . . . . 0.0 108.313 173.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 24.3 mt -68.55 -10.81 58.14 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 118.507 -2.621 . . . . 0.0 114.358 160.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttm105 -104.32 -43.02 5.32 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 125.302 1.626 . . . . 0.0 113.084 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.11 2.16 60.89 Favored Glycine 0 C--N 1.336 0.583 0 O-C-N 119.238 -2.164 . . . . 0.0 112.497 158.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -89.26 -17.41 29.07 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 120.977 -1.308 . . . . 0.0 114.351 -166.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 10.7 mmt -56.08 125.89 23.57 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.409 1.483 . . . . 0.0 114.589 177.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . 0.285 55.4 p -78.14 166.64 22.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.932 2.02 . . . . 0.0 110.233 169.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -51.03 -29.88 13.89 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 116.555 2.057 . . . . 0.0 116.555 169.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 -65.74 -44.17 86.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 125.557 2.598 . . . . 0.0 107.788 172.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -75.56 -39.21 58.5 Favored 'General case' 0 N--CA 1.452 -0.336 1 O-C-N 116.027 -4.171 . . . . 0.0 111.572 -174.27 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 96.8 mt -56.76 -6.59 0.34 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 118.637 2.828 . . . . 0.0 118.637 166.068 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -112.1 -65.07 1.21 Allowed 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 125.551 1.782 . . . . 0.0 109.912 171.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -85.53 -9.73 56.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 112.96 -3.4 . . . . 0.0 115.892 -169.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -105.74 -45.81 4.3 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 128.71 2.804 . . . . 0.0 114.752 173.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 75' ' ' LEU . . . . . 0.425 HD23 HG23 ' C' ' 57' ' ' ILE . 5.2 mp -86.51 -12.06 49.92 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 116.865 -1.54 . . . . 0.0 111.659 177.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 58.51 -133.56 52.68 Favored Glycine 0 C--N 1.338 0.641 0 CA-C-N 120.6 1.545 . . . . 0.0 110.848 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.72 -23.78 9.99 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 126.687 2.051 . . . . 0.0 110.756 -162.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.07 -13.19 6.41 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 127.404 2.43 . . . . 0.0 117.382 167.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 19.2 tt -58.3 -39.63 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 1 O-C-N 116.181 -4.129 . . . . 0.0 115.501 175.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.91 -56.13 11.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 116.919 -1.515 . . . . 0.0 111.975 168.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . 0.337 28.3 m -55.57 -37.98 68.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 125.977 2.048 . . . . 0.0 113.889 -179.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 6.5 mm -70.58 -23.54 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-O 115.105 -2.378 . . . . 0.0 115.509 170.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 52.9 p -122.51 -17.86 6.85 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 129.71 3.204 . . . . 0.0 114.925 -164.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 74.3 mtp85 -104.05 149.44 25.18 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.883 3.673 . . . . 0.0 112.283 171.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 98.28 153.45 28.66 Favored Glycine 0 C--N 1.337 0.6 0 CA-C-N 121.216 1.826 . . . . 0.0 109.498 -176.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 4.3 m -75.66 9.92 2.02 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 128.522 2.729 . . . . 0.0 117.045 176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -118.89 -2.64 10.83 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.684 1.593 . . . . 0.0 115.072 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 80.1 p -45.75 166.84 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.01 1.324 . . . . 0.0 114.43 172.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 42.7 tp -56.37 -35.76 68.05 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.618 2.451 . . . . 0.0 117.618 -164.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -90.15 -25.2 20.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 126.785 2.034 . . . . 0.0 113.033 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.94 -12.66 59.36 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 125.581 1.801 . . . . 0.0 111.801 174.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.24 161.23 5.56 Favored Pre-proline 0 N--CA 1.45 -0.457 0 C-N-CA 128.625 2.77 . . . . 0.0 113.701 174.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -68.76 143.78 57.14 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 125.08 3.853 . . . . 0.0 112.411 177.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 81.0 t -54.47 -39.73 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 124.921 1.288 . . . . 0.0 114.439 -173.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 15.6 pm0 -63.85 -33.94 76.8 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 112.511 -3.614 . . . . 0.0 113.523 173.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 32.7 tp -71.16 -43.95 66.48 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 127.558 3.036 . . . . 0.0 116.261 172.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -63.69 -39.5 94.48 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 115.488 -2.196 . . . . 0.0 110.231 -174.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -81.69 -32.75 31.59 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 116.532 -1.699 . . . . 0.0 110.635 172.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.3 t90 -67.17 -42.93 83.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 122.598 2.454 . . . . 0.0 112.645 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 22.6 mt -66.5 -16.69 64.33 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 123.604 2.911 . . . . 0.0 114.116 172.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -78.8 -18.89 53.36 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.133 1.773 . . . . 0.0 111.507 172.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -100.18 -41.98 6.88 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 120.173 -1.579 . . . . 0.0 108.963 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 48.9 t -72.12 -62.05 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.492 1 C-N-CA 131.822 4.049 . . . . 0.0 114.54 176.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . 0.26 38.9 mt -77.65 -18.03 57.13 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 124.414 3.279 . . . . 0.0 109.796 -171.475 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 90.4 mt -117.66 50.84 1.09 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 121.039 1.745 . . . . 0.0 114.817 -169.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.257 17.3 pttp . . . . . 0 N--CA 1.451 -0.424 0 O-C-N 127.605 3.066 . . . . 0.0 112.591 -157.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 5' ' ' SER . . . . . 0.451 ' HB2' ' HD2' ' D' ' 6' ' ' PRO . 78.0 p . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 122.572 1.177 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 6' ' ' PRO . . . . . 0.451 ' HD2' ' HB2' ' D' ' 5' ' ' SER . 68.8 Cg_endo -57.86 -30.8 90.72 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 122.935 2.423 . . . . 0.0 113.12 -175.302 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -148.57 142.91 26.23 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 129.189 2.995 . . . . 0.0 106.914 164.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 26.6 t -76.46 128.26 34.44 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 125.743 2.687 . . . . 0.0 112.263 -173.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.74 -20.86 37.75 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 118.075 -2.891 . . . . 0.0 114.288 165.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -83.76 -33.09 25.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 120.737 -1.227 . . . . 0.0 112.797 172.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 16.6 mmt -66.68 -42.81 85.94 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 118.404 -2.685 . . . . 0.0 112.531 173.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.9 -39.48 62.77 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 169.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -65.15 -55.31 19.41 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.471 -2.018 . . . . 0.0 107.466 176.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -50.92 -44.56 60.19 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.918 2.087 . . . . 0.0 109.331 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -11.25 47.8 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 124.425 3.284 . . . . 0.0 110.816 173.383 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -95.91 -19.28 19.67 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.974 -2.329 . . . . 0.0 108.754 168.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -86.36 -33.24 20.6 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.318 -3.364 . . . . 0.0 114.273 176.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -67.29 -33.0 74.37 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 126.637 3.113 . . . . 0.0 111.908 173.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -62.99 -51.14 67.99 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 112.782 -2.008 . . . . 0.0 112.682 168.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.64 -16.97 62.87 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.116 -2.24 . . . . 0.0 111.717 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 49.2 ttt-85 -84.1 -6.46 59.41 Favored 'General case' 0 N--CA 1.449 -0.523 1 O-C-N 116.083 -4.135 . . . . 0.0 118.628 161.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -76.06 -41.28 51.13 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 119.28 -2.137 . . . . 0.0 113.207 149.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 99.3 t -66.42 -39.66 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 O-C-N 121.189 -0.945 . . . . 0.0 113.413 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -64.78 -39.63 93.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 124.652 2.168 . . . . 0.0 114.674 174.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 63.5 tp -67.38 -40.59 85.73 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 118.878 -2.389 . . . . 0.0 115.117 173.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 39.6 tp -74.14 -41.6 61.29 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.31 1.844 . . . . 0.0 110.293 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -51.79 -57.81 8.24 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 163.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -63.0 -31.74 72.94 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 117.465 -1.255 . . . . 0.0 110.728 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.82 -38.0 80.77 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 120.839 1.654 . . . . 0.0 114.726 167.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -72.62 -14.82 61.69 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 130.43 3.492 . . . . 0.0 109.958 170.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . 0.315 47.8 mt-30 -87.48 -14.9 39.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 118.697 -2.502 . . . . 0.0 109.554 176.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 32' ' ' ASN . . . . . 0.418 ' ND2' HD12 ' D' ' 34' ' ' LEU 0.39 47.2 p30 -128.76 5.46 5.52 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 129.166 2.986 . . . . 0.0 115.911 179.303 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 62.66 25.49 15.15 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 124.439 2.066 . . . . 0.0 112.826 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 34' ' ' LEU . . . . . 0.418 HD12 ' ND2' ' D' ' 32' ' ' ASN . 44.2 mt -88.37 -8.0 55.76 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.279 -2.763 . . . . 0.0 114.927 170.472 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -49.03 -57.56 6.35 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 127.967 2.507 . . . . 0.0 115.382 -173.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.321 3.1 mt -53.18 -52.87 61.83 Favored Pre-proline 0 N--CA 1.447 -0.582 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 177.485 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -62.63 -15.27 45.13 Favored 'Trans proline' 0 N--CA 1.446 -1.317 0 C-N-CA 122.322 2.015 . . . . 0.0 113.406 176.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 47.0 tp -77.46 -43.54 32.0 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 125.592 3.814 . . . . 0.0 111.386 164.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 39' ' ' LEU . . . . . 0.498 HD13 ' CZ2' ' C' ' 19' ' ' TRP . 25.2 mt -57.94 -45.09 87.17 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 125.413 3.733 . . . . 0.0 111.844 171.18 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -73.03 -23.32 60.58 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 119.572 -0.851 . . . . 0.0 111.831 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 19.2 tp -78.69 -27.6 45.07 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.347 -2.095 . . . . 0.0 111.059 170.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 13.2 mmt -89.24 -41.09 12.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 119.602 -1.936 . . . . 0.0 114.444 -174.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt -117.03 147.26 42.49 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 125.847 2.736 . . . . 0.0 112.798 -171.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 30.4 p -74.09 156.27 87.83 Favored Pre-proline 0 N--CA 1.45 -0.443 0 C-N-CA 128.721 2.808 . . . . 0.0 108.675 172.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -44.57 -44.01 13.94 Favored 'Trans proline' 0 N--CA 1.451 -1.024 1 C-N-CA 126.967 5.111 . . . . 0.0 122.168 173.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.265 18.9 m-20 -71.21 -22.44 62.01 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 120.376 3.473 . . . . 0.0 120.376 170.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -75.71 -36.54 59.97 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 126.143 2.152 . . . . 0.0 112.864 164.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 25.5 mtm180 -67.46 -43.7 80.44 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 126.205 2.191 . . . . 0.0 109.306 171.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -70.01 -35.84 74.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -170.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.28 -32.87 73.33 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 174.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 51' ' ' LEU . . . . . 0.426 ' HA ' HD23 ' D' ' 51' ' ' LEU . 23.9 mt -77.79 -49.12 14.98 Favored 'General case' 0 N--CA 1.45 -0.451 1 O-C-N 115.388 -4.57 . . . . 0.0 114.113 -176.695 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -51.44 -37.25 39.84 Favored Glycine 0 C--N 1.335 0.507 0 CA-C-O 122.637 1.132 . . . . 0.0 113.906 164.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 86.9 m -72.33 -42.27 65.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 118.017 -3.049 . . . . 0.0 108.582 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -55.3 -23.15 21.87 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 121.579 3.918 . . . . 0.0 121.579 170.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 24.4 t -64.48 -33.5 63.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 172.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -89.02 -20.77 23.97 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 172.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 57' ' ' ILE . . . . . 0.414 HD13 HG21 ' D' ' 57' ' ' ILE . 17.9 mt -54.19 -49.65 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 118.748 -2.47 . . . . 0.0 111.506 158.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 58' ' ' VAL . . . . . 0.536 HG22 HD12 ' D' ' 82' ' ' ILE . 65.0 t -68.24 -47.57 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 CA-C-O 117.028 -1.463 . . . . 0.0 109.63 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -51.12 -48.32 61.77 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 119.446 3.128 . . . . 0.0 119.446 170.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -65.42 -24.79 67.29 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.074 2.25 . . . . 0.0 117.074 172.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 59.3 mt -68.27 -13.44 62.26 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 121.859 2.118 . . . . 0.0 113.178 168.26 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 80.0 mt -104.6 -36.49 7.47 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 114.914 -2.47 . . . . 0.0 105.005 -177.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -81.4 -39.08 25.52 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.643 2.377 . . . . 0.0 113.083 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 53.01 41.67 59.92 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 120.168 2.827 . . . . 0.0 120.168 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -119.62 -1.91 10.55 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 117.806 -3.173 . . . . 0.0 116.231 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 8.5 mmt -129.86 39.51 3.69 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 128.702 2.801 . . . . 0.0 118.105 169.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 26.1 p -81.01 -179.95 7.58 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 110.235 -3.166 . . . . 0.0 117.532 -168.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 68' ' ' GLN . . . . . 0.518 ' O ' ' HE2' ' D' ' 72' ' ' LYS . 6.0 tp-100 63.05 -105.43 0.16 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 169.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -63.84 -43.01 97.45 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.331 1.452 . . . . 0.0 110.92 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -86.81 -16.09 37.26 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 116.876 2.176 . . . . 0.0 116.876 -171.081 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.42 -31.85 58.14 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.652 1.215 . . . . 0.0 109.664 176.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 72' ' ' LYS . . . . . 0.518 ' HE2' ' O ' ' D' ' 68' ' ' GLN 0.303 38.6 mtmt -72.09 -45.97 58.58 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 114.58 -1.191 . . . . 0.0 113.052 166.255 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -86.49 -25.81 24.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 124.299 2.0 . . . . 0.0 115.582 -163.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -122.39 -45.44 2.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 120.775 -1.203 . . . . 0.0 111.695 -171.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -69.46 -42.51 74.79 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.15 -2.844 . . . . 0.0 110.08 166.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.47 -167.22 18.86 Favored Glycine 0 C--N 1.339 0.742 0 CA-C-N 125.694 3.861 . . . . 0.0 122.273 155.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.71 -19.83 64.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.569 -1.548 . . . . 0.0 114.578 -164.12 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.45 -17.23 5.85 Favored Glycine 0 N--CA 1.446 -0.644 0 O-C-N 119.278 -2.139 . . . . 0.0 118.261 166.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 10.0 tt -52.5 -33.06 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 125.752 1.621 . . . . 0.0 108.032 -177.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -86.28 -12.48 49.39 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.736 2.414 . . . . 0.0 111.522 -173.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.3 m -79.75 -25.06 41.17 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 124.999 2.333 . . . . 0.0 114.004 165.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 82' ' ' ILE . . . . . 0.536 HD12 HG22 ' D' ' 58' ' ' VAL . 26.1 mm -100.11 -31.45 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 130.219 3.408 . . . . 0.0 115.215 -163.702 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 81.6 p -117.21 -2.73 11.58 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 126.348 2.28 . . . . 0.0 114.776 174.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.354 28.5 mtp85 -121.29 175.1 6.31 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 122.447 1.118 . . . . 0.0 112.872 167.361 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.99 160.96 27.67 Favored Glycine 0 N--CA 1.445 -0.706 0 O-C-N 118.054 -2.904 . . . . 0.0 114.165 -155.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 77.5 p -71.62 -42.01 68.17 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 118.759 -2.613 . . . . 0.0 112.968 -147.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -118.75 63.92 0.77 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.476 2.71 . . . . 0.0 106.652 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . 0.266 3.1 p -73.46 -175.46 1.97 Allowed 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 117.424 2.379 . . . . 0.0 117.424 173.574 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.27 5.5 tp -54.76 -32.95 60.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 113.187 -3.292 . . . . 0.0 111.446 162.298 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -72.44 -2.14 18.36 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.005 2.691 . . . . 0.0 114.03 174.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -124.28 -23.72 4.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 116.359 -1.781 . . . . 0.0 113.76 -171.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . 0.292 . . 63.3 94.37 0.05 OUTLIER Pre-proline 0 N--CA 1.447 -0.576 0 CA-C-N 121.671 2.032 . . . . 0.0 112.226 148.009 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.324 32.1 Cg_exo 33.81 32.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 129.216 0.923 . . . . 0.0 114.351 36.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 88.0 t -56.51 -17.74 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 C-N-CA 127.988 2.515 . . . . 0.0 110.022 176.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.285 0.1 OUTLIER -92.31 -49.36 6.2 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 117.984 -2.948 . . . . 0.0 112.899 -173.739 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' D' D ' 96' ' ' LEU . . . . . 0.422 HD21 HD22 ' C' ' 41' ' ' LEU . 54.2 tp -38.38 -53.16 1.53 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 128.138 3.399 . . . . 0.0 109.531 150.616 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 31.7 ttp180 -65.87 -50.99 62.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 122.977 1.37 . . . . 0.0 111.856 -167.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.99 -28.05 15.55 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.137 -1.392 . . . . 0.0 113.726 170.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 45.6 t90 -85.61 -43.51 13.41 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -177.34 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.52 -38.86 69.79 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 125.614 1.821 . . . . 0.0 108.974 166.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -72.67 -14.82 61.67 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.873 1.321 . . . . 0.0 112.826 -177.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -94.2 -46.05 7.25 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.983 -2.323 . . . . 0.0 111.724 169.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 97.7 t -68.0 -27.92 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 O-C-N 119.345 -2.097 . . . . 0.0 113.869 177.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 82.6 mt -108.78 -18.87 13.6 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 122.055 2.207 . . . . 0.0 114.369 -171.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 4.6 mp -105.96 23.81 13.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.094 -2.879 . . . . 0.0 108.506 168.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 16.8 pttp -61.19 169.13 2.23 Favored 'General case' 0 N--CA 1.448 -0.534 1 C-N-CA 132.419 4.288 . . . . 0.0 113.342 -172.59 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 45.5 m -49.73 -45.56 49.4 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 110.654 -2.975 . . . . 0.0 114.557 -170.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 113.362 -3.208 . . . . 0.0 116.089 177.354 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . 0.253 16.5 tpt . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -27.93 65.11 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 111.933 -3.889 . . . . 0.0 112.391 166.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -73.64 -38.75 64.91 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 126.517 2.386 . . . . 0.0 111.116 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -59.98 -42.14 93.52 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 127.163 2.79 . . . . 0.0 111.147 171.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -68.65 -34.39 75.64 Favored 'General case' 0 N--CA 1.448 -0.555 1 O-C-N 115.75 -4.344 . . . . 0.0 114.096 170.141 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.6 t60 -64.86 -32.58 74.35 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 121.993 2.179 . . . . 0.0 114.6 171.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -67.36 -35.72 79.93 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 174.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -75.28 -30.08 60.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.262 -2.149 . . . . 0.0 109.104 -175.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -76.45 -40.52 50.27 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 119.707 1.139 . . . . 0.0 111.096 172.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 20' ' ' LEU . 51.3 mt -71.96 -15.81 62.08 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.476 -1.39 . . . . 0.0 109.68 -171.639 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.2 ttt180 -54.03 -57.39 11.23 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 120.162 -1.586 . . . . 0.0 113.582 167.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.591 ' CE1' HD22 ' A' ' 26' ' ' LEU . 77.5 t80 -49.89 -35.15 22.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 120.41 1.459 . . . . 0.0 114.427 168.065 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.0 t -67.42 -51.83 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 121.225 -0.922 . . . . 0.0 112.533 -175.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -71.46 -23.72 61.88 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 125.435 2.541 . . . . 0.0 110.787 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.0 tp -75.13 -43.58 51.83 Favored 'General case' 0 N--CA 1.451 -0.41 1 O-C-N 114.244 -5.285 . . . . 0.0 108.307 173.28 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.591 HD22 ' CE1' ' A' ' 22' ' ' PHE . 20.9 tp -64.66 -31.03 72.07 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 116.639 -1.648 . . . . 0.0 110.103 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -57.01 -58.07 9.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 127.599 3.062 . . . . 0.0 109.13 173.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -60.57 -37.79 82.45 Favored 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 117.496 -3.253 . . . . 0.0 108.432 175.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.87 -41.31 83.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.716 -3.115 . . . . 0.0 113.569 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.487 ' CE1' ' HB2' ' B' ' 27' ' ' LYS . 16.9 m-85 -61.44 -35.99 79.13 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 124.708 3.413 . . . . 0.0 112.186 172.034 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.316 84.6 mt-30 -62.78 -16.65 58.93 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 119.448 -2.033 . . . . 0.0 115.139 173.276 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -124.38 18.84 8.95 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 127.627 2.371 . . . . 0.0 116.52 -176.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 41.32 33.24 0.25 Allowed 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 -165.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.1 mt -91.11 -5.8 54.6 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.577 2.751 . . . . 0.0 114.005 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -68.54 -41.42 79.86 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 113.405 -3.188 . . . . 0.0 113.923 -167.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 36' ' ' LEU 0.28 39.9 mt -61.9 -50.77 79.65 Favored Pre-proline 0 N--CA 1.448 -0.542 0 O-C-N 126.3 2.25 . . . . 0.0 112.593 165.285 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . 0.261 84.8 Cg_exo -51.25 -39.73 61.91 Favored 'Trans proline' 0 N--CA 1.451 -1.004 1 C-N-CA 127.94 5.76 . . . . 0.0 113.256 174.811 . . . . . . . . 3 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.4 tp -81.39 -36.23 29.79 Favored 'General case' 0 N--CA 1.449 -0.522 1 O-C-N 115.153 -4.717 . . . . 0.0 111.643 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.9 mt -74.5 -30.54 61.85 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 126.14 1.776 . . . . 0.0 115.517 -177.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -66.75 -30.05 70.17 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 125.972 2.045 . . . . 0.0 113.625 163.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tt -69.72 -48.15 60.59 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 127.614 2.366 . . . . 0.0 111.019 173.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 80.4 mmm -91.44 -11.42 37.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.124 -2.86 . . . . 0.0 115.243 -162.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.8 mt -130.34 136.62 49.3 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 128.04 2.536 . . . . 0.0 110.714 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.2 p -94.49 157.97 36.36 Favored Pre-proline 0 N--CA 1.448 -0.555 0 O-C-N 119.154 -2.216 . . . . 0.0 112.393 176.375 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -47.89 -39.79 32.12 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.566 2.177 . . . . 0.0 116.135 -169.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . 0.288 5.3 p-10 -72.77 -18.89 61.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 129.121 2.968 . . . . 0.0 112.528 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -97.01 -32.53 11.95 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.884 1.274 . . . . 0.0 108.356 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.2 mtm-85 -69.54 -44.37 71.1 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 119.919 -1.738 . . . . 0.0 112.763 173.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -68.82 -14.56 63.1 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 112.043 -3.837 . . . . 0.0 112.158 166.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.45 -46.99 62.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 123.553 2.888 . . . . 0.0 113.035 164.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.06 -42.2 73.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 118.834 -2.416 . . . . 0.0 110.551 -173.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.26 -42.58 82.89 Favored Glycine 0 C--N 1.333 0.405 0 O-C-N 117.113 -3.492 . . . . 0.0 114.484 167.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.5 m -68.82 -33.15 73.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 124.064 1.887 . . . . 0.0 112.861 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.21 -24.12 67.04 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 116.746 2.128 . . . . 0.0 116.746 178.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.332 5.0 t -61.99 -39.6 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-O 117.171 -1.395 . . . . 0.0 108.138 172.085 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -70.53 -31.79 69.0 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 121.257 1.844 . . . . 0.0 113.687 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 95.3 mt -64.14 -48.92 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 117.126 -1.416 . . . . 0.0 107.895 176.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.1 t -61.89 -41.56 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-O 115.776 -2.059 . . . . 0.0 112.637 170.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -58.4 -53.2 61.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 123.372 2.806 . . . . 0.0 112.023 174.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -67.15 -26.4 66.65 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.316 76.6 mt -81.93 -35.87 28.66 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.101 2.96 . . . . 0.0 112.151 173.033 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 tp -72.12 -45.75 59.33 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 114.418 -2.706 . . . . 0.0 113.292 171.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -53.24 -55.66 22.69 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 120.61 1.55 . . . . 0.0 110.375 163.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.81 -0.8 89.39 Favored Glycine 0 C--N 1.333 0.391 0 CA-C-O 116.561 -2.244 . . . . 0.0 114.503 171.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -75.39 -4.92 42.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 120.437 3.495 . . . . 0.0 120.437 -176.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 94.6 mtp -106.2 155.83 19.07 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 129.252 3.021 . . . . 0.0 113.901 167.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 60.4 p -83.63 156.67 22.58 Favored 'General case' 0 N--CA 1.447 -0.615 0 O-C-N 124.476 1.11 . . . . 0.0 112.647 164.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -42.82 -39.8 2.64 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 120.573 -1.33 . . . . 0.0 111.429 166.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.8 tpt85 -79.77 -23.49 42.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 115.656 -2.116 . . . . 0.0 110.96 -175.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -76.12 -31.93 58.91 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 121.954 2.161 . . . . 0.0 112.99 168.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.8 mt -68.14 -31.39 70.94 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 124.39 2.043 . . . . 0.0 114.863 175.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -50.94 -54.39 24.66 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 117.55 -3.219 . . . . 0.0 108.83 174.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -59.2 -38.04 78.91 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.923 1.082 . . . . 0.0 113.923 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -70.56 -32.6 70.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 119.448 -2.033 . . . . 0.0 110.307 -177.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 74.3 mt -119.44 -26.45 5.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -156.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 81.77 -28.29 3.21 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 120.469 2.948 . . . . 0.0 120.469 174.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.6 163.83 25.89 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 120.226 -1.749 . . . . 0.0 110.058 -173.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.28 140.85 34.59 Favored Glycine 0 C--N 1.339 0.702 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -177.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.346 89.1 mt -53.07 -27.38 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-O 116.104 -1.903 . . . . 0.0 111.757 -178.237 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.42 -36.15 53.7 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 120.163 1.347 . . . . 0.0 111.064 175.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 56.5 p -80.9 -23.88 38.66 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 119.614 -1.929 . . . . 0.0 110.922 -173.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 50.0 mm -78.81 -42.5 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 C-N-CA 127.529 2.332 . . . . 0.0 108.999 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.4 m -67.89 -33.95 75.71 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.837 1.255 . . . . 0.0 108.477 177.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.1 ttt180 -61.55 -46.65 89.0 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 121.796 -0.565 . . . . 0.0 110.762 172.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.28 -26.82 74.27 Favored Glycine 0 C--N 1.334 0.426 0 CA-C-O 117.065 -1.964 . . . . 0.0 113.487 175.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 58.1 m -63.54 -40.29 96.62 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.261 1.825 . . . . 0.0 110.789 174.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -68.88 -43.86 74.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 116.988 -1.482 . . . . 0.0 113.96 169.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.0 m -63.26 -25.87 68.52 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 127.21 2.204 . . . . 0.0 106.666 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.0 tp -85.44 -32.35 22.35 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 117.117 -3.489 . . . . 0.0 115.901 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -78.28 -38.0 43.61 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.875 2.07 . . . . 0.0 109.069 -173.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.56 -13.03 60.34 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 129.743 3.217 . . . . 0.0 116.132 167.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.82 126.72 92.25 Favored Pre-proline 0 N--CA 1.449 -0.48 0 C-N-CA 131.088 3.755 . . . . 0.0 107.771 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -59.93 152.48 64.12 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 O-C-N 128.209 3.742 . . . . 0.0 115.298 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -34.88 67.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 CA-C-O 116.395 -1.764 . . . . 0.0 111.086 -173.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 95' ' ' GLU . 8.6 pm0 -71.83 -18.07 62.1 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 122.174 2.261 . . . . 0.0 111.896 -178.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 13.6 tp -85.52 -36.35 20.56 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 58.2 mtm-85 -82.41 -35.06 28.0 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 117.545 -3.222 . . . . 0.0 115.934 -171.455 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -69.58 -6.06 28.59 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.095 1.758 . . . . 0.0 114.148 165.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 40.3 t90 -98.97 -48.34 4.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 117.996 2.591 . . . . 0.0 117.996 166.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.0 mt -61.59 -32.7 72.82 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 120.015 -1.678 . . . . 0.0 111.589 177.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.93 -22.63 65.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 122.608 2.458 . . . . 0.0 115.992 172.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -93.9 -7.7 42.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 118.799 -2.438 . . . . 0.0 113.381 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 54.1 t -118.95 -25.36 2.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 127.456 2.972 . . . . 0.0 113.905 -175.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 68.5 mt -103.57 -39.34 6.76 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 118.587 -2.571 . . . . 0.0 116.308 167.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.2 mt -88.57 -33.61 17.64 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 119.84 -1.787 . . . . 0.0 115.318 -175.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.3 tttt . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 117.448 -1.263 . . . . 0.0 113.73 -166.303 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.307 . . . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 16.5 mmt -74.85 -28.22 60.58 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -174.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.19 75.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 168.611 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.8 -39.52 66.62 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.787 2.835 . . . . 0.0 114.537 165.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 8.9 tp60 -57.47 -44.03 84.52 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 119.938 -1.726 . . . . 0.0 112.313 171.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 51.7 mmt-85 -74.42 -29.0 61.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 120.926 1.694 . . . . 0.0 112.336 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -75.27 -39.64 59.57 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 117.991 -2.943 . . . . 0.0 113.943 170.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -64.72 -38.81 92.27 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 129.216 3.006 . . . . 0.0 109.384 169.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -70.19 -36.67 74.78 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 119.108 -2.245 . . . . 0.0 111.591 178.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -63.65 -50.15 70.42 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 116.567 -1.683 . . . . 0.0 109.105 170.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 82.6 mt -64.66 -14.2 57.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 122.131 2.241 . . . . 0.0 113.525 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -56.41 -54.17 48.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 128.56 2.744 . . . . 0.0 108.33 171.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -65.39 -52.24 54.91 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.528 0.731 . . . . 0.0 111.692 -178.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . 0.256 4.2 t -44.19 -48.98 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 126.221 1.808 . . . . 0.0 111.642 178.134 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -73.44 -41.8 62.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 128.448 3.592 . . . . 0.0 109.282 -171.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 33.8 tp -64.53 -43.7 93.17 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.37 176.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 41.1 tp -65.02 -32.88 74.82 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 120.694 -1.254 . . . . 0.0 114.008 171.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.487 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 57.7 tttt -64.14 -41.48 97.18 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.486 -2.009 . . . . 0.0 112.43 171.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -58.35 -39.15 78.75 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 123.015 2.643 . . . . 0.0 112.811 166.251 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.8 -33.4 62.22 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.539 -1.35 . . . . 0.0 113.281 -176.015 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -54.75 -47.7 73.54 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.94 2.096 . . . . 0.0 112.732 169.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -70.77 -6.31 36.65 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.286 1.834 . . . . 0.0 114.426 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -119.86 23.64 10.97 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.556 1.942 . . . . 0.0 113.004 170.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 34.79 48.18 0.3 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 128.372 2.669 . . . . 0.0 110.277 -173.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 33.9 mt -121.63 16.61 11.16 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.445 -1.252 . . . . 0.0 113.098 174.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -71.8 -37.95 70.31 Favored 'General case' 0 N--CA 1.452 -0.357 1 O-C-N 115.444 -4.535 . . . . 0.0 111.144 -176.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 43.0 tp -62.13 -55.75 37.71 Favored Pre-proline 0 N--CA 1.449 -0.518 0 CA-C-O 114.587 -2.625 . . . . 0.0 111.454 177.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -65.23 -20.52 62.51 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 CA-C-N 122.707 2.002 . . . . 0.0 111.696 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 27.7 tp -79.1 -32.85 44.76 Favored 'General case' 0 N--CA 1.451 -0.417 1 CA-C-O 111.56 -4.067 . . . . 0.0 113.047 172.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 59.1 mt -71.08 -32.87 69.64 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 125.603 1.814 . . . . 0.0 107.756 173.104 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -80.31 -10.2 59.75 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 117.38 2.363 . . . . 0.0 117.38 176.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.3 tp -91.58 -33.42 15.14 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 118.097 -2.877 . . . . 0.0 111.31 160.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 16.2 mmt -85.0 -18.18 35.24 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 128.548 3.655 . . . . 0.0 116.226 -175.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 6.2 mp -126.97 147.77 50.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.21 1.804 . . . . 0.0 112.312 176.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 18.5 p -75.82 165.52 52.63 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-O 112.305 -3.712 . . . . 0.0 116.44 176.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -58.65 -14.57 22.07 Favored 'Trans proline' 0 N--CA 1.45 -1.042 0 O-C-N 126.371 2.774 . . . . 0.0 116.385 174.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -90.19 -46.37 8.48 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 126.195 1.798 . . . . 0.0 113.218 175.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -67.43 -26.59 66.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 117.115 -1.421 . . . . 0.0 114.448 -178.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -60.12 -42.55 94.99 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 125.656 1.848 . . . . 0.0 110.81 172.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -65.35 -27.75 68.8 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 112.141 -2.3 . . . . 0.0 116.148 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.5 -45.97 12.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 118.256 -2.778 . . . . 0.0 110.748 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.99 -34.22 77.28 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.511 -1.993 . . . . 0.0 110.176 -179.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.79 -23.78 72.59 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 118.361 2.104 . . . . 0.0 118.361 170.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 74.7 m -87.9 -25.6 23.16 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.799 2.04 . . . . 0.0 112.803 174.179 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 42.4 mtt180 -64.5 -24.99 67.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 117.711 2.485 . . . . 0.0 117.711 161.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.02 -41.97 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 120.179 1.354 . . . . 0.0 107.671 175.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 -59.61 -43.84 93.64 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 112.897 -3.43 . . . . 0.0 110.502 176.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 56.5 mt -61.57 -47.76 91.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 123.116 2.689 . . . . 0.0 107.129 -177.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.298 69.2 t -62.18 -33.31 58.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 120.156 1.344 . . . . 0.0 111.766 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -69.45 -43.23 73.7 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 118.654 -2.529 . . . . 0.0 113.176 173.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -72.4 -36.82 68.74 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 119.417 -2.052 . . . . 0.0 114.118 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 12.7 mt -52.18 -28.06 16.79 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.352 0.596 . . . . 0.0 112.568 165.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 23.4 mt -92.18 -21.94 20.1 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 117.831 -3.043 . . . . 0.0 118.381 174.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 63' ' ' ARG . . . . . 0.429 HH21 ' CG ' ' B' ' 108' ' ' ASP . 5.1 ttm105 -88.89 -43.58 11.08 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.833 2.053 . . . . 0.0 105.516 -166.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.99 49.95 31.74 Favored Glycine 0 CA--C 1.524 0.632 0 CA-C-O 117.422 -1.765 . . . . 0.0 116.294 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -116.75 -36.13 3.98 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 119.811 1.805 . . . . 0.0 108.746 -177.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 27.0 mtt -73.33 139.56 46.13 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 126.357 2.98 . . . . 0.0 111.43 -175.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -81.79 170.65 15.46 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 118.973 -2.329 . . . . 0.0 109.438 163.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -59.97 -17.43 38.1 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 117.135 -3.478 . . . . 0.0 110.446 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 48.1 ttt-85 -82.04 -48.39 11.47 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.676 2.39 . . . . 0.0 106.94 -173.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -71.24 -49.28 44.94 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 114.157 -2.83 . . . . 0.0 112.162 178.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 83.0 mt -47.66 -43.27 26.1 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 121.296 1.862 . . . . 0.0 109.279 173.374 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -61.14 -20.11 62.31 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 119.271 -2.143 . . . . 0.0 113.229 178.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -118.21 -54.22 2.31 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 124.907 3.503 . . . . 0.0 116.785 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.03 -24.56 64.61 Favored 'General case' 0 N--CA 1.446 -0.653 1 C-N-CA 132.142 4.177 . . . . 0.0 113.371 -177.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 60.0 mt -131.28 -3.96 3.86 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 113.274 -1.784 . . . . 0.0 113.258 172.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.9 21.28 67.45 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 126.558 2.028 . . . . 0.0 116.603 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.55 110.85 22.43 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 118.608 -2.701 . . . . 0.0 108.959 -163.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.19 176.53 48.7 Favored Glycine 0 CA--C 1.523 0.565 0 O-C-N 118.811 -2.431 . . . . 0.0 117.289 168.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 14.4 mm -53.51 -48.32 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.725 0 CA-C-O 117.751 -1.118 . . . . 0.0 111.869 -166.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.82 -33.98 69.18 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 122.059 2.209 . . . . 0.0 112.977 -177.628 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 54.1 m -75.93 -48.52 20.9 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.38 3.072 . . . . 0.0 111.213 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 18.9 mm -53.96 -35.94 29.65 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 O-C-N 118.366 -2.709 . . . . 0.0 108.385 167.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 5.3 m -75.64 -27.61 58.46 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 117.17 -1.395 . . . . 0.0 112.917 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -63.69 -48.89 75.31 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 122.7 2.5 . . . . 0.0 110.321 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -76.94 -32.07 50.89 Favored Glycine 0 CA--C 1.525 0.682 0 CA-C-O 118.132 -1.371 . . . . 0.0 112.701 -167.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 89.1 p -68.46 -40.58 81.01 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -61.45 -41.46 97.24 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 118.826 -2.421 . . . . 0.0 110.185 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.6 m -77.94 -24.69 48.12 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 112.391 -3.671 . . . . 0.0 110.127 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.57 -36.66 44.22 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 127.113 2.758 . . . . 0.0 116.917 170.583 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -60.71 -45.44 94.22 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 125.26 2.457 . . . . 0.0 111.46 169.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . 0.31 . . -71.2 -17.21 62.53 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 118.222 -2.799 . . . . 0.0 117.62 173.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 92' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' B' ' 93' ' ' PRO . . . -72.56 160.17 83.49 Favored Pre-proline 0 N--CA 1.45 -0.451 0 O-C-N 119.906 -1.746 . . . . 0.0 112.548 172.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 93' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' B' ' 92' ' ' ALA . 86.0 Cg_exo -67.32 155.75 69.17 Favored 'Trans proline' 0 N--CA 1.447 -1.222 1 C-N-CA 127.942 5.761 . . . . 0.0 118.436 175.165 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.277 12.9 m -65.81 -36.3 77.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 119.262 0.937 . . . . 0.0 113.452 -177.351 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.332 7.8 pm0 -59.57 -27.75 66.52 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 -177.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 24.7 tp -83.16 -46.6 12.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.569 1.548 . . . . 0.0 109.41 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 64.8 mtp85 -57.47 -27.3 62.37 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 175.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -99.32 -8.75 24.47 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 174.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -75.01 -62.59 1.5 Allowed 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 127.968 2.507 . . . . 0.0 105.78 168.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 83.2 mt -57.77 -31.74 66.81 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 131.391 3.876 . . . . 0.0 109.029 -169.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -69.62 -43.13 73.34 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 124.267 3.212 . . . . 0.0 111.326 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -71.85 -48.15 48.08 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 124.871 2.272 . . . . 0.0 108.565 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 65.2 t -60.31 -50.03 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 113.481 -1.691 . . . . 0.0 111.455 -170.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 13.5 mt -76.16 -54.56 6.63 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 127.862 3.696 . . . . 0.0 115.399 176.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 60.6 mt -76.6 -36.6 57.42 Favored 'General case' 0 N--CA 1.45 -0.44 1 O-C-N 114.431 -5.168 . . . . 0.0 116.907 -165.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -80.19 -5.88 56.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 112.518 -3.611 . . . . 0.0 108.408 177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 70.6 m -105.73 -10.25 16.85 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 128.398 2.679 . . . . 0.0 109.701 -178.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 108' ' ' ASP . . . . . 0.429 ' CG ' HH21 ' B' ' 63' ' ' ARG . 9.8 t70 . . . . . 0 C--O 1.25 1.11 0 C-N-CA 129.834 3.253 . . . . 0.0 115.346 -173.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 15.7 mtt . . . . . 0 N--CA 1.472 0.639 0 CA-C-O 123.816 1.769 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.42 147.4 30.99 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 112.587 -2.097 . . . . 0.0 114.747 -178.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -140.67 156.91 46.11 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.854 2.461 . . . . 0.0 113.204 165.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -122.21 164.8 17.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.995 1.718 . . . . 0.0 108.885 175.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 42.9 p -127.99 153.97 78.38 Favored Pre-proline 0 N--CA 1.451 -0.398 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.94 -38.21 93.07 Favored 'Trans proline' 0 N--CA 1.447 -1.261 0 O-C-N 125.69 2.416 . . . . 0.0 116.976 172.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -149.82 148.59 29.36 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 124.72 2.2 . . . . 0.0 110.605 175.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.1 t -145.46 133.79 21.78 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.286 -2.759 . . . . 0.0 114.556 170.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.64 -26.43 59.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 112.95 -3.405 . . . . 0.0 107.806 175.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.33 -34.63 78.77 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 125.853 3.933 . . . . 0.0 110.044 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 18.4 mtt -82.32 -34.48 28.55 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 125.338 1.649 . . . . 0.0 114.84 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.62 -38.82 82.36 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 125.576 1.551 . . . . 0.0 114.337 164.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -67.29 -33.13 74.65 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.619 1.568 . . . . 0.0 112.659 167.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -59.08 -40.98 86.93 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 119.206 -2.184 . . . . 0.0 111.46 167.128 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -21.52 65.1 Favored 'General case' 0 N--CA 1.449 -0.506 1 O-C-N 114.635 -5.041 . . . . 0.0 117.792 169.949 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -76.82 -46.56 24.4 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 120.888 -1.132 . . . . 0.0 113.205 177.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -53.92 -23.15 11.91 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 119.191 3.034 . . . . 0.0 119.191 159.362 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -81.75 -45.13 16.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 127.329 2.251 . . . . 0.0 106.375 171.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 23.8 t-105 -66.9 -37.11 83.75 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 118.072 -2.893 . . . . 0.0 112.406 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 20' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' C' ' 20' ' ' LEU . 1.9 mp -73.03 -27.6 61.86 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 127.11 2.756 . . . . 0.0 111.281 -176.129 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 27.1 ttt180 -75.38 -35.23 61.12 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 119.33 -2.106 . . . . 0.0 113.151 172.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -61.06 -42.38 98.38 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 169.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.368 76.0 t -54.81 -61.99 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 CA-C-O 117.097 -1.43 . . . . 0.0 108.921 167.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -53.24 -43.35 67.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 117.834 2.531 . . . . 0.0 117.834 178.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 60.9 tp -45.17 -55.07 6.11 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 127.721 2.408 . . . . 0.0 112.268 176.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 25.6 tp -67.25 -27.01 66.86 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 119.641 -1.912 . . . . 0.0 114.825 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -56.43 -50.56 71.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 119.398 -2.064 . . . . 0.0 110.302 166.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -68.65 -8.73 44.94 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 119.821 -1.799 . . . . 0.0 112.086 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.17 -20.77 17.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 -178.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -76.0 -22.89 55.34 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-O 125.796 2.712 . . . . 0.0 115.123 164.005 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . 0.305 45.7 tt0 -62.07 -16.37 51.66 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 129.598 3.159 . . . . 0.0 116.582 169.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -147.24 6.01 0.85 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.263 3.6 m-20 59.16 29.98 19.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 118.228 2.677 . . . . 0.0 118.228 -173.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 96.9 mt -82.31 7.52 13.72 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 118.679 -2.513 . . . . 0.0 114.536 162.211 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 7.0 p-80 -59.33 -44.99 92.56 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 119.121 3.008 . . . . 0.0 119.121 173.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.323 6.5 mt -60.25 -55.44 45.29 Favored Pre-proline 0 N--CA 1.452 -0.352 0 O-C-N 125.085 1.491 . . . . 0.0 110.312 175.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -54.35 -50.62 12.86 Favored 'Trans proline' 0 N--CA 1.445 -1.329 0 C-N-CA 123.488 2.792 . . . . 0.0 113.12 174.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 56.6 tp -55.4 -30.53 60.58 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 173.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.387 15.3 mt -94.92 -18.48 21.08 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 122.496 2.407 . . . . 0.0 114.187 177.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -67.24 -26.18 66.46 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.596 -1.192 . . . . 0.0 111.635 161.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 19.9 tp -77.5 -52.54 8.9 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.638 2.375 . . . . 0.0 114.708 170.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 49.2 mmm -78.72 -15.8 58.01 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 117.117 -1.421 . . . . 0.0 113.752 -164.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 7.8 mp -121.29 144.45 48.62 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 130.669 3.588 . . . . 0.0 113.523 -175.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 55.7 p -75.42 157.13 84.94 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-N 122.26 2.3 . . . . 0.0 113.356 164.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -57.88 -34.1 97.88 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 CA-C-N 121.52 1.578 . . . . 0.0 110.872 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.74 -41.18 94.84 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.868 172.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -67.83 -31.49 71.38 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.652 1.181 . . . . 0.0 112.309 176.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 48' ' ' ARG . . . . . 0.433 ' HD2' ' CE2' ' D' ' 19' ' ' TRP . 85.8 mtm-85 -69.75 -44.08 70.94 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.067 2.147 . . . . 0.0 110.888 175.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . 0.254 40.5 tt0 -68.89 -22.65 64.17 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 127.967 2.507 . . . . 0.0 114.34 168.402 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.51 -28.76 64.13 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 121.62 2.009 . . . . 0.0 110.704 173.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 57.2 mt -74.75 -46.11 39.47 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 118.424 2.75 . . . . 0.0 118.424 177.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.49 -43.8 36.26 Favored Glycine 0 CA--C 1.526 0.766 0 O-C-N 126.482 2.364 . . . . 0.0 110.532 169.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 99.6 m -59.59 -55.92 28.45 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.576 1.95 . . . . 0.0 109.958 178.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -57.69 -42.03 82.86 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 115.5 -2.19 . . . . 0.0 113.504 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 50.2 t -58.59 -36.02 57.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 CA-C-N 124.464 3.302 . . . . 0.0 114.671 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -80.82 -30.91 35.73 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 113.536 -1.666 . . . . 0.0 110.788 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 57' ' ' ILE . . . . . 0.417 HG12 ' HG ' ' C' ' 75' ' ' LEU 0.325 7.9 mt -60.16 -51.67 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 1 O-C-N 115.6 -4.438 . . . . 0.0 110.755 165.039 . . . . . . . . 4 3 . 1 . 013 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . 0.267 62.5 t -49.08 -55.81 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 C-N-CA 125.488 1.515 . . . . 0.0 113.484 174.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -49.05 -45.71 43.31 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.338 1.855 . . . . 0.0 114.672 174.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . 0.265 29.9 mm-40 -78.83 -11.01 59.98 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 123.179 1.466 . . . . 0.0 114.882 -174.677 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 46.2 mt -101.53 -4.5 26.63 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 115.21 -2.329 . . . . 0.0 108.847 168.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.53 -39.95 11.08 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 114.362 -2.732 . . . . 0.0 113.222 166.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 7.9 ttm105 -67.38 -31.62 71.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 126.139 2.15 . . . . 0.0 113.664 167.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.84 17.23 73.12 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-N 113.71 -1.587 . . . . 0.0 116.746 171.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -97.94 -2.02 41.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 121.644 2.722 . . . . 0.0 112.03 -160.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 19.1 mmt -79.38 136.7 37.05 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 124.851 1.344 . . . . 0.0 108.547 -177.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 65.7 p -90.33 174.8 7.38 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 129.274 3.029 . . . . 0.0 113.001 166.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -57.93 -40.49 80.56 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -173.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 39.0 ttp-105 -57.17 -46.25 82.97 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 126.155 1.782 . . . . 0.0 109.417 173.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -80.42 -22.29 41.34 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 119.724 -1.86 . . . . 0.0 111.279 -170.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 16.3 mt -73.25 -21.14 60.69 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.038 -2.914 . . . . 0.0 110.799 172.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -89.06 -54.64 4.02 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.894 -2.379 . . . . 0.0 112.382 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -72.55 -49.04 35.32 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 125.191 1.557 . . . . 0.0 111.835 -172.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -73.31 -38.87 65.69 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 115.909 -1.996 . . . . 0.0 115.993 177.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 75' ' ' LEU . . . . . 0.417 ' HG ' HG12 ' C' ' 57' ' ' ILE . 8.0 mp -97.0 -30.86 12.83 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 120.77 3.618 . . . . 0.0 120.77 -171.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.18 -160.37 31.38 Favored Glycine 0 C--N 1.337 0.608 0 CA-C-O 124.021 1.901 . . . . 0.0 114.844 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.84 -21.58 59.18 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 116.998 2.221 . . . . 0.0 116.998 -175.308 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.53 -12.71 9.83 Favored Glycine 0 CA--C 1.522 0.531 0 C-N-CA 128.858 3.123 . . . . 0.0 117.204 173.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 16.8 tt -54.11 -38.09 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 161.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.86 -46.35 89.58 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 113.915 -2.945 . . . . 0.0 110.858 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 40.6 m -50.68 -32.54 19.57 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 129.603 3.161 . . . . 0.0 115.669 166.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.298 52.0 mm -89.18 -10.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 119.441 -2.037 . . . . 0.0 114.073 177.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 39.8 p -136.67 5.1 2.87 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 118.285 -1.366 . . . . 0.0 114.215 -161.015 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 52.5 mtp85 -126.43 158.98 34.58 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 123.433 1.587 . . . . 0.0 110.723 169.104 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.64 163.37 31.36 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-O 117.155 -1.914 . . . . 0.0 115.118 -178.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . 0.317 20.0 m -67.55 -12.88 61.39 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 127.334 2.432 . . . . 0.0 117.048 -167.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . 0.268 63.2 m-80 -99.83 -1.81 36.59 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 112.013 -2.358 . . . . 0.0 114.153 -179.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 52.7 p -70.06 167.0 18.58 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 121.101 1.773 . . . . 0.0 110.395 -174.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 27.2 tp -56.45 -29.53 61.78 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -161.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 45.3 mttt -99.54 -4.8 30.39 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 118.786 -2.446 . . . . 0.0 116.164 170.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.33 -23.9 22.14 Favored 'General case' 0 N--CA 1.452 -0.355 1 O-C-N 115.536 -4.478 . . . . 0.0 115.38 166.426 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.45 156.61 30.06 Favored Pre-proline 0 N--CA 1.449 -0.514 0 C-N-CA 124.849 1.26 . . . . 0.0 112.938 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -63.72 147.26 92.65 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 O-C-N 116.667 -2.333 . . . . 0.0 110.584 -177.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 68.3 t -62.58 -31.08 50.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 127.751 2.421 . . . . 0.0 111.671 -172.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . 0.275 22.6 pm0 -65.24 -28.27 69.24 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.566 1.547 . . . . 0.0 114.213 175.108 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 96' ' ' LEU . . . . . 0.44 HD22 ' HB2' ' D' ' 37' ' ' PRO . 13.7 tp -82.97 -42.5 17.52 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.395 -0.812 . . . . 0.0 108.891 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 -61.1 -54.39 45.2 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 127.927 2.491 . . . . 0.0 110.566 -175.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -52.71 -53.5 46.82 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 127.787 3.18 . . . . 0.0 112.665 172.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 66.9 t90 -64.08 -39.17 93.48 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -177.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 100' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' C' ' 100' ' ' LEU . 13.3 mt -60.1 -39.28 85.59 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 116.948 -1.901 . . . . 0.0 114.642 172.571 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -64.23 -30.64 71.69 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.271 1.028 . . . . 0.0 112.711 175.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -67.86 -37.52 81.95 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 128.724 2.81 . . . . 0.0 116.751 173.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 61.6 t -86.42 -51.17 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 129.757 3.223 . . . . 0.0 113.315 -176.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 70.4 mt -77.76 -19.12 55.67 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 113.852 -2.975 . . . . 0.0 108.13 -174.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 35.1 mt -124.5 49.3 1.83 Allowed 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 122.564 2.438 . . . . 0.0 111.224 176.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 4.5 pttp . . . . . 0 N--CA 1.45 -0.454 0 CA-C-O 114.908 -2.472 . . . . 0.0 116.142 -172.914 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 55.0 p . . . . . 0 N--CA 1.447 -0.596 0 CA-C-O 118.124 -0.941 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -63.62 -20.7 69.7 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 115.089 -2.807 . . . . 0.0 111.405 169.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -161.29 137.43 8.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 172.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 18.1 t -78.72 132.91 37.15 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 126.896 2.623 . . . . 0.0 111.602 -167.218 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.02 -34.54 74.99 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 116.615 -1.659 . . . . 0.0 114.209 169.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.69 -38.99 57.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 125.277 2.465 . . . . 0.0 114.722 166.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 12.8 mmt -81.91 -22.95 36.52 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 115.635 -2.126 . . . . 0.0 114.879 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.56 -17.93 57.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 118.59 2.811 . . . . 0.0 118.59 165.202 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . 0.336 40.0 tp10 -76.97 -45.04 28.94 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 116.96 -1.495 . . . . 0.0 110.622 156.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -65.64 -31.66 72.81 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 117.687 2.477 . . . . 0.0 117.687 -173.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.95 -21.05 63.3 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 176.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -86.1 -24.09 26.41 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 165.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -81.66 -30.33 32.77 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.206 -1.559 . . . . 0.0 108.677 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -70.76 -22.41 62.4 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 117.901 -3.0 . . . . 0.0 111.881 169.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 19' ' ' TRP . . . . . 0.433 ' CE2' ' HD2' ' C' ' 48' ' ' ARG . 6.7 t-105 -87.39 -48.44 7.97 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 114.806 -2.521 . . . . 0.0 110.932 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 46.3 mt -57.13 -34.27 68.21 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 126.925 2.09 . . . . 0.0 109.504 167.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -63.11 -35.54 80.61 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 116.729 -3.732 . . . . 0.0 114.377 169.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -69.68 -36.71 76.22 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 121.255 1.843 . . . . 0.0 110.037 167.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 97.9 t -68.46 -35.86 72.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-N 122.455 2.389 . . . . 0.0 110.739 -177.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.91 -42.35 94.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 128.188 2.595 . . . . 0.0 114.158 168.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 25' ' ' LEU . . . . . 0.457 ' HA ' HD12 ' D' ' 25' ' ' LEU . 57.5 tp -65.89 -47.8 73.62 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 116.27 -1.824 . . . . 0.0 109.236 177.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 39.5 tp -64.44 -38.31 90.59 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 125.537 1.773 . . . . 0.0 114.844 177.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -49.67 -58.06 6.02 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 123.846 0.858 . . . . 0.0 111.878 166.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -74.41 -12.87 60.63 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.133 -1.413 . . . . 0.0 113.127 -176.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.396 . . -77.08 -27.41 54.24 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.691 2.478 . . . . 0.0 117.691 157.538 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -68.0 -29.99 69.14 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.362 -3.336 . . . . 0.0 113.101 171.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -73.21 -36.95 66.58 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 129.187 2.995 . . . . 0.0 116.254 -172.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 40.7 p30 -105.92 9.91 32.55 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 125.259 1.599 . . . . 0.0 113.571 171.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 64.95 30.7 11.81 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 131.391 3.876 . . . . 0.0 115.287 -176.114 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 34.9 mt -96.39 12.91 29.57 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 118.713 -2.492 . . . . 0.0 116.228 174.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -53.77 51.67 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 128.07 2.548 . . . . 0.0 110.15 178.173 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.27 1.1 mt -63.1 -50.88 73.88 Favored Pre-proline 0 N--CA 1.448 -0.534 0 O-C-N 121.246 -0.909 . . . . 0.0 111.679 -171.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 37' ' ' PRO . . . . . 0.44 ' HB2' HD22 ' C' ' 96' ' ' LEU . 35.9 Cg_exo -53.09 -27.35 36.31 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 N-CA-C 118.606 2.502 . . . . 0.0 118.606 166.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 27.2 tp -83.45 -43.2 16.09 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 120.084 1.311 . . . . 0.0 111.971 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 93.1 mt -62.35 -37.36 85.37 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 119.991 1.269 . . . . 0.0 110.425 170.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -81.9 -30.72 31.78 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 116.734 -1.603 . . . . 0.0 113.769 -174.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 13.8 tp -58.52 -58.64 7.64 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 129.389 3.076 . . . . 0.0 111.166 157.545 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.9 mmt -56.04 -35.97 67.5 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.167 2.187 . . . . 0.0 112.677 -178.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 70.0 mt -121.7 124.98 45.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 117.576 -3.202 . . . . 0.0 106.365 -161.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 44' ' ' THR . . . . . 0.436 ' HB ' ' HD2' ' D' ' 45' ' ' PRO . 81.4 p -60.42 153.49 59.56 Favored Pre-proline 0 N--CA 1.453 -0.313 0 C-N-CA 127.665 2.386 . . . . 0.0 109.927 162.388 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 45' ' ' PRO . . . . . 0.436 ' HD2' ' HB ' ' D' ' 44' ' ' THR . 61.7 Cg_endo -74.61 -27.12 11.09 Favored 'Trans proline' 0 N--CA 1.449 -1.133 0 CA-C-O 116.606 -1.498 . . . . 0.0 115.513 -158.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -15.08 63.04 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 113.988 -2.91 . . . . 0.0 114.711 165.362 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -76.99 -29.72 55.63 Favored 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 125.544 1.777 . . . . 0.0 115.294 167.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 28.9 mtm-85 -77.06 -37.97 53.58 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.833 1.653 . . . . 0.0 112.022 175.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -56.82 -41.44 77.8 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 123.728 1.728 . . . . 0.0 114.414 166.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.319 . . -64.32 -42.22 96.42 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.76 -1.838 . . . . 0.0 113.877 175.514 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 20.0 mt -72.05 -38.72 69.43 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.12 -28.58 73.79 Favored Glycine 0 C--N 1.336 0.545 0 CA-C-N 120.034 1.288 . . . . 0.0 110.724 167.208 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 91.2 m -70.5 -23.08 62.6 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 119.164 -2.374 . . . . 0.0 110.928 170.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -81.6 -23.86 36.8 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 116.622 -3.799 . . . . 0.0 110.329 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 69.5 t -58.33 -39.14 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 120.594 1.543 . . . . 0.0 113.859 164.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -84.4 -19.44 33.53 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.839 -1.788 . . . . 0.0 115.747 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 80.4 mt -66.8 -51.57 54.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 C-N-CA 127.315 2.246 . . . . 0.0 110.353 160.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . 0.278 67.9 t -55.7 -52.35 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 O-C-N 126.352 2.282 . . . . 0.0 109.099 169.452 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -56.2 -42.55 77.36 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 120.065 1.302 . . . . 0.0 112.289 -168.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -76.16 -35.33 59.23 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 119.007 2.965 . . . . 0.0 119.007 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 54.4 mt -53.66 -37.32 63.03 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 115.562 -2.161 . . . . 0.0 113.22 167.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 94.1 mt -80.74 -36.2 32.36 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 127.984 2.514 . . . . 0.0 107.358 177.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -68.53 -50.49 51.58 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 122.488 2.404 . . . . 0.0 110.261 -177.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.63 48.15 8.2 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-O 114.933 -3.148 . . . . 0.0 106.651 161.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -130.74 -54.5 1.07 Allowed 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 126.385 1.874 . . . . 0.0 107.081 179.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 15.7 mmt -80.28 49.91 1.19 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.766 2.426 . . . . 0.0 108.679 -176.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 23.6 p -82.4 -166.02 1.17 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 119.977 3.325 . . . . 0.0 119.977 -175.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 50.59 -95.47 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 126.124 1.77 . . . . 0.0 113.761 169.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -70.58 -39.14 74.03 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 117.498 -3.251 . . . . 0.0 113.025 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -79.01 -38.71 35.96 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 112.885 -1.961 . . . . 0.0 110.656 -161.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . 0.3 3.8 mt -56.65 -34.76 67.62 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.415 170.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -78.45 -29.85 47.14 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 177.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -116.65 -16.81 10.68 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 128.177 2.591 . . . . 0.0 116.207 -162.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . 0.27 15.8 tp10 -122.14 -44.93 2.26 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 130.971 3.708 . . . . 0.0 107.821 -173.099 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -82.17 -47.15 12.85 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 113.282 -3.247 . . . . 0.0 114.879 165.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 99.53 -164.14 19.93 Favored Glycine 0 CA--C 1.523 0.592 0 CA-C-N 121.144 1.793 . . . . 0.0 113.415 155.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.69 -22.49 66.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 125.808 1.534 . . . . 0.0 113.947 -159.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.94 -15.81 22.26 Favored Glycine 0 C--N 1.337 0.6 1 CA-C-O 112.483 -4.509 . . . . 0.0 112.099 171.503 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 10.0 tt -49.8 -22.11 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 1 CA-C-N 124.211 4.006 . . . . 0.0 114.926 172.38 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -102.19 -15.21 16.73 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 131.356 3.862 . . . . 0.0 112.649 -171.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 57.1 m -64.78 -32.4 74.07 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 116.264 -1.827 . . . . 0.0 113.341 153.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 28.0 mm -98.18 -23.55 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 126.817 2.047 . . . . 0.0 113.388 -173.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 44.8 p -118.17 0.56 11.79 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 118.836 -2.415 . . . . 0.0 115.118 177.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -120.22 -177.53 3.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.308 1.843 . . . . 0.0 108.083 154.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.14 166.3 35.51 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-O 117.183 -1.898 . . . . 0.0 112.127 -144.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 53.3 p -77.83 -32.31 52.13 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 118.872 2.916 . . . . 0.0 118.872 -166.302 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -131.57 101.71 5.61 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.014 -1.448 . . . . 0.0 112.485 161.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 69.1 p -101.33 -177.28 3.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 124.273 1.987 . . . . 0.0 112.433 -172.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 tp -63.34 -22.5 66.91 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.165 -1.38 . . . . 0.0 113.371 168.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 46.5 tttt -75.17 -15.48 60.57 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.453 -2.03 . . . . 0.0 111.306 170.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -110.1 -15.36 14.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 115.874 -2.013 . . . . 0.0 115.263 -170.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 38.68 92.43 0.05 OUTLIER Pre-proline 0 N--CA 1.45 -0.45 0 O-C-N 126.539 2.399 . . . . 0.0 115.886 172.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 93' ' ' PRO . . . . . 0.449 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.365 15.2 Cg_exo 24.43 38.49 0.0 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.342 0 CA-C-O 116.319 -1.617 . . . . 0.0 115.948 50.694 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 15.4 t -51.8 -33.34 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 126.137 1.775 . . . . 0.0 107.45 -176.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 95' ' ' GLU . . . . . 0.449 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.332 0.0 OUTLIER -76.38 -43.27 41.36 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -174.36 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 14.7 tp -59.51 -46.85 87.66 Favored 'General case' 0 N--CA 1.447 -0.606 1 O-C-N 129.263 4.102 . . . . 0.0 105.805 174.201 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 45.2 ttp180 -65.94 -55.1 18.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.62 0.768 . . . . 0.0 110.43 -171.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -45.22 -37.64 4.76 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 126.638 2.461 . . . . 0.0 113.564 173.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . 0.272 90.4 t90 -74.03 -52.67 11.99 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 172.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 97.0 mt -51.39 -29.65 16.39 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 118.519 -2.613 . . . . 0.0 112.579 169.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -82.73 -16.22 48.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 120.049 -1.657 . . . . 0.0 110.933 -175.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -116.38 6.07 13.61 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 117.0 -3.562 . . . . 0.0 115.875 175.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 44.1 t -109.88 -38.14 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 128.122 2.569 . . . . 0.0 108.87 170.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 31.3 mt -99.34 -20.62 16.42 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 121.965 2.166 . . . . 0.0 112.198 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 4.3 mp -116.6 44.49 2.01 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 126.928 3.251 . . . . 0.0 112.677 171.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 17.1 pttp -71.64 -179.89 2.78 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 112.136 -2.302 . . . . 0.0 113.704 -174.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 69.2 m -50.97 -31.8 18.99 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.619 -1.173 . . . . 0.0 112.636 -173.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 . . . . . 0 C--O 1.251 1.157 1 O-C-N 116.297 -4.002 . . . . 0.0 114.487 -175.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 16.9 tpt . . . . . 0 N--CA 1.453 -0.277 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.07 -37.0 85.44 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 118.426 -1.31 . . . . 0.0 113.583 174.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -62.91 -39.29 94.09 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 118.981 -2.324 . . . . 0.0 112.884 171.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -72.04 -30.43 65.17 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.134 -1.394 . . . . 0.0 112.473 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 37.4 mmt-85 -75.16 -28.08 59.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 162.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -64.95 -42.33 94.71 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 117.036 -1.459 . . . . 0.0 110.543 171.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -79.68 -18.15 52.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 125.049 1.468 . . . . 0.0 112.276 -175.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -74.28 -36.55 63.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.734 2.814 . . . . 0.0 107.334 173.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.44 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG . 11.1 t-105 -71.17 -62.08 1.53 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 124.914 2.292 . . . . 0.0 110.697 172.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.3 mt -57.05 -13.81 3.17 Favored 'General case' 0 N--CA 1.447 -0.604 1 O-C-N 115.535 -4.478 . . . . 0.0 117.422 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -52.37 -44.95 65.55 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 118.732 -2.48 . . . . 0.0 113.798 160.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -72.4 -35.66 68.45 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 118.034 -2.916 . . . . 0.0 114.221 179.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.557 HG21 HD13 ' B' ' 36' ' ' LEU . 92.8 t -62.65 -34.72 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 124.141 1.924 . . . . 0.0 110.226 176.415 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -76.5 -31.49 57.75 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.47 -2.643 . . . . 0.0 114.352 171.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 27.3 tp -68.13 -66.23 0.59 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.695 1.198 . . . . 0.0 111.588 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.0 tp -46.37 -29.45 1.69 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 117.514 2.413 . . . . 0.0 117.514 167.027 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -62.8 -49.39 75.12 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 116.329 -3.982 . . . . 0.0 110.924 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -70.94 -17.86 62.66 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 116.501 -1.714 . . . . 0.0 112.563 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . 0.301 . . -84.28 -28.68 26.99 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 114.482 1.289 . . . . 0.0 114.482 176.748 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -56.33 -49.67 73.69 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.094 1.758 . . . . 0.0 110.435 163.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -62.08 -7.16 3.61 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 118.404 2.742 . . . . 0.0 118.404 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -126.66 8.66 6.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 129.625 3.17 . . . . 0.0 112.29 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 42.41 21.64 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 118.282 2.697 . . . . 0.0 118.282 -168.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 mt -84.06 2.86 37.19 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.466 1.906 . . . . 0.0 111.898 172.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -66.35 -45.38 80.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 -178.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.1 mt -64.57 -40.47 50.1 Favored Pre-proline 0 N--CA 1.451 -0.423 0 C-N-CA 116.44 -2.104 . . . . 0.0 112.333 174.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -60.69 -39.65 61.77 Favored 'Trans proline' 0 N--CA 1.449 -1.119 1 C-N-CA 126.791 4.994 . . . . 0.0 112.584 178.4 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.9 tp -63.32 -47.66 81.31 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 125.427 2.537 . . . . 0.0 114.925 169.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 62.5 mt -70.41 -37.31 74.43 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 118.384 -2.698 . . . . 0.0 112.105 -169.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -68.34 -9.42 47.81 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 119.836 -1.79 . . . . 0.0 114.035 171.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.293 1.0 OUTLIER -86.34 -56.56 3.38 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 118.263 -2.773 . . . . 0.0 106.89 178.902 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.3 mmt -66.17 -22.77 66.37 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.367 48.5 mt -123.56 131.28 53.58 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.276 2.63 . . . . 0.0 112.946 -170.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.8 p -87.56 152.74 52.41 Favored Pre-proline 0 N--CA 1.447 -0.575 0 CA-C-O 117.229 -1.367 . . . . 0.0 111.899 177.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -49.69 -48.24 19.96 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 123.709 2.939 . . . . 0.0 118.619 -175.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -65.66 -35.77 81.74 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 116.693 -1.622 . . . . 0.0 110.365 175.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -60.69 -40.14 91.06 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 123.887 3.04 . . . . 0.0 112.71 169.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 46.0 mtm-85 -65.86 -54.36 27.66 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -50.45 -45.76 56.23 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.391 1.476 . . . . 0.0 108.377 170.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.37 -33.97 77.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 117.638 -3.164 . . . . 0.0 109.983 -178.667 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.409 HD23 ' HD2' ' A' ' 54' ' ' ARG . 12.8 mt -75.75 -27.5 58.11 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 125.262 1.602 . . . . 0.0 113.554 176.17 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -64.27 -47.14 87.79 Favored Glycine 0 CA--C 1.521 0.447 0 CA-C-O 115.436 -2.869 . . . . 0.0 108.229 172.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 m -57.79 -36.31 72.01 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 120.419 2.11 . . . . 0.0 114.321 174.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.409 ' HD2' HD23 ' A' ' 51' ' ' LEU . 82.2 mtt180 -59.54 -19.85 51.36 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 117.4 2.37 . . . . 0.0 117.4 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.9 t -64.86 -45.74 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 CA-C-O 117.25 -1.357 . . . . 0.0 113.932 167.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 46.6 ttt180 -71.35 -26.57 62.87 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 125.759 1.912 . . . . 0.0 116.142 171.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.304 34.5 mt -61.66 -53.34 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 128.047 3.342 . . . . 0.0 115.679 165.679 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.0 t -67.55 -30.76 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 O-C-N 126.558 2.411 . . . . 0.0 110.544 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -50.97 -55.16 18.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 116.397 -3.939 . . . . 0.0 115.369 172.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.447 ' HA ' ' OE1' ' A' ' 60' ' ' GLU . 22.5 mm-40 -76.05 -29.28 57.97 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.158 1.783 . . . . 0.0 106.393 -174.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -80.56 -18.61 47.86 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 113.087 -3.34 . . . . 0.0 112.077 178.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.5 tp -87.18 -35.47 18.56 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 113.131 -3.319 . . . . 0.0 109.18 167.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -66.66 -45.41 79.0 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 123.294 2.77 . . . . 0.0 109.448 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.65 20.42 44.21 Favored Glycine 0 CA--C 1.525 0.673 0 CA-C-O 125.689 2.827 . . . . 0.0 113.183 158.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -105.06 -43.46 5.04 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.919 1.688 . . . . 0.0 113.531 -170.329 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 24.6 mtp -79.49 145.32 33.3 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.796 -3.065 . . . . 0.0 109.448 178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.55 165.17 21.38 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 126.091 2.12 . . . . 0.0 113.494 170.554 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -67.68 -27.99 67.31 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 126.481 2.363 . . . . 0.0 108.662 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -78.45 -33.34 48.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.823 1.249 . . . . 0.0 113.542 173.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -67.24 -40.32 86.28 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 124.223 1.963 . . . . 0.0 109.533 172.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.4 mt -68.68 -22.38 64.38 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 118.51 -2.619 . . . . 0.0 110.822 -175.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -61.6 -46.05 91.48 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 116.816 -1.564 . . . . 0.0 114.852 167.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -60.73 -15.72 32.25 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 120.22 1.373 . . . . 0.0 113.27 172.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -91.05 -50.8 5.66 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 124.937 2.303 . . . . 0.0 113.821 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.6 mt -100.4 -20.26 15.89 Favored 'General case' 0 N--CA 1.451 -0.381 1 N-CA-C 121.895 4.035 . . . . 0.0 121.895 -172.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 61.07 -4.85 0.25 Allowed Glycine 0 CA--C 1.521 0.418 0 N-CA-C 118.608 2.203 . . . . 0.0 118.608 -164.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.71 154.08 39.95 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 125.189 2.423 . . . . 0.0 112.827 -178.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.75 136.97 50.75 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 126.45 1.976 . . . . 0.0 117.021 171.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 26.8 mt -74.91 -25.92 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 O-C-N 118.014 -3.051 . . . . 0.0 113.464 -175.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . 0.298 . . -58.3 -33.97 70.05 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 120.159 3.392 . . . . 0.0 120.159 167.025 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . 0.277 33.4 p -83.12 -26.38 31.05 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 114.582 -2.627 . . . . 0.0 113.971 174.048 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 13.7 mm -68.66 -38.01 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 162.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.2 m -64.91 -44.75 88.53 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 118.633 -2.542 . . . . 0.0 112.856 176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -60.68 -49.13 78.73 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 113.732 -1.576 . . . . 0.0 111.85 172.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -50.17 -38.55 32.9 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 117.071 1.588 . . . . 0.0 117.071 171.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.4 m -63.58 -41.79 98.34 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 128.877 2.871 . . . . 0.0 114.347 174.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 49.4 m-20 -77.67 -38.98 46.41 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.065 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 70.3 m -54.51 -33.24 59.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 126.426 1.89 . . . . 0.0 114.247 166.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 89' ' ' LEU . 37.3 tp -69.89 -49.27 53.87 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.862 1.665 . . . . 0.0 111.857 172.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -56.28 -37.82 70.37 Favored 'General case' 0 N--CA 1.446 -0.658 0 O-C-N 117.157 -3.464 . . . . 0.0 107.728 172.329 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.89 5.05 26.77 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 121.434 1.925 . . . . 0.0 114.579 -173.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.86 147.65 94.27 Favored Pre-proline 0 N--CA 1.452 -0.367 0 C-N-CA 127.959 2.504 . . . . 0.0 113.131 166.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -59.43 150.14 77.15 Favored 'Trans proline' 0 N--CA 1.446 -1.285 0 C-N-CA 125.094 3.863 . . . . 0.0 112.925 165.174 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.2 m -59.1 -36.91 65.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 O-C-N 126.116 2.135 . . . . 0.0 105.725 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -73.88 -37.89 64.57 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 123.498 2.863 . . . . 0.0 109.584 -168.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 21.8 tp -61.12 -43.82 98.3 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 117.365 -3.334 . . . . 0.0 111.479 168.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 50.7 mtm-85 -67.31 -40.01 85.98 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 121.477 1.944 . . . . 0.0 113.322 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.37 -43.12 83.3 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 126.842 2.057 . . . . 0.0 115.266 166.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -63.39 -53.56 50.59 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 116.299 -1.81 . . . . 0.0 115.831 164.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 51.4 mt -59.72 -25.05 64.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 127.44 2.296 . . . . 0.0 112.488 -177.219 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -67.73 -35.23 78.38 Favored 'General case' 0 N--CA 1.452 -0.332 1 O-C-N 116.257 -4.027 . . . . 0.0 111.895 170.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -80.11 -24.72 40.32 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 120.529 -1.357 . . . . 0.0 111.83 178.568 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.4 t -66.72 -61.04 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 O-C-N 117.314 -3.366 . . . . 0.0 114.291 164.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.2 mt -87.5 -31.66 19.84 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 117.375 2.361 . . . . 0.0 117.375 -166.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 24.4 mt -109.14 -4.64 16.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 -163.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.8 tttt . . . . . 0 N--CA 1.447 -0.622 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -164.077 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -34.72 67.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 117.182 2.29 . . . . 0.0 117.182 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.02 -45.23 91.24 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 123.41 1.576 . . . . 0.0 109.711 173.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . 0.302 48.3 tp10 -61.73 -38.09 86.65 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.501 2.72 . . . . 0.0 110.628 174.438 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -70.3 -42.36 72.1 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 122.232 2.287 . . . . 0.0 109.39 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -80.8 -2.81 48.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 115.004 -2.427 . . . . 0.0 112.266 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -82.58 -44.97 15.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 119.933 3.308 . . . . 0.0 119.933 152.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -65.14 -21.38 66.78 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 170.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -64.95 -37.04 86.33 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 117.88 2.548 . . . . 0.0 117.88 161.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 15.9 t-105 -68.44 -41.42 80.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 117.143 -1.408 . . . . 0.0 108.815 -177.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 59.7 mt -65.92 -27.79 68.45 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 127.346 2.904 . . . . 0.0 110.739 -176.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -63.31 -31.66 72.88 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 125.251 1.595 . . . . 0.0 114.677 -178.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -74.48 -49.36 22.5 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 124.814 1.321 . . . . 0.0 109.847 171.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.18 -37.41 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.774 1.63 . . . . 0.0 108.48 -173.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.45 -35.01 63.32 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 127.846 2.458 . . . . 0.0 113.601 175.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 16.8 tp -57.79 -50.09 74.42 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 116.879 -3.638 . . . . 0.0 110.597 166.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 26' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' B' ' 29' ' ' ALA . 22.4 tp -63.52 -45.45 90.54 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.844 178.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -56.73 -44.94 82.13 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.812 2.045 . . . . 0.0 113.419 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -66.55 -43.94 83.73 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 172.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' B' ' 26' ' ' LEU . . . -50.44 -49.35 55.18 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 119.214 -2.179 . . . . 0.0 114.238 173.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 30' ' ' TYR . . . . . 0.404 ' C ' ' H ' ' B' ' 32' ' ' ASN . 1.6 m-85 -64.65 -37.69 88.45 Favored 'General case' 0 N--CA 1.45 -0.457 1 CA-C-O 111.37 -4.157 . . . . 0.0 105.206 -176.166 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -57.26 -4.94 0.24 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 123.639 2.927 . . . . 0.0 116.47 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 32' ' ' ASN . . . . . 0.404 ' H ' ' C ' ' B' ' 30' ' ' TYR . 49.0 m-80 -141.48 3.18 1.69 Allowed 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 129.002 2.921 . . . . 0.0 114.61 -167.304 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 65.79 19.43 11.35 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 129.503 3.121 . . . . 0.0 118.298 170.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 26.2 mt -87.81 0.69 55.45 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 113.367 -1.742 . . . . 0.0 114.843 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -59.19 -40.92 87.24 Favored 'General case' 0 N--CA 1.45 -0.425 1 O-C-N 115.573 -4.454 . . . . 0.0 113.286 -170.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.557 HD13 HG21 ' A' ' 23' ' ' VAL . 29.4 tp -66.89 -47.61 53.46 Favored Pre-proline 0 N--CA 1.451 -0.41 0 CA-C-O 113.51 -3.138 . . . . 0.0 110.109 -178.236 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.22 -49.07 18.27 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 124.934 3.756 . . . . 0.0 116.567 167.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 21.8 tp -56.08 -40.78 74.13 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 119.201 3.037 . . . . 0.0 119.201 168.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 82.4 mt -73.61 -16.55 61.23 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 113.986 -2.912 . . . . 0.0 109.338 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . 0.344 33.6 m-20 -78.8 -40.46 32.95 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 123.025 2.648 . . . . 0.0 110.945 169.11 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 56.4 tp -65.88 -30.13 70.69 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 117.336 2.347 . . . . 0.0 117.336 169.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.2 mmt -105.82 -8.27 17.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 121.535 1.97 . . . . 0.0 109.039 -169.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 19.5 mt -134.94 135.23 41.34 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 120.501 1.5 . . . . 0.0 109.298 176.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 59.0 p -75.42 159.32 82.21 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-O 114.037 -2.887 . . . . 0.0 112.879 170.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -67.97 -20.56 44.64 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 CA-C-O 113.025 -2.99 . . . . 0.0 112.885 -172.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.78 -35.65 73.13 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 128.153 3.408 . . . . 0.0 112.372 166.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -86.8 -36.57 18.46 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 126.078 2.111 . . . . 0.0 112.28 -176.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' ARG . . . . . 0.44 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 16.3 mtm-85 -68.19 -30.21 69.25 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.069 -1.423 . . . . 0.0 114.157 170.222 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -71.38 -25.91 62.56 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 114.651 -2.595 . . . . 0.0 114.135 167.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.81 -53.02 62.41 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 124.592 2.139 . . . . 0.0 114.915 158.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.292 30.7 mt -62.12 -42.78 99.57 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 116.63 -1.653 . . . . 0.0 114.849 -175.141 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.32 -31.67 79.69 Favored Glycine 0 CA--C 1.522 0.519 0 C-N-CA 118.096 -2.002 . . . . 0.0 113.798 174.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . 0.258 25.8 m -64.01 -45.05 90.67 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.638 2.375 . . . . 0.0 111.303 170.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -73.08 -27.51 61.76 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 118.891 -2.38 . . . . 0.0 112.385 -171.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 23.8 t -56.85 -38.28 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 1 O-C-N 115.01 -4.807 . . . . 0.0 112.889 163.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -76.97 -33.06 57.66 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 120.656 1.571 . . . . 0.0 110.38 -176.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 45.0 mt -64.3 -56.08 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 128.383 2.673 . . . . 0.0 113.536 173.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.267 94.0 t -44.69 -48.16 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 119.136 3.013 . . . . 0.0 119.136 167.385 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -58.75 -54.72 43.89 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 126.99 2.681 . . . . 0.0 110.924 173.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -59.93 -33.29 71.69 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.831 -1.793 . . . . 0.0 109.437 -175.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 42.6 mt -60.89 -42.59 98.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 116.308 -1.805 . . . . 0.0 108.901 178.142 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 47.8 mt -72.64 -24.55 61.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.753 1.908 . . . . 0.0 114.995 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 31.9 ttm105 -87.08 -50.12 6.85 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.421 -1.276 . . . . 0.0 112.208 -176.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.02 37.91 36.85 Favored Glycine 0 CA--C 1.525 0.687 0 CA-C-N 121.249 1.841 . . . . 0.0 116.865 177.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -113.23 -28.94 7.44 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 118.237 -2.92 . . . . 0.0 114.14 -175.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 24.5 mtt -82.72 131.17 35.21 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 -168.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 29.6 p -62.61 166.25 5.53 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 128.338 2.655 . . . . 0.0 113.066 170.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -72.15 -25.04 61.55 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 123.921 3.055 . . . . 0.0 112.428 -177.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -63.33 -48.06 79.58 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 131.437 3.895 . . . . 0.0 109.202 169.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -67.06 -38.93 86.65 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.409 HD23 HD12 ' B' ' 75' ' ' LEU . 78.0 mt -54.68 -42.05 70.92 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 124.471 1.107 . . . . 0.0 112.133 168.284 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -71.33 -21.51 62.04 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 115.09 -2.386 . . . . 0.0 113.595 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -130.41 -39.37 1.31 Allowed 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 124.758 3.435 . . . . 0.0 110.159 -163.191 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -71.38 -49.39 42.62 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 124.874 2.273 . . . . 0.0 112.091 173.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 75' ' ' LEU . . . . . 0.409 HD12 HD23 ' B' ' 71' ' ' LEU . 16.9 mt -96.53 3.86 52.4 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 112.766 -2.016 . . . . 0.0 115.977 170.13 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 56.79 33.39 63.17 Favored Glycine 0 C--N 1.337 0.593 0 O-C-N 118.037 -2.914 . . . . 0.0 115.387 172.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.71 139.94 52.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 120.952 2.376 . . . . 0.0 115.389 -168.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.23 153.86 36.18 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 127.889 2.661 . . . . 0.0 114.006 169.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . 0.251 23.8 mm -62.85 -23.18 32.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 120.557 2.179 . . . . 0.0 112.148 -172.223 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.67 -41.89 95.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 119.728 -1.857 . . . . 0.0 112.504 167.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -69.16 -19.18 64.0 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 116.722 -3.736 . . . . 0.0 114.188 174.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 mm -81.35 -54.16 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-O 123.969 1.842 . . . . 0.0 113.591 172.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 25.7 m -55.71 -35.17 65.79 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 118.573 -2.579 . . . . 0.0 114.86 174.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -56.81 -50.65 71.74 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 118.746 -2.471 . . . . 0.0 114.409 168.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -57.25 -42.99 93.73 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 128.402 2.905 . . . . 0.0 118.927 173.164 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 4.0 p -72.39 -42.41 65.22 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 175.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -47.57 -37.59 12.64 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 158.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 13.8 m -75.32 -28.75 59.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 120.086 1.312 . . . . 0.0 112.487 -176.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 mt -84.68 -43.73 14.07 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 128.179 2.591 . . . . 0.0 106.448 -178.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 18.5 tttm -54.13 -40.8 67.7 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 121.858 2.117 . . . . 0.0 110.711 176.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.05 4.55 44.77 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 117.606 2.447 . . . . 0.0 117.606 -179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 92' ' ' ALA . . . . . 0.408 ' HB1' HD23 ' B' ' 96' ' ' LEU . . . -67.07 135.62 93.95 Favored Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 117.539 2.422 . . . . 0.0 117.539 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -51.83 128.76 27.69 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 N-CA-C 106.755 -2.056 . . . . 0.0 106.755 176.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 34.5 m -65.32 -23.21 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -163.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -62.24 -31.58 72.16 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 170.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 96' ' ' LEU . . . . . 0.408 HD23 ' HB1' ' B' ' 92' ' ' ALA . 13.7 tp -80.28 -36.54 34.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 126.588 1.955 . . . . 0.0 112.674 171.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 58.0 mtp85 -61.92 -43.96 97.76 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 177.075 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.69 -37.66 85.19 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.06 1.344 . . . . 0.0 110.415 177.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 79.1 t90 -67.15 -45.62 76.51 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 124.765 2.222 . . . . 0.0 108.906 -172.002 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 70.2 mt -67.98 -27.26 66.43 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 111.835 -3.936 . . . . 0.0 110.378 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -68.99 -37.09 78.53 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 125.191 3.632 . . . . 0.0 109.266 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -82.04 -30.2 31.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.435 2.294 . . . . 0.0 114.852 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 76.9 t -62.17 -55.3 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 O-C-N 121.327 -0.858 . . . . 0.0 108.859 167.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . 0.29 33.2 mt -82.17 -55.2 4.69 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 124.345 2.021 . . . . 0.0 111.73 -156.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 32.1 mt -79.59 -2.78 44.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 118.087 -2.883 . . . . 0.0 114.13 -163.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -123.33 4.03 9.13 Favored 'General case' 0 N--CA 1.454 -0.268 1 C-N-CA 132.765 4.426 . . . . 0.0 110.926 -177.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 16.5 m -114.43 -35.95 4.78 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 115.532 -2.175 . . . . 0.0 110.949 162.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 33.0 t70 . . . . . 0 C--O 1.25 1.091 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 169.395 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . 0.296 61.9 mtp . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.428 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.294 . . -87.78 132.58 34.11 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 126.327 1.851 . . . . 0.0 110.054 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -109.05 132.75 53.81 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 119.513 1.051 . . . . 0.0 110.899 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -103.59 149.85 24.52 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 166.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 5' ' ' SER . . . . . 0.417 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 32.7 p -125.03 150.45 66.61 Favored Pre-proline 0 N--CA 1.45 -0.446 0 O-C-N 126.682 2.489 . . . . 0.0 109.545 177.3 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 6' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' C' ' 5' ' ' SER . 63.6 Cg_exo -66.32 -9.85 25.37 Favored 'Trans proline' 0 N--CA 1.446 -1.282 0 C-N-CA 124.573 3.515 . . . . 0.0 116.388 -174.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -155.08 158.08 38.52 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 118.082 -2.886 . . . . 0.0 107.589 176.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 10.6 t -150.06 121.89 8.14 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 131.311 3.844 . . . . 0.0 112.065 157.037 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.34 -40.9 78.98 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 116.845 -3.66 . . . . 0.0 114.579 171.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.57 -41.41 73.26 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 120.78 1.627 . . . . 0.0 115.355 172.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 25.3 mtt -56.67 -40.73 76.05 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.651 1.58 . . . . 0.0 108.694 178.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.94 -37.79 79.09 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 119.305 -2.122 . . . . 0.0 112.94 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -68.95 -16.8 63.83 Favored 'General case' 0 N--CA 1.448 -0.541 1 CA-C-O 109.224 -5.179 . . . . 0.0 116.79 165.759 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -84.66 -31.1 24.35 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 125.04 3.563 . . . . 0.0 110.868 163.189 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -33.27 75.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 124.677 1.236 . . . . 0.0 113.114 170.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . 0.265 84.7 t60 -78.59 -30.83 46.9 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 126.019 2.075 . . . . 0.0 109.62 -177.833 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -69.18 -23.93 63.99 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 117.413 -1.715 . . . . 0.0 114.863 171.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -77.6 -32.82 53.82 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 124.502 1.121 . . . . 0.0 111.84 -179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -64.9 -43.04 94.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 130.899 3.68 . . . . 0.0 114.225 165.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mp -66.86 -30.04 70.1 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 116.612 -3.805 . . . . 0.0 110.279 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -74.53 -34.02 62.9 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 124.085 1.898 . . . . 0.0 110.739 -175.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 22' ' ' PHE . . . . . 0.411 ' CE2' HD22 ' D' ' 51' ' ' LEU . 5.4 t80 -59.99 -39.33 85.36 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 115.916 -1.992 . . . . 0.0 112.622 170.019 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 78.7 t -68.55 -46.23 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 C-N-CA 128.284 2.633 . . . . 0.0 110.983 174.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -64.77 -41.54 95.78 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 117.723 2.49 . . . . 0.0 117.723 176.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 45.7 tp -57.11 -40.94 78.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 127.442 3.496 . . . . 0.0 110.689 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 15.8 tp -71.65 -28.39 63.73 Favored 'General case' 0 N--CA 1.447 -0.579 1 O-C-N 115.955 -4.215 . . . . 0.0 116.579 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -63.86 -44.11 94.08 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.129 -1.891 . . . . 0.0 108.728 170.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -71.69 -31.39 66.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 126.834 2.584 . . . . 0.0 111.229 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.42 83.85 Favored 'General case' 0 N--CA 1.443 -0.785 0 O-C-N 119.15 -2.219 . . . . 0.0 115.232 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -58.17 -24.74 60.06 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 126.768 3.175 . . . . 0.0 117.167 169.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -76.51 -22.99 53.73 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 111.821 -2.445 . . . . 0.0 114.092 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 32.7 p-10 -135.55 19.38 3.33 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.237 2.215 . . . . 0.0 112.253 -174.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.263 1.6 m-20 60.92 24.34 14.37 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 117.362 -3.336 . . . . 0.0 115.619 178.042 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 18.4 mt -89.2 4.46 48.56 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.642 171.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . 0.402 32.6 p-80 -53.66 -56.74 14.6 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 117.454 2.39 . . . . 0.0 117.454 175.397 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.73 -57.15 27.55 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-O 115.862 -2.018 . . . . 0.0 105.813 175.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -52.69 -37.56 75.46 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 CA-C-N 124.323 2.58 . . . . 0.0 114.507 175.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 64.4 tp -74.65 -23.28 58.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 122.927 2.603 . . . . 0.0 112.654 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 35.4 mt -90.09 -38.21 13.71 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 119.512 1.051 . . . . 0.0 112.237 174.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -43.93 -38.4 3.4 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.712 1.205 . . . . 0.0 110.446 162.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 57.6 tp -83.43 -40.15 19.68 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 118.42 -2.675 . . . . 0.0 114.004 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 42' ' ' MET . . . . . 0.4 ' SD ' ' HB3' ' D' ' 54' ' ' ARG . 26.1 mmm -96.07 -6.28 38.98 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 119.786 -1.821 . . . . 0.0 112.143 -171.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 10.1 mp -119.24 146.8 44.92 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.044 1.738 . . . . 0.0 108.158 175.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . 0.387 41.6 p -70.2 156.83 91.2 Favored Pre-proline 0 N--CA 1.449 -0.487 0 C-N-CA 127.468 2.307 . . . . 0.0 114.518 158.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -50.25 -31.46 29.39 Favored 'Trans proline' 0 N--CA 1.45 -1.063 0 C-N-CA 124.743 3.629 . . . . 0.0 112.001 165.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.66 -30.6 65.9 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 127.248 2.219 . . . . 0.0 113.419 175.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -82.21 -36.87 26.83 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 120.447 -1.408 . . . . 0.0 108.453 -174.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 48' ' ' ARG . . . . . 0.405 ' HD2' ' CE2' ' D' ' 19' ' ' TRP . 73.1 mtm-85 -66.04 -42.33 89.72 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 115.394 -2.241 . . . . 0.0 112.903 171.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -58.04 -52.42 65.6 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 127.901 3.251 . . . . 0.0 111.271 176.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -41.88 -59.89 1.56 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 128.37 2.668 . . . . 0.0 110.791 169.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 28.7 mt -63.78 -34.42 77.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 119.213 3.042 . . . . 0.0 119.213 178.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.84 -56.47 24.95 Favored Glycine 0 C--N 1.336 0.55 0 O-C-N 126.798 2.561 . . . . 0.0 113.124 170.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . 0.315 17.6 m -45.04 -53.77 7.43 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 159.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 54' ' ' ARG . . . . . 0.419 ' HA ' HD12 ' C' ' 57' ' ' ILE . 95.2 mtt180 -59.7 -33.66 71.89 Favored 'General case' 0 N--CA 1.449 -0.498 1 O-C-N 114.756 -4.965 . . . . 0.0 117.88 172.772 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 17.1 t -57.38 -51.63 67.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 121.19 -0.944 . . . . 0.0 110.612 169.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 45.9 mtp180 -66.52 -26.72 67.29 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 113.396 -3.192 . . . . 0.0 113.593 -174.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 57' ' ' ILE . . . . . 0.419 HD12 ' HA ' ' C' ' 54' ' ' ARG 0.251 77.8 mt -70.42 -27.17 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 105.392 -2.077 . . . . 0.0 105.392 175.284 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 40.1 t -78.84 -39.7 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 122.369 2.35 . . . . 0.0 112.335 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -49.83 -47.09 51.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 119.042 -2.286 . . . . 0.0 111.366 169.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -75.79 -22.3 56.52 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 115.336 -2.269 . . . . 0.0 116.034 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 63.6 mt -86.39 -15.23 41.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 123.579 2.9 . . . . 0.0 108.255 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 16.7 mt -83.03 -41.71 18.35 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 123.256 2.753 . . . . 0.0 108.824 172.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.5 ttm105 -66.02 -25.93 67.29 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 116.687 2.106 . . . . 0.0 116.687 170.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.77 2.39 0.02 OUTLIER Glycine 0 C--N 1.336 0.548 0 C-N-CA 127.517 2.484 . . . . 0.0 118.469 -178.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -66.06 -39.42 90.08 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 121.815 2.807 . . . . 0.0 110.903 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 16.0 mmt -55.58 123.15 13.08 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 124.659 2.171 . . . . 0.0 113.157 175.219 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 92.5 p -83.91 -174.96 5.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 112.826 -1.988 . . . . 0.0 111.791 -174.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -67.5 -28.31 67.73 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 122.208 2.276 . . . . 0.0 112.112 -173.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 34.1 ttp-105 -59.48 -64.55 0.9 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 127.63 2.372 . . . . 0.0 113.872 171.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -53.69 -39.94 65.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 128.301 2.64 . . . . 0.0 112.976 176.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 77.2 mt -64.17 -12.22 38.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.375 -1.453 . . . . 0.0 114.706 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -107.08 -48.64 3.43 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.023 2.529 . . . . 0.0 112.783 171.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -88.96 10.9 19.78 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -174.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -137.85 -36.71 0.61 Allowed 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 111.929 -3.891 . . . . 0.0 110.08 166.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 7.8 mp -95.77 0.22 52.11 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 120.477 3.51 . . . . 0.0 120.477 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 44.3 -125.36 5.87 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-O 115.199 -3.0 . . . . 0.0 119.85 171.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.04 -18.85 16.07 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 120.728 2.264 . . . . 0.0 113.149 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.11 -29.3 73.98 Favored Glycine 0 CA--C 1.523 0.57 0 O-C-N 117.299 -3.375 . . . . 0.0 109.656 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tt -43.81 -34.81 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 117.733 2.494 . . . . 0.0 117.733 162.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.64 -59.22 5.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 121.126 3.75 . . . . 0.0 121.126 173.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 9.1 m -43.62 -47.13 7.51 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 115.341 -2.266 . . . . 0.0 109.849 172.162 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.259 44.5 mm -60.29 -30.42 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 122.213 2.279 . . . . 0.0 113.203 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 61.0 p -118.34 3.22 11.93 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 119.127 -2.233 . . . . 0.0 114.536 -163.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 67.8 mtp85 -116.76 136.67 52.78 Favored 'General case' 0 N--CA 1.45 -0.428 1 C-N-CA 131.856 4.062 . . . . 0.0 115.039 175.042 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 97.76 161.59 31.05 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-O 115.794 -2.67 . . . . 0.0 113.816 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 66.7 m -56.83 -12.28 1.86 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 113.465 -3.16 . . . . 0.0 117.812 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -103.84 15.01 29.7 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 122.387 2.358 . . . . 0.0 113.698 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 3.0 p -68.05 162.91 23.54 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 116.803 -1.57 . . . . 0.0 114.504 -171.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 17.3 tp -47.01 -42.64 18.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 121.979 2.172 . . . . 0.0 115.791 -172.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -91.16 -10.76 40.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 119.989 3.329 . . . . 0.0 119.989 171.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.72 -28.53 64.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 116.872 -1.537 . . . . 0.0 109.819 167.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.77 162.98 31.8 Favored Pre-proline 0 N--CA 1.453 -0.316 0 C-N-CA 129.526 3.13 . . . . 0.0 117.716 -163.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_exo -55.36 148.14 52.94 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 124.285 3.323 . . . . 0.0 111.957 172.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 18.1 t -71.13 -45.35 72.02 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 CA-C-N 110.139 -3.21 . . . . 0.0 106.991 -169.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 18.7 pm0 -65.77 -28.43 69.02 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 113.788 -3.006 . . . . 0.0 111.672 -179.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 36.6 tp -71.36 -46.27 60.85 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 125.184 2.421 . . . . 0.0 115.57 169.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -63.18 -33.73 76.12 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 112.37 -3.681 . . . . 0.0 110.022 -177.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -83.35 -31.29 26.86 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 127.618 3.074 . . . . 0.0 113.378 173.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 82.0 t90 -63.29 -54.19 40.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 170.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 78.8 mt -55.55 -29.24 58.63 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.513 1.125 . . . . 0.0 109.329 -175.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -71.52 -34.91 70.49 Favored 'General case' 0 N--CA 1.452 -0.34 1 C-N-CA 132.08 4.152 . . . . 0.0 109.825 -178.031 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -75.19 -26.26 58.88 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 111.075 -2.784 . . . . 0.0 113.117 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 54.2 t -97.42 -47.98 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-N 113.145 -1.843 . . . . 0.0 113.142 -176.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 73.4 mt -85.38 -22.7 28.29 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -169.162 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 64.5 mt -111.36 17.06 20.53 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 119.088 -2.258 . . . . 0.0 112.698 176.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 20.9 pttp . . . . . 0 N--CA 1.446 -0.673 0 CA-C-O 125.941 2.781 . . . . 0.0 116.69 176.088 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 1.7 p . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -76.09 -0.04 9.87 Favored 'Trans proline' 0 N--CA 1.444 -1.383 0 CA-C-O 117.587 -1.089 . . . . 0.0 112.615 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -162.89 120.29 1.96 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.184 2.593 . . . . 0.0 110.455 165.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 15.8 p -74.82 149.88 39.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 113.147 -3.421 . . . . 0.0 110.965 -168.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.77 -33.91 73.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 126.299 1.84 . . . . 0.0 115.347 174.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.36 -14.28 59.47 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 124.474 2.083 . . . . 0.0 112.491 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 4.8 mmt -87.15 -36.13 18.22 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 117.804 -3.06 . . . . 0.0 105.81 -175.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.98 -23.25 66.29 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 116.627 -3.796 . . . . 0.0 117.331 168.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -74.35 -40.75 61.95 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 126.927 2.642 . . . . 0.0 116.035 156.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -62.72 -36.92 84.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 119.815 1.189 . . . . 0.0 109.465 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -36.25 77.17 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 115.158 -2.353 . . . . 0.0 113.735 175.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -69.88 -24.87 63.47 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 122.564 2.438 . . . . 0.0 117.412 172.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -82.09 -39.53 23.23 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.342 1.057 . . . . 0.0 108.544 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -62.92 -29.32 70.7 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 169.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 19' ' ' TRP . . . . . 0.405 ' CE2' ' HD2' ' C' ' 48' ' ' ARG . 38.4 t-105 -70.69 -35.84 72.98 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 117.49 -3.256 . . . . 0.0 112.859 166.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 64.4 mt -80.19 -18.36 49.86 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 119.059 -2.276 . . . . 0.0 115.442 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 42.3 ttt180 -69.05 -29.11 67.18 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 126.535 1.934 . . . . 0.0 112.857 162.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -75.09 -48.4 24.03 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 114.409 -2.71 . . . . 0.0 112.347 166.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 46.7 t -56.67 -38.78 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 124.524 3.329 . . . . 0.0 112.272 174.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -73.05 -48.27 37.54 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 125.528 1.768 . . . . 0.0 113.081 173.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 39.0 tp -52.93 -48.61 67.18 Favored 'General case' 0 N--CA 1.448 -0.563 1 O-C-N 115.173 -4.704 . . . . 0.0 109.307 173.663 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.25 -46.7 87.67 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 120.364 1.438 . . . . 0.0 110.507 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -51.61 -46.83 63.74 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 116.123 1.898 . . . . 0.0 116.123 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -66.73 -27.85 67.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 119.109 -2.244 . . . . 0.0 108.578 174.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.307 . . -69.66 -23.91 63.53 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.049 2.94 . . . . 0.0 114.785 173.219 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -76.43 -28.26 56.54 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 120.449 -1.407 . . . . 0.0 111.031 165.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -75.44 -24.28 57.03 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 119.895 -1.753 . . . . 0.0 113.085 -175.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 55.1 p30 -116.33 9.93 14.61 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 121.134 3.753 . . . . 0.0 121.134 164.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 55.59 32.54 19.39 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 116.693 -1.622 . . . . 0.0 115.278 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 60.8 mt -80.78 -1.51 43.21 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 120.411 1.46 . . . . 0.0 112.578 164.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . 0.331 0.0 OUTLIER -38.8 -75.6 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 119.418 3.118 . . . . 0.0 119.418 -179.279 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.292 50.8 mt -46.44 -45.33 44.37 Favored Pre-proline 0 N--CA 1.446 -0.631 0 CA-C-O 113.528 -3.13 . . . . 0.0 115.298 174.222 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -55.0 -37.23 93.86 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 124.538 3.492 . . . . 0.0 114.063 168.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 41.3 tp -75.09 -46.94 31.28 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 176.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 61.8 mt -57.85 -31.23 66.47 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.757 2.023 . . . . 0.0 112.804 171.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -79.0 -40.61 31.05 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 117.0 -3.563 . . . . 0.0 112.31 176.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 54.9 tp -51.01 -55.92 15.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 118.954 -2.341 . . . . 0.0 111.68 164.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 22.2 mmt -83.5 -25.03 31.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 115.943 -1.98 . . . . 0.0 115.401 -172.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 31.9 mt -116.96 141.3 48.42 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 122.173 2.26 . . . . 0.0 113.2 -176.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 44' ' ' THR . . . . . 0.437 ' HB ' ' HD2' ' D' ' 45' ' ' PRO . 46.4 p -70.58 156.03 92.54 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 127.923 2.489 . . . . 0.0 109.347 170.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 45' ' ' PRO . . . . . 0.437 ' HD2' ' HB ' ' D' ' 44' ' ' THR . 17.7 Cg_endo -65.28 -36.69 34.75 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 O-C-N 117.93 -1.668 . . . . 0.0 113.868 -168.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.255 0.1 OUTLIER -69.65 -10.82 59.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.834 -2.416 . . . . 0.0 115.477 173.894 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -78.91 -40.3 32.57 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.508 1.523 . . . . 0.0 108.982 166.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 41.0 mtm-85 -71.14 -36.44 72.09 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 119.164 -2.21 . . . . 0.0 116.829 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.19 -36.19 82.82 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 119.667 -1.896 . . . . 0.0 112.493 167.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.1 -30.38 43.8 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 117.72 -3.113 . . . . 0.0 111.421 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 51' ' ' LEU . . . . . 0.411 HD22 ' CE2' ' C' ' 22' ' ' PHE . 56.4 mt -68.84 -52.7 27.13 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 118.625 -2.547 . . . . 0.0 113.844 167.364 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -48.45 -36.36 17.17 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-O 115.614 -2.77 . . . . 0.0 115.162 164.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 25.6 m -76.13 -26.55 56.46 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 121.087 2.444 . . . . 0.0 113.516 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 54' ' ' ARG . . . . . 0.4 ' HB3' ' SD ' ' C' ' 42' ' ' MET . 72.9 mtt180 -66.22 -34.36 77.84 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 116.928 -1.51 . . . . 0.0 109.354 171.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . 0.255 42.8 t -44.71 -49.09 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-O 126.471 3.034 . . . . 0.0 115.562 171.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -86.42 -21.98 26.81 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 112.017 -2.356 . . . . 0.0 116.507 -176.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.13 -39.05 84.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 122.35 1.071 . . . . 0.0 112.932 166.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 85.0 t -60.69 -54.44 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 C-N-CA 127.928 2.491 . . . . 0.0 112.415 165.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -67.06 -35.63 80.28 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -178.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -79.24 -18.19 53.32 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 121.922 2.147 . . . . 0.0 112.484 176.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 17.0 mt -63.43 -58.8 5.9 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 117.686 -1.149 . . . . 0.0 109.09 162.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 11.1 mt -63.55 -42.48 98.38 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.242 -2.132 . . . . 0.0 105.242 -171.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -62.46 -41.6 98.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 177.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 59.16 44.53 96.33 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 118.064 1.985 . . . . 0.0 118.064 175.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -132.16 -22.52 2.26 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 121.732 2.766 . . . . 0.0 115.966 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 25.1 mmt -92.49 56.57 2.76 Favored 'General case' 0 N--CA 1.448 -0.566 1 O-C-N 129.433 4.208 . . . . 0.0 108.019 168.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 64.4 p -93.22 176.16 6.5 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 125.603 1.814 . . . . 0.0 112.777 -148.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 51.69 -82.76 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 114.653 -2.594 . . . . 0.0 112.027 168.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -88.43 -24.57 22.99 Favored 'General case' 0 N--CA 1.451 -0.39 1 CA-C-N 126.803 4.365 . . . . 0.0 113.346 -174.051 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -83.79 -44.06 14.77 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 53.0 mt -45.52 -43.01 11.48 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 120.534 3.531 . . . . 0.0 120.534 163.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 30.3 mtmm -79.73 -38.84 32.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 116.564 2.061 . . . . 0.0 116.564 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -112.22 -17.62 12.73 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -162.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -107.21 -50.02 3.16 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.106 1.762 . . . . 0.0 114.398 168.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.56 -27.49 51.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.551 1.541 . . . . 0.0 112.355 170.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 76' ' ' GLY . . . . . 0.412 ' O ' HG22 ' D' ' 79' ' ' ILE . . . 84.92 -157.33 32.16 Favored Glycine 0 CA--C 1.522 0.505 1 O-C-N 113.496 -5.752 . . . . 0.0 118.206 136.372 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.67 -23.42 11.32 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.432 1.893 . . . . 0.0 114.11 -169.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.56 14.13 25.47 Favored Glycine 0 C--N 1.334 0.47 1 O-C-N 115.227 -4.671 . . . . 0.0 114.682 177.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 79' ' ' ILE . . . . . 0.412 HG22 ' O ' ' D' ' 76' ' ' GLY . 14.9 tt -93.59 -15.19 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.826 0 C-N-CA 117.9 -1.52 . . . . 0.0 108.598 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.15 -18.6 42.25 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 130.303 3.441 . . . . 0.0 108.802 176.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 95.7 m -84.62 -34.03 23.19 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 121.749 -0.594 . . . . 0.0 110.256 175.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 18.6 mm -87.07 -35.65 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 C-N-CA 127.421 2.288 . . . . 0.0 111.764 -178.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 11.5 p -118.39 4.46 11.82 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 116.879 -1.534 . . . . 0.0 114.386 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 33.1 mtp85 -119.66 -169.68 1.81 Allowed 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 120.453 1.479 . . . . 0.0 112.246 151.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.17 171.04 40.17 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.936 -159.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 90.4 p -71.43 -35.2 70.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 120.155 3.391 . . . . 0.0 120.155 -164.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -130.35 72.36 1.49 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 126.209 2.909 . . . . 0.0 104.678 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 6.5 p -88.26 -177.96 5.8 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 129.66 3.184 . . . . 0.0 111.579 173.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.07 -15.5 61.5 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 117.528 -3.232 . . . . 0.0 113.629 167.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -70.63 -25.81 63.19 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 161.025 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -78.96 -34.68 44.14 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -176.101 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 56.85 72.64 0.92 Allowed Pre-proline 0 N--CA 1.447 -0.612 0 O-C-N 126.582 2.426 . . . . 0.0 115.48 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 93' ' ' PRO . . . . . 0.595 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.326 0.1 OUTLIER 24.07 33.51 0.0 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.283 0 N-CA-C 116.502 1.693 . . . . 0.0 116.502 45.509 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 63.1 t -59.14 -31.17 45.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 173.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 95' ' ' GLU . . . . . 0.595 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.327 0.0 OUTLIER -67.91 -35.18 78.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.528 -2.607 . . . . 0.0 115.166 176.384 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 30.6 tp -66.89 -53.08 35.79 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 126.754 2.533 . . . . 0.0 107.043 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 23.8 ttp180 -52.28 -38.52 58.54 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 120.967 3.692 . . . . 0.0 120.967 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.18 -24.95 54.75 Favored 'General case' 0 N--CA 1.444 -0.729 0 O-C-N 126.23 2.206 . . . . 0.0 109.979 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 54.8 t90 -87.72 -41.12 13.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 127.693 3.12 . . . . 0.0 110.508 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 29.6 mt -60.61 -32.05 71.2 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 114.934 -2.46 . . . . 0.0 109.655 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -58.89 -44.79 91.26 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 123.013 2.642 . . . . 0.0 114.868 177.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -91.8 -5.35 53.61 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 129.186 2.994 . . . . 0.0 113.743 -173.251 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 98.8 t -95.44 -41.7 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 O-C-N 118.658 -2.526 . . . . 0.0 112.611 164.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 16.9 mt -97.17 -27.71 14.43 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 121.055 0.455 . . . . 0.0 111.538 -172.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.352 3.3 mp -108.38 54.98 0.65 Allowed 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 121.22 -0.925 . . . . 0.0 112.149 167.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -78.12 176.75 8.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 126.983 3.277 . . . . 0.0 112.789 -173.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 59.7 m -61.72 -27.16 68.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 117.424 2.379 . . . . 0.0 117.424 -172.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 130.831 3.652 . . . . 0.0 110.576 176.454 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 N--CA 1.447 -0.6 0 CA-C-O 115.95 -1.976 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.59 -25.6 68.04 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 120.329 1.422 . . . . 0.0 112.433 170.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -75.63 -38.9 58.53 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 117.682 -3.136 . . . . 0.0 109.817 175.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -66.0 -45.43 81.6 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.639 -0.696 . . . . 0.0 109.296 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -63.11 -22.2 66.7 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 128.729 2.811 . . . . 0.0 116.481 169.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -80.71 -48.91 11.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 125.543 1.777 . . . . 0.0 112.046 173.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -65.05 -20.82 66.67 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 125.526 1.53 . . . . 0.0 112.82 172.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -72.13 -48.95 39.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 170.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.42 ' CH2' HD13 ' B' ' 39' ' ' LEU . 0.2 OUTLIER -62.01 -37.16 83.8 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.56 2.744 . . . . 0.0 115.535 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . 0.299 51.9 mt -63.73 -13.77 46.45 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.812 1.645 . . . . 0.0 115.247 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -75.31 -26.65 58.84 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 118.343 -2.723 . . . . 0.0 117.633 173.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -68.25 -26.8 65.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 124.655 1.182 . . . . 0.0 111.446 163.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.7 t -80.6 -23.71 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 122.061 2.21 . . . . 0.0 114.287 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -77.57 -41.3 39.34 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 128.744 2.817 . . . . 0.0 114.892 161.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.0 tp -67.17 -40.97 86.69 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 124.937 1.398 . . . . 0.0 113.02 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.9 tp -70.23 -31.54 69.0 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 119.447 -2.033 . . . . 0.0 113.613 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -71.12 -38.09 72.31 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 127.361 2.913 . . . . 0.0 110.801 178.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -64.68 -37.87 89.06 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 174.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.87 -36.5 82.46 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 120.038 1.29 . . . . 0.0 113.42 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -54.28 -35.26 62.39 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 118.074 2.62 . . . . 0.0 118.074 166.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -74.02 -25.66 60.0 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.208 -2.182 . . . . 0.0 115.539 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -98.81 0.06 43.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 128.541 2.736 . . . . 0.0 113.172 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 39.42 35.69 0.18 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 118.242 2.682 . . . . 0.0 118.242 -155.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.1 mt -89.02 2.41 54.06 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -71.38 -43.8 66.17 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 117.705 -3.122 . . . . 0.0 115.946 -161.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.44 -42.56 5.27 Favored Pre-proline 0 N--CA 1.452 -0.356 0 CA-C-N 121.626 2.012 . . . . 0.0 107.193 -177.39 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -42.4 -55.61 2.49 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 124.991 3.794 . . . . 0.0 111.895 162.823 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 52.7 tp -64.88 -33.17 75.37 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 177.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.3 mt -77.86 -30.63 51.0 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 122.136 2.244 . . . . 0.0 110.781 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -65.41 -29.67 70.39 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 122.297 2.317 . . . . 0.0 112.92 165.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.4 tp -67.09 -49.4 65.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 117.451 -3.281 . . . . 0.0 109.689 171.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 32.6 mmt -76.52 -36.11 57.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 126.421 1.889 . . . . 0.0 115.578 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 48.2 mt -111.39 132.91 54.08 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 122.149 2.25 . . . . 0.0 115.153 -175.036 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.9 p -61.79 166.41 6.09 Favored Pre-proline 0 N--CA 1.448 -0.527 0 CA-C-O 114.393 -2.717 . . . . 0.0 117.573 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -64.86 -23.4 62.31 Favored 'Trans proline' 0 N--CA 1.452 -0.943 0 N-CA-C 119.684 2.917 . . . . 0.0 119.684 -177.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -94.48 -24.2 17.39 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 124.465 1.103 . . . . 0.0 111.533 -174.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -75.31 -22.29 57.79 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 118.416 -1.314 . . . . 0.0 111.124 168.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.3 mtm-85 -72.94 -48.94 32.46 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 114.948 -2.454 . . . . 0.0 109.443 172.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -66.69 -32.05 73.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 127.306 2.879 . . . . 0.0 112.618 175.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.96 -48.77 75.18 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.193 2.269 . . . . 0.0 110.517 167.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.5 mt -65.16 -45.05 86.51 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 116.598 -3.814 . . . . 0.0 113.792 -175.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.16 -36.61 83.05 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 118.779 2.272 . . . . 0.0 118.779 171.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.3 m -67.27 -34.65 77.85 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 119.788 -2.007 . . . . 0.0 114.102 173.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -69.19 -16.92 63.73 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 115.937 1.829 . . . . 0.0 115.937 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 52.3 t -72.34 -38.49 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 126.273 1.829 . . . . 0.0 109.457 167.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 33.5 ttt180 -61.79 -42.62 99.23 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 121.927 2.149 . . . . 0.0 112.045 167.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.1 mt -53.84 -50.97 48.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.355 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 3.3 t -76.25 -25.21 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -172.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -70.97 -52.5 19.41 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 116.293 -1.813 . . . . 0.0 106.355 171.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -69.61 -23.48 63.52 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 123.525 2.875 . . . . 0.0 115.282 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.311 80.6 mt -69.48 -49.23 56.75 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 128.553 2.741 . . . . 0.0 116.136 171.022 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 40.7 tp -65.81 -40.2 91.62 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 128.219 2.607 . . . . 0.0 111.407 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -74.97 -48.31 24.91 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.974 2.11 . . . . 0.0 111.302 172.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.6 16.17 75.8 Favored Glycine 0 C--O 1.224 -0.47 0 C-N-CA 124.829 1.204 . . . . 0.0 113.517 167.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -70.83 -44.88 65.6 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.235 -3.509 . . . . 0.0 113.174 173.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 50.9 mtp -79.78 124.45 28.62 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 131.612 3.965 . . . . 0.0 111.212 168.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.5 p -97.21 177.34 5.6 Favored 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 127.215 2.822 . . . . 0.0 112.804 -174.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -54.0 -44.68 71.1 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 118.981 -2.324 . . . . 0.0 114.863 -178.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 50.2 tpt85 -71.43 -29.02 64.39 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 125.747 1.905 . . . . 0.0 107.281 -175.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -73.23 -44.05 60.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 117.199 -1.381 . . . . 0.0 108.967 178.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 36.2 mt -70.13 -10.8 59.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 116.005 -1.95 . . . . 0.0 114.219 -175.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -75.33 -42.16 55.01 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 113.479 -3.153 . . . . 0.0 109.182 171.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -55.05 -31.71 61.34 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 128.436 3.585 . . . . 0.0 117.219 171.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -91.04 -41.33 11.14 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 118.443 -2.66 . . . . 0.0 114.724 -166.393 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 44.5 mt -109.51 -9.5 14.91 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -176.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 83.38 -29.38 3.59 Favored Glycine 0 C--N 1.339 0.709 0 CA-C-O 115.139 -3.034 . . . . 0.0 116.237 170.326 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -85.77 -159.18 0.44 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 117.984 2.587 . . . . 0.0 117.984 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.49 154.74 40.67 Favored Glycine 0 C--N 1.337 0.599 0 CA-C-O 116.809 -2.106 . . . . 0.0 111.348 -166.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.3 mt -59.62 -30.04 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-O 116.221 -1.847 . . . . 0.0 111.034 170.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.91 -18.57 65.33 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.628 2.467 . . . . 0.0 115.544 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 44.0 p -60.35 -29.59 69.0 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 118.137 -0.935 . . . . 0.0 111.895 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.9 mm -83.69 -53.67 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 C-N-CA 127.789 2.436 . . . . 0.0 105.153 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.2 m -54.4 -56.27 20.29 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.606 1.962 . . . . 0.0 112.786 -174.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -58.79 -36.34 74.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.77 -37.18 75.73 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 114.05 -1.432 . . . . 0.0 114.533 177.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 5.4 m -63.44 -51.27 66.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 113.447 -1.377 . . . . 0.0 111.122 173.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -62.42 -43.38 98.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 127.028 2.131 . . . . 0.0 111.576 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.9 m -65.65 -26.75 67.94 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 114.635 -2.602 . . . . 0.0 116.916 169.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.452 ' O ' ' HB3' ' A' ' 92' ' ' ALA . 19.7 tp -76.38 -34.15 58.88 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 127.418 2.949 . . . . 0.0 110.433 177.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -61.08 -31.75 71.41 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 118.032 2.604 . . . . 0.0 118.032 161.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -86.66 -4.76 59.22 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 124.284 1.992 . . . . 0.0 113.359 170.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 89' ' ' LEU . . . -58.46 150.53 54.87 Favored Pre-proline 0 N--CA 1.445 -0.684 0 O-C-N 117.934 -2.979 . . . . 0.0 115.636 167.459 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -65.8 158.04 55.82 Favored 'Trans proline' 0 N--CA 1.448 -1.176 1 C-N-CA 125.895 4.397 . . . . 0.0 108.787 162.571 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.5 m -77.35 -38.54 26.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 O-C-N 122.204 -0.31 . . . . 0.0 111.752 -166.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -59.68 -24.3 63.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 119.561 -1.962 . . . . 0.0 112.33 177.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 16.4 tp -67.02 -55.87 12.55 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 119.903 1.228 . . . . 0.0 113.138 172.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 46.2 mtm-85 -57.1 -45.8 83.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 115.708 1.744 . . . . 0.0 115.708 169.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -63.09 -28.53 70.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.164 -2.835 . . . . 0.0 111.852 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 29.7 t90 -73.49 -44.67 57.32 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 169.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 104' ' ' LEU . 70.7 mt -59.72 -27.89 66.86 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 115.449 -2.215 . . . . 0.0 109.751 174.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -74.3 -24.16 59.2 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 123.599 2.909 . . . . 0.0 115.024 175.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -86.28 -30.0 22.64 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.697 0.799 . . . . 0.0 112.666 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.4 t -84.37 -34.99 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 O-C-N 118.951 -2.343 . . . . 0.0 110.627 173.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 100' ' ' LEU . 27.3 mt -94.02 -45.3 7.65 Favored 'General case' 0 N--CA 1.45 -0.454 1 O-C-N 114.857 -4.902 . . . . 0.0 112.287 -167.07 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 56.8 mt -111.5 0.69 16.58 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 120.799 3.629 . . . . 0.0 120.799 -169.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.254 67.9 tttt . . . . . 0 N--CA 1.45 -0.469 0 O-C-N 116.473 -3.892 . . . . 0.0 113.748 -165.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.47 0 CA-C-O 123.326 1.536 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 13.1 mmt -63.01 -40.16 96.93 Favored 'General case' 0 N--CA 1.449 -0.496 1 O-C-N 115.948 -4.22 . . . . 0.0 112.885 176.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.01 -44.83 79.34 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.873 3.269 . . . . 0.0 111.545 -178.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -62.97 -30.93 71.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 120.791 1.632 . . . . 0.0 114.313 168.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -69.94 -36.56 75.39 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 114.555 -2.64 . . . . 0.0 111.314 172.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -72.71 -27.17 61.9 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 115.433 -2.222 . . . . 0.0 113.016 176.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -71.95 -36.6 69.92 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 124.822 3.465 . . . . 0.0 113.505 168.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -67.01 -37.14 83.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 117.103 -1.427 . . . . 0.0 110.302 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -72.84 -24.62 60.91 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 114.308 -2.758 . . . . 0.0 107.741 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 7.1 t-105 -69.5 -51.39 36.27 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 124.512 3.324 . . . . 0.0 108.965 169.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.65 -16.53 49.47 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 126.52 1.928 . . . . 0.0 115.441 177.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -64.03 -48.23 77.13 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.093 1.757 . . . . 0.0 110.733 173.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -56.54 -40.41 75.05 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.213 1.405 . . . . 0.0 113.185 173.331 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 14.0 t -80.61 -33.93 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 O-C-N 118.968 -2.332 . . . . 0.0 114.659 -178.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -66.78 -39.22 87.75 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.113 0.965 . . . . 0.0 113.067 169.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 25.4 tp -50.62 -63.38 1.14 Allowed 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 118.979 -2.326 . . . . 0.0 107.427 161.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.252 41.8 tp -59.72 -45.83 90.97 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 121.421 1.919 . . . . 0.0 115.244 -172.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -51.93 -43.17 63.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 116.828 2.159 . . . . 0.0 116.828 170.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -67.42 -37.5 83.14 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 116.677 2.103 . . . . 0.0 116.677 170.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.28 -38.37 52.39 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.498 1.919 . . . . 0.0 111.87 173.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -64.31 -48.14 76.76 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 128.176 2.591 . . . . 0.0 113.264 175.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -44.26 -31.86 1.13 Allowed 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 117.631 -3.168 . . . . 0.0 114.523 171.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -108.57 -3.84 17.68 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 129.46 3.104 . . . . 0.0 115.167 -175.086 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.33 4.9 m-20 60.28 10.68 2.48 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 -176.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -69.22 1.19 3.92 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 167.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -64.4 -44.7 90.46 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 115.868 -2.015 . . . . 0.0 114.97 -171.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 65.5 tp -72.58 -36.79 3.91 Favored Pre-proline 0 N--CA 1.447 -0.609 0 CA-C-N 121.631 2.014 . . . . 0.0 112.315 -173.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 0.8 OUTLIER -58.2 -29.35 87.24 Favored 'Trans proline' 0 N--CA 1.445 -1.349 0 N-CA-C 121.537 3.63 . . . . 0.0 121.537 161.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 27.2 tp -72.75 -35.29 67.47 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 172.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 39' ' ' LEU . . . . . 0.42 HD13 ' CH2' ' A' ' 19' ' ' TRP 0.253 60.8 mt -73.61 -22.81 59.91 Favored 'General case' 0 N--CA 1.445 -0.677 1 O-C-N 115.717 -4.364 . . . . 0.0 114.456 176.502 . . . . . . . . 4 3 . 1 . 015 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -70.04 -33.41 71.93 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.836 0.854 . . . . 0.0 108.952 171.554 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 48.8 tp -84.26 -46.63 11.63 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.077 1.751 . . . . 0.0 106.343 -178.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 15.7 mmt -86.12 -17.41 35.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 123.861 0.726 . . . . 0.0 112.296 -161.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mp -126.34 138.4 53.57 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 120.867 -1.146 . . . . 0.0 112.521 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 46.8 p -78.64 161.52 69.05 Favored Pre-proline 0 N--CA 1.446 -0.626 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -46.68 -45.39 20.04 Favored 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 123.012 2.475 . . . . 0.0 114.261 175.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.48 -36.08 68.7 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 126.626 3.108 . . . . 0.0 117.338 177.145 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -90.56 -25.17 20.34 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 112.062 -2.336 . . . . 0.0 113.22 -178.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 62.8 mtm-85 -61.09 -35.11 76.11 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 119.421 3.119 . . . . 0.0 119.421 155.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -73.05 -35.65 66.75 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 126.332 2.27 . . . . 0.0 111.826 174.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.35 -53.73 53.85 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 115.442 -2.218 . . . . 0.0 110.358 167.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.282 33.1 mt -63.93 -52.34 60.24 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 121.595 1.998 . . . . 0.0 112.609 178.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.97 -27.12 12.68 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 118.456 2.142 . . . . 0.0 118.456 173.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 32.0 m -80.87 -50.63 9.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 116.132 -1.89 . . . . 0.0 112.806 163.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -53.18 -32.48 48.09 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 122.774 2.534 . . . . 0.0 110.104 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.4 -41.05 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 O-C-N 117.253 -3.404 . . . . 0.0 107.78 176.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -80.92 -26.34 36.83 Favored 'General case' 0 N--CA 1.449 -0.497 1 O-C-N 114.898 -4.876 . . . . 0.0 112.265 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 68.7 mt -65.58 -45.18 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 O-C-N 118.918 -2.364 . . . . 0.0 108.436 173.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 65.6 t -69.66 -36.92 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 O-C-N 117.943 -2.973 . . . . 0.0 108.92 -179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -61.92 -47.34 85.38 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 124.357 2.027 . . . . 0.0 113.834 169.147 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -74.92 -22.02 58.86 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 116.359 -3.963 . . . . 0.0 111.94 -177.061 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 79.8 mt -70.3 -14.83 62.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.764 0.826 . . . . 0.0 111.601 167.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 84.2 mt -106.77 -13.81 15.16 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.421 1.088 . . . . 0.0 113.511 177.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 20.4 ttm105 -87.41 -47.57 8.67 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.162 -2.836 . . . . 0.0 111.962 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 65.37 69.9 1.23 Allowed Glycine 0 C--N 1.334 0.465 1 O-C-N 130.018 4.574 . . . . 0.0 115.201 -175.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -139.39 -30.69 0.71 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 119.745 1.773 . . . . 0.0 113.511 176.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 33.2 mtt -81.62 134.67 35.51 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.132 2.271 . . . . 0.0 117.132 -172.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 83.0 p -81.88 168.6 17.76 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 128.574 3.671 . . . . 0.0 112.218 179.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.404 ' HA ' HD12 ' B' ' 71' ' ' LEU . 67.1 mt-30 -64.22 -17.25 63.38 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 121.291 1.859 . . . . 0.0 114.658 -175.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -74.03 -51.11 16.87 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 168.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -75.11 -22.56 58.14 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 116.619 -2.032 . . . . 0.0 115.981 -175.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' B' ' 68' ' ' GLN . 78.5 mt -57.66 -45.48 85.47 Favored 'General case' 0 N--CA 1.451 -0.417 1 CA-C-O 131.311 5.339 . . . . 0.0 111.79 170.101 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -66.33 -28.32 68.58 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 117.958 -2.964 . . . . 0.0 113.021 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -87.29 -75.56 0.4 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 121.614 2.007 . . . . 0.0 116.241 167.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -56.58 -33.56 66.3 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 120.563 3.542 . . . . 0.0 120.563 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 29.5 mt -101.11 -8.75 21.98 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 120.014 1.279 . . . . 0.0 109.726 169.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.54 7.49 40.75 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-O 118.285 -1.286 . . . . 0.0 112.421 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.36 156.89 21.73 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 -174.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.17 158.2 52.17 Favored Glycine 0 C--N 1.334 0.434 0 CA-C-N 110.737 -2.938 . . . . 0.0 113.922 167.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 37.3 mm -71.16 -31.85 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 C-N-CA 124.331 1.052 . . . . 0.0 111.634 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.76 -43.81 90.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 120.368 -1.458 . . . . 0.0 114.169 165.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 3.5 m -54.19 -36.9 63.92 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 113.319 -3.229 . . . . 0.0 111.56 169.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 19.2 mm -73.0 -40.66 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 O-C-N 126.361 2.288 . . . . 0.0 105.265 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 32.2 m -74.85 -33.87 62.19 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 115.586 1.698 . . . . 0.0 115.586 -167.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -49.43 -44.1 45.15 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 114.634 -2.603 . . . . 0.0 112.478 155.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.4 -55.34 15.78 Favored Glycine 0 C--N 1.335 0.479 0 C-N-CA 126.387 1.946 . . . . 0.0 111.789 177.05 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 2.4 p -50.52 -37.37 38.78 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 123.574 3.687 . . . . 0.0 114.189 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -71.31 -35.69 71.36 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 119.741 -1.85 . . . . 0.0 115.57 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 44.3 m -67.3 -27.96 67.6 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 166.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.91 -42.67 66.44 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.156 1.535 . . . . 0.0 109.977 178.368 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -67.53 -38.91 84.91 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 172.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.14 -4.51 39.15 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 115.423 -2.227 . . . . 0.0 113.229 177.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.41 157.8 55.46 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 120.626 1.557 . . . . 0.0 111.331 -169.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -54.91 132.94 55.05 Favored 'Trans proline' 0 N--CA 1.45 -1.082 1 C-N-CA 125.841 4.361 . . . . 0.0 110.461 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.309 16.6 m -59.8 -26.39 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 116.158 1.91 . . . . 0.0 116.158 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.309 17.5 pm0 -49.57 -52.67 28.53 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 126.681 1.993 . . . . 0.0 114.53 165.666 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 17.4 tp -63.32 -42.82 99.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 124.894 2.283 . . . . 0.0 108.344 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 60.5 mtp85 -63.62 -47.4 81.53 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.855 -1.778 . . . . 0.0 113.858 -175.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -61.37 -37.92 85.14 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 115.584 -2.151 . . . . 0.0 115.009 170.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 16.7 t90 -70.68 -38.13 73.71 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 119.97 1.259 . . . . 0.0 108.519 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 26.1 mt -68.58 -37.49 79.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 119.826 1.194 . . . . 0.0 111.86 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -65.56 -38.71 90.34 Favored 'General case' 0 N--CA 1.445 -0.678 1 O-C-N 115.443 -4.535 . . . . 0.0 114.841 173.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -62.18 -55.21 30.87 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 118.893 -2.379 . . . . 0.0 112.181 164.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.23 -34.5 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 C-N-CA 123.139 0.575 . . . . 0.0 110.015 -164.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 87.9 mt -90.38 -49.72 6.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 118.688 2.847 . . . . 0.0 118.688 -176.04 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 19.1 mt -82.59 -34.31 27.71 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.488 1.613 . . . . 0.0 112.921 -166.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -67.3 -16.69 64.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.971 164.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 48.9 m -103.05 6.12 38.51 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.935 -2.978 . . . . 0.0 118.944 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.312 33.6 t70 . . . . . 0 C--O 1.25 1.084 0 N-CA-C 120.112 3.375 . . . . 0.0 120.112 -169.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 1' ' ' MET . . . . . . . . . . . . 0.257 6.1 mtt . . . . . 0 N--CA 1.469 0.516 0 CA-C-O 123.926 1.822 . . . . 0.0 106.951 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.94 179.25 7.82 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 125.745 1.618 . . . . 0.0 112.629 179.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -151.28 119.25 6.22 Favored 'General case' 0 N--CA 1.448 -0.529 1 O-C-N 116.115 -4.116 . . . . 0.0 107.519 -171.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -108.3 149.47 28.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.443 -2.036 . . . . 0.0 107.685 171.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 25.0 p -129.94 148.16 68.45 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 103.476 -2.787 . . . . 0.0 103.476 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -53.6 -38.93 84.42 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.071 2.514 . . . . 0.0 118.12 -171.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -145.98 166.27 26.53 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 117.568 -3.208 . . . . 0.0 107.021 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 3.1 t -154.55 132.15 11.35 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 105.143 -2.169 . . . . 0.0 105.143 170.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.35 -41.33 89.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.44 1.496 . . . . 0.0 112.676 168.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.25 86.84 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 119.028 -2.295 . . . . 0.0 111.384 177.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 37.4 mtt -60.61 -35.6 76.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 120.046 -1.659 . . . . 0.0 113.086 171.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.76 -25.2 63.7 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.116 1.366 . . . . 0.0 113.659 168.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -71.02 -26.57 63.17 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 122.679 1.228 . . . . 0.0 109.036 171.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -77.29 -38.61 50.33 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.247 -2.783 . . . . 0.0 108.665 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -37.1 86.32 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 124.193 1.949 . . . . 0.0 112.039 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -62.76 -41.63 99.31 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 112.813 -1.994 . . . . 0.0 105.985 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 -69.95 -24.32 63.33 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 117.828 -3.045 . . . . 0.0 112.346 178.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -62.93 -48.41 79.04 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 126.088 2.851 . . . . 0.0 114.206 169.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 54.9 t-105 -55.58 -42.44 74.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 116.453 -3.904 . . . . 0.0 118.058 160.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 3.8 mp -63.08 -15.16 55.7 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 122.019 2.19 . . . . 0.0 115.975 167.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 43.6 ttt-85 -87.43 -32.55 19.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 122.539 1.162 . . . . 0.0 111.363 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -54.48 -42.65 70.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.449 -3.282 . . . . 0.0 113.112 157.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 17.1 t -78.79 -26.93 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 126.462 1.905 . . . . 0.0 107.115 -171.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -83.02 -29.38 28.94 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.418 0.687 . . . . 0.0 112.627 172.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 33.2 tp -68.26 -47.3 68.09 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 121.078 -1.014 . . . . 0.0 111.03 172.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 67.2 tp -68.36 -32.11 71.96 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -176.137 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -55.46 -53.37 57.19 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.825 -2.422 . . . . 0.0 109.381 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -68.3 -22.58 64.71 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 125.976 2.048 . . . . 0.0 116.051 174.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.89 -27.34 65.7 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 116.869 -3.645 . . . . 0.0 113.454 -177.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -61.23 -30.95 70.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 117.795 2.517 . . . . 0.0 117.795 167.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -71.91 -22.24 61.51 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 118.345 2.72 . . . . 0.0 118.345 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 51.0 p-10 -114.8 24.19 11.99 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 120.264 -1.522 . . . . 0.0 112.342 161.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.331 18.3 m-20 57.21 24.42 9.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.914 2.486 . . . . 0.0 114.767 173.515 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 mt -85.96 -12.44 50.43 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 173.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -40.39 -56.3 2.05 Favored 'General case' 0 N--CA 1.448 -0.529 1 O-C-N 115.621 -4.425 . . . . 0.0 114.035 174.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 81.0 mt -68.53 -48.13 33.94 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-O 116.802 -1.57 . . . . 0.0 111.925 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . 0.31 30.3 Cg_endo -55.69 -25.32 50.25 Favored 'Trans proline' 0 N--CA 1.449 -1.098 1 C-N-CA 127.279 5.32 . . . . 0.0 115.216 168.666 . . . . . . . . 3 2 . 1 . 015 nuclear build core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -73.92 -48.15 32.78 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 123.178 2.717 . . . . 0.0 107.109 172.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 84.8 mt -63.99 -25.34 68.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 125.752 1.907 . . . . 0.0 114.723 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -68.19 -27.79 66.71 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 119.352 0.978 . . . . 0.0 112.809 165.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 14.2 tp -78.59 -55.18 5.39 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 126.634 3.112 . . . . 0.0 110.969 172.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 55.3 mmm -67.76 -18.25 64.81 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 121.679 3.955 . . . . 0.0 121.679 -168.116 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . 0.269 8.5 mp -131.5 165.37 23.72 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 117.971 -2.956 . . . . 0.0 106.156 -178.214 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 29.3 p -91.51 154.54 44.29 Favored Pre-proline 0 N--CA 1.449 -0.509 0 C-N-CA 124.935 1.294 . . . . 0.0 112.226 165.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_exo -49.71 -31.26 24.94 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 N-CA-C 115.596 1.345 . . . . 0.0 115.596 167.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.65 -24.92 60.06 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 176.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -76.68 -36.33 57.34 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 120.416 -1.427 . . . . 0.0 113.929 168.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . 0.252 90.3 mtm-85 -57.82 -37.69 74.25 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 115.193 -2.337 . . . . 0.0 109.856 176.106 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -70.41 -53.34 16.88 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 128.954 3.909 . . . . 0.0 109.319 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . 0.343 . . -44.88 -49.87 10.7 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 116.301 -3.999 . . . . 0.0 117.715 165.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 33.6 mt -63.81 -44.14 94.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 117.102 -1.427 . . . . 0.0 112.817 177.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.45 -26.59 69.65 Favored Glycine 0 CA--C 1.523 0.54 0 O-C-N 126.409 2.318 . . . . 0.0 111.309 -177.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 6.0 m -80.65 -32.95 36.01 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.41 -2.818 . . . . 0.0 114.241 173.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.25 91.1 mtt180 -71.71 -19.77 62.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 115.801 -2.047 . . . . 0.0 113.092 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 55' ' ' VAL . . . . . 0.424 ' HA ' ' HE1' ' D' ' 42' ' ' MET . 23.7 t -69.14 -40.79 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 C-N-CA 128.045 2.538 . . . . 0.0 109.977 162.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -68.75 -37.0 79.09 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 112.158 -3.782 . . . . 0.0 110.507 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 57' ' ' ILE . . . . . 0.492 HG23 HD23 ' C' ' 75' ' ' LEU . 37.7 mt -60.39 -43.11 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 O-C-N 126.576 2.422 . . . . 0.0 109.25 175.05 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 47.4 t -67.48 -42.36 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 120.917 1.69 . . . . 0.0 111.297 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -51.0 -49.31 60.64 Favored 'General case' 0 N--CA 1.449 -0.514 1 C-N-CA 131.707 4.003 . . . . 0.0 114.479 166.623 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -64.56 -38.23 90.28 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 118.193 -2.817 . . . . 0.0 114.479 173.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 20.1 mt -78.23 -30.53 48.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 122.406 2.366 . . . . 0.0 109.642 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 35.1 mt -80.4 -22.21 41.5 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.56 -3.212 . . . . 0.0 114.443 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -66.76 -37.16 84.08 Favored 'General case' 0 N--CA 1.449 -0.494 1 C-N-CA 134.502 5.121 . . . . 0.0 110.218 169.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.25 19.75 64.42 Favored Glycine 0 CA--C 1.521 0.431 0 CA-C-O 116.629 -2.206 . . . . 0.0 114.423 177.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -96.83 -30.76 12.98 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -171.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 18.8 mmt -55.3 142.75 30.68 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 118.003 2.594 . . . . 0.0 118.003 166.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 30.7 p -95.18 170.17 9.58 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 129.543 3.137 . . . . 0.0 109.005 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.57 -35.21 75.52 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 116.19 -1.862 . . . . 0.0 113.014 -172.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 32.8 ttp180 -67.47 -41.73 84.15 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 120.935 1.698 . . . . 0.0 115.456 172.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.11 -35.53 64.15 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 -175.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 24.2 mt -57.99 -21.1 42.98 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.311 3.044 . . . . 0.0 110.341 169.232 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -106.34 -29.64 9.64 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 123.87 3.032 . . . . 0.0 112.688 175.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -97.78 -37.33 9.9 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 115.539 1.681 . . . . 0.0 115.539 -174.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -90.04 -43.47 10.49 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 119.438 -2.039 . . . . 0.0 109.939 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 75' ' ' LEU . . . . . 0.492 HD23 HG23 ' C' ' 57' ' ' ILE . 10.9 mp -86.04 9.03 18.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-O 124.275 1.988 . . . . 0.0 114.922 173.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 58.97 -142.13 46.62 Favored Glycine 0 C--N 1.337 0.597 1 C-N-CA 130.834 4.064 . . . . 0.0 112.238 161.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.36 -26.8 23.18 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 119.469 -2.195 . . . . 0.0 113.413 164.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.13 2.81 3.68 Favored Glycine 0 CA--C 1.525 0.713 1 CA-C-O 112.586 -4.452 . . . . 0.0 116.41 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tt -66.67 -40.38 86.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 120.748 2.274 . . . . 0.0 115.259 165.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.49 -23.78 52.01 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.474 2.31 . . . . 0.0 115.775 171.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 1.7 m -71.75 -28.32 63.58 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 119.885 -1.76 . . . . 0.0 112.704 169.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 9.2 mm -92.65 -22.91 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 1 O-C-N 115.525 -4.485 . . . . 0.0 117.127 -171.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 73.0 p -123.32 -1.23 8.68 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 118.177 2.658 . . . . 0.0 118.177 -164.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 69.1 mtp85 -125.8 158.93 33.74 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 129.021 2.929 . . . . 0.0 111.575 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 76.96 164.08 19.64 Favored Glycine 0 C--O 1.224 -0.497 0 O-C-N 121.168 -0.957 . . . . 0.0 112.807 -177.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 66.7 m -67.96 -7.98 33.25 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 112.205 -3.76 . . . . 0.0 117.016 -163.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -117.82 18.62 14.01 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 131.078 3.751 . . . . 0.0 112.697 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 17.0 p -68.38 178.19 2.07 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 89' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' C' ' 89' ' ' LEU . 20.4 tp -59.86 -38.59 82.56 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 118.468 -1.293 . . . . 0.0 112.338 -173.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.346 94.1 mttt -101.75 6.41 41.74 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 127.537 2.335 . . . . 0.0 117.027 -176.212 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -120.61 -9.07 9.44 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 125.189 1.396 . . . . 0.0 112.135 167.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.19 160.21 18.13 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-O 125.743 2.687 . . . . 0.0 112.276 164.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -58.57 125.68 19.06 Favored 'Trans proline' 0 N--CA 1.447 -1.217 1 C-N-CA 126.221 4.614 . . . . 0.0 110.5 -177.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 50.7 t -37.64 -41.08 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 125.851 1.66 . . . . 0.0 110.711 178.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.9 pm0 -74.88 -18.3 60.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 116.285 -1.817 . . . . 0.0 110.83 -174.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -81.43 -38.42 26.48 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 122.596 2.453 . . . . 0.0 110.694 165.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 68.0 mtp180 -59.37 -52.42 65.72 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 118.605 -2.559 . . . . 0.0 110.096 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -47.6 -54.23 12.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 126.241 2.213 . . . . 0.0 114.521 166.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -66.12 -42.1 89.66 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.316 -1.311 . . . . 0.0 114.046 -173.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 61.0 mt -61.49 -48.53 80.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.449 1.9 . . . . 0.0 108.984 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -45.67 -41.42 10.37 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 116.721 -3.737 . . . . 0.0 118.823 164.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -73.95 -32.62 63.57 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.607 1.163 . . . . 0.0 109.529 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 38.9 t -88.38 -46.42 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 -175.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 51.0 mt -82.84 -18.55 40.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 117.63 -3.169 . . . . 0.0 113.028 -158.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 35.0 mt -118.33 3.31 11.92 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 120.573 1.533 . . . . 0.0 114.797 -173.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.352 21.6 pttp . . . . . 0 N--CA 1.449 -0.479 0 C-N-CA 129.771 3.228 . . . . 0.0 111.53 -170.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 98.1 p . . . . . 0 N--CA 1.448 -0.539 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -92.24 -23.35 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.927 0 N-CA-C 116.717 1.776 . . . . 0.0 116.717 175.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -151.12 129.56 12.11 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.63 3.172 . . . . 0.0 106.377 -169.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.83 137.64 42.0 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 112.444 -2.162 . . . . 0.0 110.854 176.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.24 -30.98 69.77 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 120.255 -1.528 . . . . 0.0 111.377 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.56 -14.89 59.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 114.897 -2.478 . . . . 0.0 111.695 175.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 7.2 mmt -70.25 -27.37 64.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 121.782 2.083 . . . . 0.0 113.73 169.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.45 -41.66 72.54 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 120.622 -1.299 . . . . 0.0 112.291 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 21.4 tp10 -63.4 -36.22 83.0 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 113.591 -3.1 . . . . 0.0 107.014 170.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -73.92 -34.84 64.51 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 121.533 1.969 . . . . 0.0 107.797 -174.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 15' ' ' ARG . . . . . 0.408 ' HE ' ' HA ' ' D' ' 15' ' ' ARG 0.298 0.0 OUTLIER -65.63 -29.37 69.94 Favored 'General case' 0 N--CA 1.447 -0.62 1 O-C-N 114.432 -5.168 . . . . 0.0 113.728 -176.997 . . . . . . . . 5 4 . 1 . 015 nuclear build core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -77.63 -29.72 51.89 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 167.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -73.87 -28.4 61.55 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 123.003 1.382 . . . . 0.0 111.04 -178.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -89.56 -18.1 27.25 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 120.325 -1.484 . . . . 0.0 107.652 -176.173 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 -76.06 -47.35 24.99 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 116.914 -1.517 . . . . 0.0 111.251 162.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.48 -35.38 80.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.196 2.295 . . . . 0.0 117.196 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -63.94 -26.31 68.53 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 118.143 -1.423 . . . . 0.0 113.982 170.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -62.85 -53.46 53.79 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 113.844 -2.979 . . . . 0.0 111.142 166.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.62 -35.09 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 121.179 1.809 . . . . 0.0 110.716 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.33 -41.3 81.0 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 170.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 13.4 tp -63.73 -48.66 76.13 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 26' ' ' LEU . . . . . 0.472 HD13 HD21 ' D' ' 39' ' ' LEU . 53.7 tp -51.67 -48.12 63.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 115.36 -2.257 . . . . 0.0 116.402 173.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 19.5 ttpp -59.32 -52.32 66.17 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 125.397 1.685 . . . . 0.0 110.078 174.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -61.62 -33.83 74.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.713 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.75 -38.75 89.97 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 123.674 2.943 . . . . 0.0 114.975 171.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -61.65 -29.89 70.36 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 123.769 1.747 . . . . 0.0 115.535 172.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -81.28 -25.18 36.75 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -177.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . 0.329 54.3 p30 -102.74 3.74 37.24 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 120.56 -1.338 . . . . 0.0 114.011 164.188 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.254 1.7 m-20 63.72 26.5 14.51 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 128.744 2.818 . . . . 0.0 113.337 177.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 43.9 mt -93.71 16.86 12.94 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 165.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -52.22 -58.42 6.67 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 126.972 2.109 . . . . 0.0 110.152 174.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.415 22.6 mt -41.87 -63.86 0.78 Allowed Pre-proline 0 N--CA 1.448 -0.549 0 C-N-CA 128.05 2.54 . . . . 0.0 110.964 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -58.87 -36.65 96.6 Favored 'Trans proline' 0 N--CA 1.451 -0.992 0 CA-C-O 114.81 -2.246 . . . . 0.0 115.916 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 33.1 tp -56.0 -54.41 45.16 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 125.226 3.648 . . . . 0.0 112.292 171.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 39' ' ' LEU . . . . . 0.472 HD21 HD13 ' D' ' 26' ' ' LEU . 88.6 mt -62.55 -31.63 72.45 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 115.846 -2.026 . . . . 0.0 110.652 176.166 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -74.71 -28.35 60.76 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 117.236 -1.786 . . . . 0.0 114.474 170.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -74.07 -51.9 14.31 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 118.44 -2.662 . . . . 0.0 108.615 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 42' ' ' MET . . . . . 0.424 ' HE1' ' HA ' ' C' ' 55' ' ' VAL . 24.8 mmt -63.36 -43.63 97.11 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 113.827 -2.987 . . . . 0.0 116.664 173.228 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 61.4 mt -121.26 142.58 49.79 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 124.81 3.459 . . . . 0.0 107.144 -166.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 38.9 p -77.65 159.26 77.19 Favored Pre-proline 0 N--CA 1.444 -0.738 0 C-N-CA 129.848 3.259 . . . . 0.0 115.729 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -41.84 -50.35 5.08 Favored 'Trans proline' 0 N--CA 1.451 -0.99 0 O-C-N 125.052 2.08 . . . . 0.0 114.341 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -73.53 -20.63 60.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 122.285 2.311 . . . . 0.0 116.288 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -70.32 -38.27 74.87 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 123.321 2.782 . . . . 0.0 109.946 170.112 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 26.0 mtm-85 -74.16 -36.6 64.11 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 118.36 2.726 . . . . 0.0 118.36 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.44 -45.62 84.5 Favored 'General case' 0 N--CA 1.447 -0.62 0 O-C-N 128.672 3.732 . . . . 0.0 114.018 161.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.77 -36.68 62.56 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 117.174 2.287 . . . . 0.0 117.174 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 47.4 mt -62.18 -32.02 72.6 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 120.063 -1.648 . . . . 0.0 107.671 171.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.93 -41.69 71.39 Favored Glycine 0 C--N 1.338 0.677 0 O-C-N 119.109 -2.244 . . . . 0.0 112.365 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 24.8 m -62.77 -31.52 72.5 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.05 2.14 . . . . 0.0 112.971 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 54' ' ' ARG . . . . . 0.463 ' HA ' ' HB ' ' D' ' 57' ' ' ILE . 24.3 mtt180 -71.6 -24.68 61.94 Favored 'General case' 0 N--CA 1.448 -0.544 1 O-C-N 116.134 -4.104 . . . . 0.0 111.834 -177.086 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.66 -43.26 98.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 O-C-N 118.694 -2.504 . . . . 0.0 111.044 170.305 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.357 3.7 ptm180 -81.92 -25.63 34.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 172.452 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 57' ' ' ILE . . . . . 0.463 ' HB ' ' HA ' ' D' ' 54' ' ' ARG . 54.0 mt -67.0 -32.84 59.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 122.024 0.129 . . . . 0.0 110.775 170.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 57.9 t -68.94 -48.25 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.69 165.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -70.15 -27.1 64.27 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 117.721 -1.592 . . . . 0.0 115.095 -174.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -74.96 -7.93 55.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 116.242 -1.837 . . . . 0.0 113.898 165.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.13 -7.75 55.1 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 121.691 2.041 . . . . 0.0 114.288 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 44.0 mt -97.65 -35.75 10.49 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 165.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -75.33 -32.41 60.9 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 112.08 -3.819 . . . . 0.0 111.768 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 47.03 55.4 8.57 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 121.042 3.177 . . . . 0.0 121.042 168.04 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -130.73 -30.19 1.86 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.082 1.353 . . . . 0.0 107.579 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 22.5 mmt -94.88 51.83 1.42 Allowed 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.844 2.458 . . . . 0.0 106.18 172.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 59.1 p -66.34 171.01 5.21 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 112.194 -2.276 . . . . 0.0 115.277 -169.001 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.303 6.6 tp-100 49.86 -89.28 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.73 1.612 . . . . 0.0 114.774 166.255 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -80.82 -35.14 33.3 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.273 -2.767 . . . . 0.0 110.238 -172.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -78.24 -31.69 49.37 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 126.459 1.904 . . . . 0.0 112.294 -172.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mt -51.67 -31.1 24.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.82 1.648 . . . . 0.0 113.566 168.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -104.63 -38.65 6.65 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 128.055 2.542 . . . . 0.0 108.43 -172.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -111.33 -14.32 13.8 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 121.982 2.174 . . . . 0.0 113.141 -164.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -118.32 -24.66 6.82 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 113.346 -3.216 . . . . 0.0 115.555 167.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 75' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' D' ' 75' ' ' LEU . 2.5 mm? -83.86 -27.55 28.61 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.332 2.333 . . . . 0.0 110.752 162.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 95.13 -175.34 33.44 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 129.64 3.495 . . . . 0.0 115.647 169.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.293 . . -68.64 -10.73 57.9 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 119.887 -1.949 . . . . 0.0 115.803 -164.12 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.39 -23.82 43.35 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 127.415 2.436 . . . . 0.0 111.094 169.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -46.5 -33.56 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 175.187 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -100.67 -4.56 28.08 Favored 'General case' 0 N--CA 1.45 -0.452 1 O-C-N 116.085 -4.135 . . . . 0.0 114.678 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 53.3 m -67.86 -33.45 74.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 120.19 1.359 . . . . 0.0 109.75 148.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.389 41.1 mm -85.85 -24.32 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 C-N-CA 131.449 3.899 . . . . 0.0 112.597 -168.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 66.7 p -129.55 6.68 5.23 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 112.106 -2.315 . . . . 0.0 115.203 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -134.16 177.21 7.92 Favored 'General case' 0 N--CA 1.452 -0.354 1 O-C-N 114.616 -5.053 . . . . 0.0 108.318 165.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 84.03 157.59 25.92 Favored Glycine 0 C--N 1.337 0.587 0 O-C-N 117.043 -3.536 . . . . 0.0 111.634 -147.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 38.7 p -72.09 -26.78 62.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 118.888 2.922 . . . . 0.0 118.888 -166.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -133.54 85.81 2.24 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 124.925 2.298 . . . . 0.0 109.62 -170.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 88' ' ' SER . . . . . 0.474 ' H ' ' HB3' ' D' ' 91' ' ' ALA . 59.5 p -131.25 -169.28 2.15 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.644 2.778 . . . . 0.0 109.301 175.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.392 5.4 mp -87.85 27.85 1.1 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 124.091 1.9 . . . . 0.0 109.886 -177.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -107.17 10.59 30.0 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 119.879 -1.763 . . . . 0.0 115.006 147.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 91' ' ' ALA . . . . . 0.474 ' HB3' ' H ' ' D' ' 88' ' ' SER . . . -144.65 -3.81 0.79 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 112.414 -3.66 . . . . 0.0 109.818 -162.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 92' ' ' ALA . . . . . 0.498 ' HA ' ' N ' ' D' ' 94' ' ' VAL . . . 66.01 85.85 0.15 Allowed Pre-proline 0 N--CA 1.448 -0.564 0 CA-C-N 124.676 3.398 . . . . 0.0 117.91 169.405 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.309 0.0 OUTLIER 30.42 23.23 0.0 OUTLIER 'Cis proline' 0 N--CA 1.451 -1.018 0 N-CA-C 121.107 3.464 . . . . 0.0 121.107 17.373 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' D' D ' 94' ' ' VAL . . . . . 0.498 ' N ' ' HA ' ' D' ' 92' ' ' ALA . 15.1 t -65.74 -31.91 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 119.571 1.078 . . . . 0.0 110.526 161.031 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.358 0.0 OUTLIER -78.52 -36.76 44.38 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 128.716 2.806 . . . . 0.0 109.607 -178.769 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . 0.286 16.3 tp -55.96 -57.41 12.2 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.718 168.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 26.4 ttp-105 -49.09 -40.57 32.46 Favored 'General case' 0 N--CA 1.451 -0.381 1 CA-C-O 110.793 -4.432 . . . . 0.0 115.75 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -62.35 -24.12 67.17 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 127.7 3.125 . . . . 0.0 115.183 177.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -98.22 -35.12 10.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.661 -3.149 . . . . 0.0 110.84 175.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 48.0 mt -53.46 -39.74 64.71 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 120.631 1.559 . . . . 0.0 114.839 168.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . 0.297 15.5 tt0 -80.05 -13.13 59.54 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 117.016 -1.874 . . . . 0.0 107.986 -176.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -104.59 4.76 33.18 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 119.244 -2.16 . . . . 0.0 113.611 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 2.5 t -123.49 -27.06 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 114.401 -2.714 . . . . 0.0 113.73 162.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 29.0 mt -92.99 -27.39 17.05 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 123.985 3.084 . . . . 0.0 118.261 166.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.313 74.7 mt -114.66 30.45 7.32 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 122.615 2.462 . . . . 0.0 107.628 172.357 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -61.49 174.71 0.7 Allowed 'General case' 0 N--CA 1.449 -0.481 1 C-N-CA 131.993 4.117 . . . . 0.0 111.626 -174.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 14.6 m -58.13 -38.1 75.89 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 112.776 -2.011 . . . . 0.0 113.655 -169.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.953 2.501 . . . . 0.0 115.423 -174.478 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ttp . . . . . 0 N--CA 1.467 0.411 0 N-CA-C 117.144 2.276 . . . . 0.0 117.144 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . 0.256 . . -58.11 -27.95 64.19 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 121.622 2.01 . . . . 0.0 114.75 -176.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -45.92 -51.51 13.12 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 128.195 2.598 . . . . 0.0 112.727 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -64.07 -30.52 71.59 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 111.747 -2.479 . . . . 0.0 113.134 -174.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.3 p -90.29 175.73 3.53 Favored Pre-proline 0 N--CA 1.447 -0.599 0 CA-C-O 117.284 -1.341 . . . . 0.0 114.598 -165.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -74.11 -33.99 5.4 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 123.028 2.486 . . . . 0.0 112.785 -169.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -133.7 128.3 34.67 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 119.11 -2.244 . . . . 0.0 110.4 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 24.1 t -104.41 114.75 29.19 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 118.514 -2.617 . . . . 0.0 112.956 168.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.39 -4.05 56.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 115.612 -2.137 . . . . 0.0 115.046 168.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.265 . . -86.79 -42.35 13.36 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 115.834 -2.031 . . . . 0.0 108.376 177.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.1 ttm -64.56 -33.29 75.56 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 121.859 2.118 . . . . 0.0 109.299 173.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.2 -39.98 84.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.973 1.471 . . . . 0.0 114.973 171.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -74.42 -46.52 39.57 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -54.37 -52.94 60.07 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 118.968 0.804 . . . . 0.0 112.173 176.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -60.2 -37.0 78.92 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 173.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 40.5 t60 -62.71 -48.99 76.86 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 115.321 -2.276 . . . . 0.0 113.762 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -66.78 -36.57 82.71 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 121.127 1.785 . . . . 0.0 113.889 175.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -58.69 -33.47 70.19 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 117.47 -3.269 . . . . 0.0 110.963 169.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -77.74 -40.81 39.86 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 117.881 2.549 . . . . 0.0 117.881 175.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.8 mt -63.08 -17.88 62.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 117.825 2.528 . . . . 0.0 117.825 172.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -62.21 -52.28 64.42 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 115.275 -2.298 . . . . 0.0 109.991 167.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -53.47 -46.14 69.84 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 127.346 2.904 . . . . 0.0 108.358 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.8 t -72.46 -19.86 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 O-C-N 117.056 -3.527 . . . . 0.0 116.767 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -83.77 -39.02 20.57 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 117.516 -3.24 . . . . 0.0 112.543 163.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.4 tp -49.11 -52.28 26.88 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 124.466 2.079 . . . . 0.0 112.838 170.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.8 tp -81.24 -16.5 52.49 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 118.14 -2.85 . . . . 0.0 108.792 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -64.27 -49.85 70.25 Favored 'General case' 0 N--CA 1.449 -0.481 1 CA-C-N 126.014 4.006 . . . . 0.0 108.771 168.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 58.0 m-20 -71.34 -15.08 62.38 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 118.47 -2.644 . . . . 0.0 112.832 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.17 -36.8 61.45 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 115.265 -2.303 . . . . 0.0 115.457 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -63.0 -37.22 86.3 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.217 2.207 . . . . 0.0 116.003 170.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -67.16 -9.54 41.02 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 113.071 -1.877 . . . . 0.0 114.151 171.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -120.71 4.59 10.57 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.723 -2.486 . . . . 0.0 112.6 173.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.322 13.2 m-20 56.93 29.39 16.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 116.385 1.995 . . . . 0.0 116.385 -170.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.7 mt -102.71 0.61 33.26 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 117.802 -3.061 . . . . 0.0 115.3 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 36.5 p-80 -57.24 -45.75 83.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.927 2.091 . . . . 0.0 110.983 173.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.354 77.2 mt -55.44 -51.44 79.95 Favored Pre-proline 0 N--CA 1.445 -0.69 2 O-C-N 115.938 -4.226 . . . . 0.0 113.368 178.064 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -77.73 -37.77 0.83 Allowed 'Trans proline' 0 N--CA 1.449 -1.126 0 CA-C-O 115.634 -1.903 . . . . 0.0 108.95 -176.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.6 tp -58.6 -40.79 84.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 120.035 1.289 . . . . 0.0 113.562 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.62 -36.98 73.76 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 116.031 -1.938 . . . . 0.0 113.376 174.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -62.16 -23.15 66.42 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 119.469 3.137 . . . . 0.0 119.469 166.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.0 tp -74.25 -48.3 29.56 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 125.872 1.982 . . . . 0.0 115.7 166.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 79.0 mmm -77.29 -8.78 58.19 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.384 -1.293 . . . . 0.0 113.692 -167.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 53.2 mt -144.51 128.84 17.86 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 125.245 1.591 . . . . 0.0 113.741 -166.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 62.3 p -71.78 152.38 93.31 Favored Pre-proline 0 N--CA 1.446 -0.644 0 CA-C-O 122.281 1.038 . . . . 0.0 109.528 176.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -62.38 -13.07 30.55 Favored 'Trans proline' 0 N--CA 1.446 -1.297 0 C-N-CA 122.607 2.205 . . . . 0.0 114.398 -174.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.97 -27.17 18.86 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 119.406 -2.059 . . . . 0.0 112.205 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.81 -46.39 78.81 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 158.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 60.8 mtm-85 -63.2 -40.82 98.59 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 117.971 -1.492 . . . . 0.0 111.286 -178.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -62.03 -36.69 82.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 166.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.24 -25.78 66.26 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 117.322 -3.361 . . . . 0.0 113.798 173.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.1 mt -76.81 -40.9 46.42 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 124.956 2.313 . . . . 0.0 115.348 -177.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -47.23 -56.42 7.99 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 110.85 -2.886 . . . . 0.0 117.065 161.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.1 m -71.86 -35.2 69.74 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 112.542 -1.829 . . . . 0.0 114.311 175.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 60.4 mtt180 -61.75 -34.96 76.78 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 121.229 1.831 . . . . 0.0 111.275 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.4 t -59.29 -42.13 86.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 O-C-N 117.126 -3.484 . . . . 0.0 109.241 171.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -72.73 -26.32 61.53 Favored 'General case' 0 N--CA 1.449 -0.492 1 O-C-N 115.461 -4.525 . . . . 0.0 112.033 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 52.7 mt -67.6 -47.04 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 117.126 -1.416 . . . . 0.0 107.696 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.4 t -62.99 -38.57 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-O 116.412 -1.756 . . . . 0.0 112.069 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -61.84 -49.62 75.54 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 125.127 3.603 . . . . 0.0 112.704 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -76.08 -18.07 59.35 Favored 'General case' 0 N--CA 1.448 -0.546 1 CA-C-O 111.047 -4.311 . . . . 0.0 114.18 -173.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.9 mt -77.55 -33.02 54.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 124.944 3.52 . . . . 0.0 111.795 160.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.2 mt -78.1 -26.42 48.03 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 119.566 -0.854 . . . . 0.0 112.189 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -85.42 -30.99 23.13 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 123.682 1.706 . . . . 0.0 114.855 172.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.25 25.32 61.77 Favored Glycine 0 C--N 1.339 0.718 0 O-C-N 117.203 -3.436 . . . . 0.0 115.749 161.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -110.88 -36.46 5.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 120.544 2.172 . . . . 0.0 110.047 -170.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 55.6 mtp -64.08 139.76 58.8 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 174.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 54.0 p -83.83 173.36 11.33 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 111.793 -2.458 . . . . 0.0 111.442 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -70.72 -28.61 64.86 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 177.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.46 ' NH2' HD21 ' A' ' 73' ' ' ASN . 34.7 ttt85 -80.74 -34.79 34.09 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 114.083 -2.865 . . . . 0.0 107.656 175.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -65.37 -42.93 92.2 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 120.71 1.595 . . . . 0.0 108.761 175.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 40.4 mt -68.13 -20.26 64.89 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 123.083 2.674 . . . . 0.0 110.02 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -87.33 -38.82 15.89 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 120.787 1.63 . . . . 0.0 108.659 -177.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.46 HD21 ' NH2' ' A' ' 69' ' ' ARG . 7.5 m120 -77.11 -30.9 55.47 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 117.002 2.223 . . . . 0.0 117.002 174.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -101.59 -37.9 8.18 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 121.265 1.848 . . . . 0.0 112.215 -170.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.8 mt -106.75 -8.55 16.77 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 130.348 3.459 . . . . 0.0 115.22 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 88.28 -15.43 56.33 Favored Glycine 0 CA--C 1.526 0.742 0 O-C-N 120.033 -1.667 . . . . 0.0 114.717 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.48 119.6 16.92 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 126.833 2.053 . . . . 0.0 115.5 -159.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.59 179.15 26.67 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 119.377 2.511 . . . . 0.0 119.377 172.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 76.1 mt -53.15 -47.86 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 117.838 -1.077 . . . . 0.0 108.141 163.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.36 -49.48 72.15 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -176.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.1 m -65.5 -48.84 71.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.814 0.816 . . . . 0.0 110.958 -167.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.6 mm -65.51 -26.8 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 124.663 2.173 . . . . 0.0 114.917 175.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 55.9 m -71.62 -40.3 69.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 119.433 -2.042 . . . . 0.0 111.075 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 60.9 ttt180 -79.17 -31.45 43.9 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 127.799 2.439 . . . . 0.0 106.15 -176.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -58.37 -55.06 32.79 Favored Glycine 0 CA--C 1.521 0.436 0 O-C-N 120.013 -1.679 . . . . 0.0 112.307 165.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.6 m -69.2 -19.61 63.98 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -81.82 -38.92 24.77 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 116.316 -3.99 . . . . 0.0 107.239 174.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.3 m -66.02 -28.61 68.99 Favored 'General case' 0 N--CA 1.451 -0.415 1 O-C-N 116.192 -4.067 . . . . 0.0 116.589 171.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.85 -42.03 22.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 117.55 -3.219 . . . . 0.0 107.997 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -62.85 -27.08 69.09 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 125.328 1.643 . . . . 0.0 114.274 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.56 -17.25 20.59 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 126.043 1.737 . . . . 0.0 112.792 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.57 153.08 11.07 Favored Pre-proline 0 N--CA 1.45 -0.443 0 O-C-N 119.032 -2.293 . . . . 0.0 113.959 165.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -76.42 155.94 36.63 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 N-CA-C 109.279 -1.085 . . . . 0.0 109.279 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.5 m -66.57 -37.32 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-O 126.397 2.999 . . . . 0.0 113.578 -175.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.4 pm0 -62.46 -19.18 63.27 Favored 'General case' 0 N--CA 1.447 -0.598 1 O-C-N 114.939 -4.851 . . . . 0.0 116.947 170.096 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 50.8 tp -83.08 -38.67 22.18 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 124.378 1.049 . . . . 0.0 111.805 169.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -73.56 -34.29 65.09 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 117.932 -1.507 . . . . 0.0 109.525 -175.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -68.43 -33.43 74.19 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 84.0 t90 -81.7 -26.83 34.31 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.871 2.068 . . . . 0.0 112.711 -176.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 75.6 mt -69.92 -44.97 68.56 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 116.609 -3.807 . . . . 0.0 115.75 164.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -64.34 -2.85 2.42 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 163.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -91.08 -62.94 1.34 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 119.584 -0.847 . . . . 0.0 109.42 154.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 77.9 t -66.98 -35.81 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-O 118.096 -0.954 . . . . 0.0 109.032 -154.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 33.1 mt -96.01 -7.02 37.5 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 117.698 -3.127 . . . . 0.0 110.794 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 50.4 mt -124.32 7.61 8.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 123.452 2.842 . . . . 0.0 111.857 -172.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.286 60.1 tttt -107.54 -15.89 14.49 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 117.133 -3.479 . . . . 0.0 114.635 -177.082 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.5 t -75.19 -32.31 61.19 Favored 'General case' 0 N--CA 1.45 -0.449 1 N-CA-C 123.13 4.493 . . . . 0.0 123.13 175.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 . . . . . 0 C--O 1.249 1.072 1 C-N-CA 132.539 4.336 . . . . 0.0 114.512 166.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 39.8 ttp . . . . . 0 N--CA 1.473 0.725 0 CA-C-O 116.205 -1.855 . . . . 0.0 115.602 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.41 -26.42 64.62 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 122.544 2.429 . . . . 0.0 115.233 -159.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -76.89 -13.52 59.98 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 124.797 1.311 . . . . 0.0 111.64 173.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -95.59 -30.74 13.64 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 120.261 -1.524 . . . . 0.0 108.145 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' SER . . . . . 0.421 ' HA ' ' HD3' ' B' ' 6' ' ' PRO . 16.0 m -67.63 149.92 98.08 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.664 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' B' ' 5' ' ' SER . 23.4 Cg_exo -72.05 -16.55 28.81 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 CA-C-O 112.809 -3.08 . . . . 0.0 115.988 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -142.9 142.66 31.79 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 124.255 3.207 . . . . 0.0 113.414 161.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 30.2 t -125.09 110.22 13.87 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.561 1.945 . . . . 0.0 111.227 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.02 -21.5 54.5 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 119.553 -1.967 . . . . 0.0 114.313 173.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.52 -40.56 68.72 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 118.493 2.775 . . . . 0.0 118.493 163.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 26.2 ttm -76.68 -29.63 56.4 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 113.808 -2.996 . . . . 0.0 109.948 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . 0.295 . . -62.22 -44.15 97.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 123.364 2.802 . . . . 0.0 110.588 170.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -61.6 -56.43 19.99 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 115.976 -1.964 . . . . 0.0 112.45 170.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -45.6 -43.1 11.96 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 171.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . 0.26 39.4 mmt180 -70.13 -42.05 73.11 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 119.246 -2.159 . . . . 0.0 115.706 171.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -57.59 -41.88 82.07 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 117.326 -3.359 . . . . 0.0 112.588 171.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -75.51 -25.21 57.06 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 113.519 -3.134 . . . . 0.0 115.093 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -59.15 -45.58 90.6 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 122.682 2.492 . . . . 0.0 115.574 158.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 53.2 t-105 -64.04 -52.6 58.66 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.586 2.354 . . . . 0.0 116.811 175.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 89.1 mt -56.16 -31.67 63.6 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 117.295 -3.378 . . . . 0.0 111.625 169.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -69.84 -32.08 70.3 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 122.324 2.329 . . . . 0.0 106.748 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -65.24 -48.46 73.21 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 117.317 -1.325 . . . . 0.0 112.669 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 95.9 t -60.2 -49.84 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 CA-C-O 112.362 -3.685 . . . . 0.0 112.259 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -50.58 -45.92 57.54 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 124.892 3.496 . . . . 0.0 114.845 167.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 24.5 tp -56.92 -45.97 82.32 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 27.2 tp -73.44 -26.63 61.02 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 47.2 tttt -73.0 -43.26 62.36 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 116.763 -1.589 . . . . 0.0 110.125 176.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -62.42 -44.01 97.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 164.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.8 70.21 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 119.55 -1.969 . . . . 0.0 112.64 -175.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -68.38 -30.56 69.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.456 -2.652 . . . . 0.0 111.132 171.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -80.92 -4.34 54.6 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.118 -0.989 . . . . 0.0 113.291 174.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . 0.265 1.1 m-80 -124.67 13.27 8.65 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 116.304 -1.808 . . . . 0.0 113.237 170.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 53.76 23.43 3.73 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 117.064 2.246 . . . . 0.0 117.064 -175.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.1 mt -98.72 15.48 25.16 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 126.512 2.382 . . . . 0.0 112.313 172.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -74.4 -41.65 60.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 123.189 2.722 . . . . 0.0 113.534 -168.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 20.5 mt -69.99 -44.98 22.59 Favored Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-O 117.344 -1.312 . . . . 0.0 113.001 176.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.48 -46.21 30.56 Favored 'Trans proline' 0 N--CA 1.452 -0.968 0 CA-C-N 124.257 2.556 . . . . 0.0 113.475 170.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 61.2 tp -56.87 -52.23 65.93 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 127.187 2.195 . . . . 0.0 113.268 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 29.9 mt -60.48 -35.34 75.68 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 116.013 -1.946 . . . . 0.0 115.625 178.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -70.78 -32.3 69.37 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 128.336 2.655 . . . . 0.0 113.39 171.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 57.8 tp -67.55 -36.18 80.47 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 121.903 -0.498 . . . . 0.0 112.107 165.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 96.7 mmm -90.64 -24.77 20.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 121.553 3.909 . . . . 0.0 121.553 -178.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 10.1 mt -125.69 131.63 52.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 114.3 -2.762 . . . . 0.0 109.28 -176.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.252 73.0 p -71.55 153.69 93.54 Favored Pre-proline 0 N--CA 1.447 -0.583 0 O-C-N 128.545 3.653 . . . . 0.0 118.979 175.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_exo -44.87 -45.25 14.0 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.53 2.82 . . . . 0.0 108.568 -175.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -41.45 80.81 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.011 2.069 . . . . 0.0 114.376 -177.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.12 -39.46 90.09 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.084 2.153 . . . . 0.0 110.975 171.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 48.4 mtm-85 -71.38 -41.82 69.2 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.86 1.664 . . . . 0.0 110.891 -177.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.271 37.1 tt0 -68.88 -31.49 70.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 174.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.47 -35.91 73.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.812 -1.089 . . . . 0.0 111.527 172.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -75.06 -33.1 61.67 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 116.505 -3.872 . . . . 0.0 112.899 176.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.75 -29.8 75.26 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 117.453 -2.308 . . . . 0.0 116.32 172.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 99.3 m -80.56 -33.27 36.29 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 126.83 2.135 . . . . 0.0 109.278 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -59.65 -30.7 68.92 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 118.366 2.728 . . . . 0.0 118.366 173.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 9.4 t -65.75 -45.63 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 174.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -70.29 -31.61 69.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.108 -1.425 . . . . 0.0 112.988 177.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 68.5 mt -68.03 -39.67 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 123.311 2.778 . . . . 0.0 109.537 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.388 78.5 t -78.38 -41.07 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 128.057 2.543 . . . . 0.0 112.982 -175.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -48.57 -46.88 39.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 123.384 1.564 . . . . 0.0 109.898 167.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -76.73 -35.73 57.6 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 119.435 -2.041 . . . . 0.0 109.705 -171.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 39.5 mt -67.39 -17.38 64.71 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.801 -1.571 . . . . 0.0 111.945 174.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 70.4 mt -94.19 -29.76 14.95 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 114.429 -2.701 . . . . 0.0 114.428 168.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 26.2 ttm105 -72.23 -37.2 69.24 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 130.286 3.434 . . . . 0.0 109.745 173.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.98 18.59 64.73 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 128.52 2.962 . . . . 0.0 117.919 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -115.71 54.18 0.82 Allowed 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 129.93 3.959 . . . . 0.0 115.351 -171.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 6.8 mtt -144.71 146.62 32.3 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 129.52 3.128 . . . . 0.0 111.956 164.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 91.4 p -81.16 175.57 10.53 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 161.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -64.85 -38.58 91.46 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 119.487 -2.008 . . . . 0.0 112.055 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' ARG . . . . . 0.41 HH21 ' HD2' ' B' ' 69' ' ' ARG . 20.0 ttt85 -56.01 -54.3 46.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 122.373 1.082 . . . . 0.0 113.235 174.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -58.16 -48.86 78.97 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.486 1.915 . . . . 0.0 112.937 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.41 -34.83 77.52 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 118.338 -2.726 . . . . 0.0 116.995 166.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 tptt -66.63 -36.02 81.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 121.627 2.012 . . . . 0.0 110.507 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -102.35 -45.15 5.18 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 120.876 -1.14 . . . . 0.0 108.997 -162.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -87.36 -34.72 18.71 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -171.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 63.7 mt -109.97 -10.93 14.7 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 117.23 2.308 . . . . 0.0 117.23 173.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.04 21.79 70.08 Favored Glycine 0 CA--C 1.526 0.73 0 C-N-CA 126.837 2.161 . . . . 0.0 111.614 177.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -103.74 96.17 6.52 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 122.423 3.111 . . . . 0.0 111.006 -177.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.37 178.61 41.28 Favored Glycine 0 C--N 1.335 0.489 0 O-C-N 126.127 2.142 . . . . 0.0 110.212 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 19.8 mt -42.12 -54.87 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 114.331 -0.935 . . . . 0.0 111.639 174.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.41 -56.0 11.15 Favored 'General case' 0 N--CA 1.451 -0.378 1 N-CA-C 121.856 4.021 . . . . 0.0 121.856 177.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 17.3 m -58.71 -47.17 85.47 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 173.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 40.7 mm -52.81 -45.61 50.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 124.581 1.152 . . . . 0.0 113.279 166.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 3.5 m -61.94 -36.92 82.83 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 123.962 1.839 . . . . 0.0 112.404 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -84.3 -27.96 27.45 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 117.578 -3.201 . . . . 0.0 109.456 -174.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.17 -38.89 28.53 Favored Glycine 0 C--N 1.334 0.434 0 O-C-N 118.435 -2.666 . . . . 0.0 111.694 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 18.8 m -65.03 -49.41 70.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 129.311 3.044 . . . . 0.0 107.658 175.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -52.55 -50.02 63.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 127.558 2.343 . . . . 0.0 111.313 170.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 13.5 m -66.06 -33.45 75.83 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.961 -1.712 . . . . 0.0 114.246 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 13.4 mt -61.45 -42.56 98.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 123.798 0.839 . . . . 0.0 112.861 167.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 39.3 mttm -65.73 -38.31 88.79 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 125.509 1.755 . . . . 0.0 113.551 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.06 -25.41 62.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.954 1.701 . . . . 0.0 111.875 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.38 165.74 6.46 Favored Pre-proline 0 N--CA 1.45 -0.464 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -69.11 162.1 43.12 Favored 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.788 2.326 . . . . 0.0 112.645 168.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 m -74.67 -30.56 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 O-C-N 119.109 -2.245 . . . . 0.0 111.156 171.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -70.85 -20.02 62.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.481 2.312 . . . . 0.0 111.254 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' B' ' 96' ' ' LEU . 13.3 tp -75.88 -56.46 4.65 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 114.538 -2.649 . . . . 0.0 110.1 167.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 92.9 mtm-85 -56.51 -46.67 80.41 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 121.22 1.827 . . . . 0.0 109.893 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -59.25 -30.35 68.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.729 -176.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 80.5 t90 -96.89 -33.09 11.74 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.066 -2.271 . . . . 0.0 112.488 -173.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.55 -33.38 73.75 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 118.664 -1.214 . . . . 0.0 111.798 166.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.7 -32.49 74.08 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 117.284 2.327 . . . . 0.0 117.284 171.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -75.32 -16.59 60.4 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 112.732 -2.031 . . . . 0.0 115.319 169.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 48.7 t -103.26 -41.14 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 O-C-N 117.069 -3.519 . . . . 0.0 115.416 171.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 88.6 mt -85.07 -35.47 21.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 121.903 2.138 . . . . 0.0 115.266 -168.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 33.2 mt -101.62 -10.34 20.14 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 118.828 -2.42 . . . . 0.0 109.543 -171.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -77.88 -7.69 57.06 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.339 1.855 . . . . 0.0 112.308 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . 0.25 14.4 m -89.36 -17.68 28.38 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.67 2.388 . . . . 0.0 116.549 178.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.27 70.4 m-20 . . . . . 0 C--O 1.248 0.986 0 C-N-CA 129.183 2.993 . . . . 0.0 109.129 171.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 62.4 ttp . . . . . 0 N--CA 1.474 0.751 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.92 168.96 11.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 120.491 1.496 . . . . 0.0 107.051 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -133.4 149.53 51.82 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.499 -2.626 . . . . 0.0 109.789 176.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -157.22 138.71 13.9 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 105.834 -1.913 . . . . 0.0 105.834 -177.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 32.6 p -139.91 171.4 7.94 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 130.62 3.568 . . . . 0.0 111.808 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -50.05 -33.42 34.72 Favored 'Trans proline' 0 N--CA 1.446 -1.278 0 N-CA-C 119.477 2.837 . . . . 0.0 119.477 174.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -151.02 148.06 27.89 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 115.851 -2.023 . . . . 0.0 107.109 -161.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 26.0 t -150.55 131.37 14.13 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.06 -23.66 60.59 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 114.653 -2.594 . . . . 0.0 113.269 167.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.85 -35.04 78.64 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 113.026 -3.369 . . . . 0.0 114.426 169.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 53.9 mtt -68.98 -43.23 75.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 127.178 2.799 . . . . 0.0 108.635 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . 0.254 . . -57.2 -37.62 72.48 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 174.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -64.96 -28.31 69.43 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 117.438 -3.289 . . . . 0.0 116.61 170.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -72.84 -44.94 60.81 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 120.373 -1.454 . . . . 0.0 113.401 170.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -36.15 71.76 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 126.144 1.778 . . . . 0.0 111.994 167.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -61.92 -44.89 95.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 120.251 -1.53 . . . . 0.0 111.234 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -75.52 -22.05 57.45 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 177.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -62.39 -45.22 94.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.838 1.255 . . . . 0.0 111.931 167.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 23.6 t-105 -59.5 -52.71 64.41 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 123.459 1.6 . . . . 0.0 114.423 169.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 15.3 mt -69.14 -24.63 64.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.148 -1.387 . . . . 0.0 112.858 -171.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -78.1 -32.35 50.55 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 117.17 -1.395 . . . . 0.0 113.555 165.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -58.9 -58.77 7.16 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 117.75 -1.58 . . . . 0.0 113.576 168.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.56 -46.42 95.03 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-O 122.452 1.12 . . . . 0.0 110.451 -171.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -58.74 -42.71 89.45 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 -177.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 60.9 tp -67.67 -46.51 72.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 131.389 3.876 . . . . 0.0 107.064 172.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.75 -31.46 72.46 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 128.015 3.322 . . . . 0.0 114.819 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . 0.32 27.3 ttpp -65.21 -41.33 94.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 117.621 2.452 . . . . 0.0 117.621 162.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -58.49 -27.57 64.57 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 124.327 3.239 . . . . 0.0 114.557 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.76 -38.01 86.41 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.757 1.623 . . . . 0.0 113.765 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -60.94 -16.75 46.07 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -82.71 -21.33 34.85 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 34.1 p-10 -126.62 8.03 6.95 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.374 2.0 m-20 73.59 23.18 2.47 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 119.862 -1.774 . . . . 0.0 114.006 175.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.61 5.57 31.18 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 122.026 2.194 . . . . 0.0 114.626 171.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -67.85 -43.48 79.37 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.203 -2.811 . . . . 0.0 116.557 -166.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.295 82.5 mt -72.1 -43.35 10.28 Favored Pre-proline 0 N--CA 1.45 -0.435 0 O-C-N 125.245 1.591 . . . . 0.0 114.139 170.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.61 -32.03 95.86 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 CA-C-O 124.57 1.821 . . . . 0.0 113.627 172.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 19.2 tp -72.39 -33.93 67.55 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.358 -2.714 . . . . 0.0 115.837 172.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 40.4 mt -77.33 -28.27 53.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.93 0.892 . . . . 0.0 109.757 173.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -73.46 -31.17 63.63 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 131.015 3.726 . . . . 0.0 109.883 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -72.29 -51.05 22.58 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 128.206 2.603 . . . . 0.0 115.766 168.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 91.7 mmm -85.4 -29.11 24.67 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.147 -1.406 . . . . 0.0 110.632 -164.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 9.1 mp -115.61 153.26 31.57 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 119.308 0.958 . . . . 0.0 110.153 -175.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 11.9 p -75.59 159.04 82.47 Favored Pre-proline 0 N--CA 1.449 -0.477 0 C-N-CA 127.03 2.132 . . . . 0.0 112.514 163.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.61 -24.77 46.79 Favored 'Trans proline' 0 N--CA 1.451 -1.024 1 C-N-CA 126.404 4.736 . . . . 0.0 116.446 173.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.76 -26.85 25.59 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.029 1.332 . . . . 0.0 109.412 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -77.37 -35.24 54.66 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 118.668 0.667 . . . . 0.0 112.558 172.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 86.6 mtm-85 -55.43 -52.17 64.49 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 124.955 1.302 . . . . 0.0 111.615 166.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -69.27 -39.51 78.34 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 115.603 -2.141 . . . . 0.0 110.846 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.39 -46.37 88.88 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.629 2.013 . . . . 0.0 111.454 169.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . 0.265 28.8 mt -63.89 -27.48 69.18 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 120.273 1.397 . . . . 0.0 113.658 -174.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.85 -25.1 42.67 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 117.62 1.808 . . . . 0.0 117.62 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 24.3 m -74.2 -37.56 63.87 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 116.015 -1.945 . . . . 0.0 112.07 166.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -56.78 -38.58 72.71 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 128.973 2.909 . . . . 0.0 114.877 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 69.1 t -59.31 -43.99 91.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 115.806 -2.045 . . . . 0.0 108.997 170.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 48.9 mtp180 -68.11 -34.13 75.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 122.006 2.185 . . . . 0.0 110.487 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 57' ' ' ILE . . . . . 0.434 HG22 HG13 ' C' ' 82' ' ' ILE . 50.0 mt -72.51 -36.85 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 120.009 -1.682 . . . . 0.0 111.735 176.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 78.4 t -56.83 -47.59 82.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 N-CA-C 118.086 2.625 . . . . 0.0 118.086 160.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -53.91 -48.24 70.35 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 129.113 2.965 . . . . 0.0 115.92 175.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -69.06 -19.37 64.08 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.124 -1.417 . . . . 0.0 111.825 -177.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 95.8 mt -89.0 -30.07 19.01 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.161 -1.876 . . . . 0.0 114.666 177.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 37.8 mt -64.44 -43.86 92.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 119.357 0.981 . . . . 0.0 111.703 165.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -62.74 -51.04 68.71 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 127.405 2.282 . . . . 0.0 113.464 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.36 -5.05 79.27 Favored Glycine 0 C--N 1.338 0.644 0 CA-C-O 115.355 -2.914 . . . . 0.0 112.383 158.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -69.65 -15.16 63.13 Favored 'General case' 0 N--CA 1.447 -0.599 1 N-CA-C 121.879 4.029 . . . . 0.0 121.879 -174.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . 0.263 39.2 mtt -59.44 127.1 30.37 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 129.902 3.281 . . . . 0.0 110.199 173.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 96.4 p -81.47 168.29 18.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 125.517 1.761 . . . . 0.0 109.71 175.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -56.83 -26.28 57.89 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 117.061 -1.447 . . . . 0.0 114.248 174.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 mtp-105 -69.44 -26.21 64.49 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 126.448 1.899 . . . . 0.0 112.553 167.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -99.78 -34.31 10.21 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 128.126 2.57 . . . . 0.0 116.653 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . 0.25 24.7 mt -62.5 -22.51 66.32 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.88 -1.763 . . . . 0.0 109.251 168.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -91.11 -53.74 4.24 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 125.467 1.729 . . . . 0.0 113.689 168.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -104.87 -1.02 26.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 119.39 3.108 . . . . 0.0 119.39 -166.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 23.9 tp10 -122.74 -31.94 3.62 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 128.698 2.799 . . . . 0.0 116.502 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 tp -88.93 -31.39 18.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 121.464 -0.772 . . . . 0.0 112.583 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 93.05 -179.37 39.49 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-O 117.828 -1.54 . . . . 0.0 116.235 172.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.75 -21.13 54.69 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 125.168 2.413 . . . . 0.0 112.308 169.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.67 -15.47 18.76 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-O 124.894 2.386 . . . . 0.0 116.547 171.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 6.0 tt -70.16 -34.38 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 120.276 -1.72 . . . . 0.0 112.451 176.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.89 -27.29 68.04 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 171.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 25.2 m -72.63 -27.75 62.33 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 122.22 2.282 . . . . 0.0 110.414 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 82' ' ' ILE . . . . . 0.434 HG13 HG22 ' C' ' 57' ' ' ILE 0.317 39.2 mm -97.56 -22.8 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 126.876 2.07 . . . . 0.0 116.173 -173.893 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 39.4 p -118.39 -3.14 10.98 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 120.833 3.642 . . . . 0.0 120.833 -176.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -126.18 153.06 45.16 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 117.865 -3.022 . . . . 0.0 111.962 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 94.13 167.64 37.33 Favored Glycine 0 C--N 1.335 0.505 0 N-CA-C 117.484 1.754 . . . . 0.0 117.484 -172.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 93.9 p -80.61 2.92 23.7 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 117.854 2.539 . . . . 0.0 117.854 -174.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -117.72 -9.65 10.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.962 -1.971 . . . . 0.0 112.607 171.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 57.5 p -47.77 168.28 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 -173.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 tp -53.78 -38.96 65.01 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 120.714 3.598 . . . . 0.0 120.714 -163.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.256 57.1 mttt -88.51 -12.56 42.56 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 124.808 1.318 . . . . 0.0 114.406 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.13 -10.63 41.2 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 129.789 3.235 . . . . 0.0 112.242 169.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.05 150.59 69.56 Favored Pre-proline 0 N--CA 1.446 -0.648 0 CA-C-O 115.142 -2.361 . . . . 0.0 112.997 172.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -39.06 141.21 0.39 Allowed 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 123.794 2.996 . . . . 0.0 118.45 166.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 2.1 t -59.78 -45.28 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 CA-C-O 113.536 -3.126 . . . . 0.0 110.441 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.6 pm0 -61.12 -16.87 49.01 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 121.145 1.793 . . . . 0.0 115.414 -176.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 14.8 tp -82.64 -41.54 19.32 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 117.017 2.229 . . . . 0.0 117.017 164.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -60.82 -37.17 81.08 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 116.519 -3.863 . . . . 0.0 110.038 176.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -71.23 -35.02 71.32 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.971 1.708 . . . . 0.0 111.68 175.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -75.11 -40.27 59.99 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 31.1 mt -61.35 -36.71 80.95 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.972 1.709 . . . . 0.0 109.744 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.99 -27.92 67.84 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 170.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -79.36 -17.64 54.07 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 122.504 2.411 . . . . 0.0 111.137 174.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 92.8 t -108.93 -28.77 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 O-C-N 117.901 -2.999 . . . . 0.0 114.28 -176.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 65.9 mt -95.79 -45.9 6.8 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.079 0.942 . . . . 0.0 109.696 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 33.1 mt -92.98 16.85 11.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 120.992 -1.068 . . . . 0.0 113.271 -171.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -52.05 163.38 0.36 Allowed 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 118.506 -2.621 . . . . 0.0 116.813 157.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -132.12 39.24 3.44 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 117.426 -3.296 . . . . 0.0 109.124 172.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 25.1 t70 . . . . . 0 C--O 1.251 1.18 0 CA-C-N 121.77 2.077 . . . . 0.0 112.721 -160.523 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 29.5 ttp . . . . . 0 N--CA 1.47 0.565 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.04 122.46 16.12 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 -162.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -150.18 58.14 0.96 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -170.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -84.44 148.67 26.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.588 0.755 . . . . 0.0 111.003 -173.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 21.0 p -126.62 153.13 75.45 Favored Pre-proline 0 N--CA 1.447 -0.583 0 C-N-CA 124.333 1.053 . . . . 0.0 108.519 175.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 99.5 Cg_exo -53.25 -49.91 15.82 Favored 'Trans proline' 0 N--CA 1.449 -1.142 1 C-N-CA 125.651 4.234 . . . . 0.0 115.522 177.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -151.35 126.05 9.61 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.341 1.856 . . . . 0.0 114.547 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 14.5 t -47.12 113.66 0.71 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 166.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.16 -44.83 32.71 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 113.244 -1.798 . . . . 0.0 109.686 171.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.88 -26.47 62.36 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.612 2.078 . . . . 0.0 116.612 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 11' ' ' MET . . . . . 0.431 ' O ' ' HD2' ' D' ' 15' ' ' ARG . 17.8 mmt -71.32 -31.22 67.16 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 126.058 2.098 . . . . 0.0 111.244 168.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.42 -21.99 52.23 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 118.374 -2.704 . . . . 0.0 111.064 176.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -79.22 -34.87 42.43 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.817 1.189 . . . . 0.0 109.705 166.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -62.39 -43.3 99.13 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 123.666 1.698 . . . . 0.0 111.325 -177.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 15' ' ' ARG . . . . . 0.431 ' HD2' ' O ' ' D' ' 11' ' ' MET . 0.0 OUTLIER -64.57 -33.14 75.21 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 118.99 2.959 . . . . 0.0 118.99 169.719 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -72.51 -12.88 61.26 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 119.089 -2.257 . . . . 0.0 113.228 166.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -94.09 -32.54 13.73 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 118.894 2.924 . . . . 0.0 118.894 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -67.62 -26.55 66.3 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 111.248 -2.705 . . . . 0.0 109.019 169.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 8.2 t-105 -74.04 -53.44 10.0 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 123.727 1.727 . . . . 0.0 110.97 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.92 -15.64 44.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 117.926 -2.983 . . . . 0.0 112.764 173.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -75.46 -23.83 56.93 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 120.256 1.389 . . . . 0.0 113.99 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -78.51 -35.05 46.87 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.748 2.019 . . . . 0.0 109.328 174.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 91.9 t -62.2 -47.23 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 O-C-N 124.209 0.943 . . . . 0.0 109.174 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -70.87 -40.11 72.49 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.574 1.15 . . . . 0.0 112.468 174.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 20.7 tp -50.92 -45.11 60.27 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 121.129 1.786 . . . . 0.0 113.255 168.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 56.6 tp -73.87 -38.06 64.55 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 123.445 1.593 . . . . 0.0 115.187 -176.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 27' ' ' LYS . . . . . 0.46 ' HA ' ' CD2' ' D' ' 30' ' ' TYR . 27.9 ttpt -61.84 -49.29 76.86 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 120.358 -1.464 . . . . 0.0 108.163 169.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -58.84 -22.08 58.17 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.931 -2.981 . . . . 0.0 117.557 171.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 29' ' ' ALA . . . . . 0.42 ' HA ' ' OD1' ' D' ' 32' ' ' ASN . . . -85.81 -26.43 25.74 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 120.27 -1.519 . . . . 0.0 112.455 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 30' ' ' TYR . . . . . 0.46 ' CD2' ' HA ' ' D' ' 27' ' ' LYS . 16.7 m-30 -56.69 -45.42 81.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 118.941 -2.35 . . . . 0.0 110.442 166.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -73.16 -25.59 60.86 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.886 2.074 . . . . 0.0 108.069 -163.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 32' ' ' ASN . . . . . 0.42 ' OD1' ' HA ' ' D' ' 29' ' ' ALA . 43.2 p30 -115.22 5.35 14.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.211 1.804 . . . . 0.0 114.963 174.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 57.61 28.45 15.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 -178.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 15.3 mt -83.59 1.43 42.19 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.234 2.214 . . . . 0.0 112.067 164.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -60.08 3.73 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 118.212 2.671 . . . . 0.0 118.212 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 9.0 mt -57.37 -54.31 56.27 Favored Pre-proline 0 N--CA 1.451 -0.412 0 CA-C-O 114.396 -2.716 . . . . 0.0 109.677 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -43.68 -46.24 10.42 Favored 'Trans proline' 0 N--CA 1.447 -1.238 0 CA-C-N 124.696 2.713 . . . . 0.0 115.393 159.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 22.5 tp -74.44 -39.09 62.8 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 116.379 -3.951 . . . . 0.0 114.744 -176.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 39' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' D' ' 39' ' ' LEU . 42.4 mt -59.7 -48.44 81.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.18 -2.2 . . . . 0.0 107.185 166.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 33.0 m-20 -63.43 -31.57 72.76 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 121.393 1.906 . . . . 0.0 114.516 -178.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 31.4 tp -71.15 -41.78 69.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 116.175 -1.869 . . . . 0.0 106.601 172.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 8.0 mmm -83.47 -23.3 32.26 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -170.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 29.5 mt -127.45 141.74 51.59 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 104.69 -2.337 . . . . 0.0 104.69 -173.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 71.7 p -60.22 158.05 29.88 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-O 114.745 -2.55 . . . . 0.0 116.82 171.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -48.15 -50.52 11.82 Favored 'Trans proline' 0 N--CA 1.447 -1.237 1 C-N-CA 126.684 4.923 . . . . 0.0 114.386 170.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -71.82 -17.83 62.13 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 117.738 2.496 . . . . 0.0 117.738 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -73.15 -42.14 63.16 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.412 163.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -61.18 -41.89 97.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 126.815 2.046 . . . . 0.0 108.02 175.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -66.07 -38.75 89.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.528 1.131 . . . . 0.0 110.927 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.59 -33.94 23.27 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.776 2.031 . . . . 0.0 112.911 -177.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 84.0 mt -58.65 -43.54 89.84 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.065 -2.397 . . . . 0.0 116.183 160.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.7 -34.44 70.41 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-N 121.102 1.774 . . . . 0.0 113.691 170.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 17.8 m -77.07 -38.14 53.12 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 122.335 1.064 . . . . 0.0 112.929 -177.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -61.54 -31.17 71.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 112.444 -3.646 . . . . 0.0 110.852 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.71 -49.94 70.95 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 CA-C-N 123.702 2.956 . . . . 0.0 112.515 170.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.307 9.4 ptm180 -65.64 -22.18 66.63 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 118.267 2.691 . . . . 0.0 118.267 169.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 10.2 mt -70.93 -42.49 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 124.194 3.179 . . . . 0.0 112.484 171.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 3.2 t -61.9 -48.12 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 128.163 3.415 . . . . 0.0 111.724 169.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -63.06 -38.82 92.73 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.313 -2.742 . . . . 0.0 108.976 -174.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 60' ' ' GLU . . . . . 0.425 ' HA ' ' HB3' ' D' ' 63' ' ' ARG . 75.5 mm-40 -75.14 -26.9 59.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 115.679 -2.105 . . . . 0.0 112.305 174.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 63.4 mt -68.73 -23.62 64.36 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 116.734 -1.603 . . . . 0.0 110.389 174.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 29.8 mt -84.09 -38.72 20.43 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 170.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 63' ' ' ARG . . . . . 0.425 ' HB3' ' HA ' ' D' ' 60' ' ' GLU . 40.1 ttm180 -69.64 -29.32 66.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 127.327 2.892 . . . . 0.0 114.455 175.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.42 36.99 92.5 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-O 115.727 -2.707 . . . . 0.0 113.481 158.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -111.63 -25.17 9.67 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 114.774 -2.536 . . . . 0.0 110.157 173.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . 0.256 33.6 mtm -89.23 30.84 0.93 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 169.134 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 77.7 p -85.36 172.83 10.77 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 119.47 -2.019 . . . . 0.0 111.022 -163.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.268 5.5 tp60 65.15 -17.64 0.09 Allowed 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 116.598 -3.814 . . . . 0.0 119.305 169.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 35.0 ttt85 -146.96 -59.85 0.28 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 129.995 3.318 . . . . 0.0 116.169 176.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -84.38 -35.86 22.87 Favored 'General case' 0 N--CA 1.446 -0.644 1 O-C-N 115.47 -4.519 . . . . 0.0 114.16 -152.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.72 -41.99 15.96 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 116.369 -3.957 . . . . 0.0 116.05 178.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt -61.14 -38.91 88.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 112.822 -1.99 . . . . 0.0 108.997 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -84.2 -20.56 32.12 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 126.49 2.369 . . . . 0.0 114.233 -176.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -97.3 -38.88 9.49 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 127.963 2.505 . . . . 0.0 110.986 -173.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -120.9 -16.91 8.02 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 85.47 -171.23 45.4 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-O 123.707 1.726 . . . . 0.0 116.746 165.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.254 . . -43.43 -16.69 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.88 -20.47 68.6 Favored Glycine 0 C--N 1.335 0.522 0 CA-C-N 122.585 2.448 . . . . 0.0 112.537 171.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 5.0 tt -46.05 -18.06 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 C-N-CA 126.498 1.919 . . . . 0.0 114.959 168.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -103.99 -21.9 13.54 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 117.866 -1.534 . . . . 0.0 112.65 -178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 17.7 m -66.72 -39.4 87.99 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.375 1.47 . . . . 0.0 109.816 165.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 8.5 mm -87.06 -18.18 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 O-C-N 117.755 -3.09 . . . . 0.0 114.444 -172.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 31.0 p -109.25 -24.89 10.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 120.99 3.7 . . . . 0.0 120.99 168.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.8 mtp85 -83.84 162.42 20.57 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.894 -3.004 . . . . 0.0 110.827 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.31 154.73 30.95 Favored Glycine 0 N--CA 1.446 -0.66 0 O-C-N 127.247 2.842 . . . . 0.0 112.275 -177.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 24.6 m -74.38 -7.2 52.08 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 115.847 -2.025 . . . . 0.0 114.943 -168.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . 0.276 18.2 m-80 -134.36 33.38 3.31 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 123.606 2.912 . . . . 0.0 105.963 -171.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 59.9 p -77.28 -175.5 3.72 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.415 2.746 . . . . 0.0 118.415 175.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 29.7 tp -56.24 -32.12 64.19 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 118.389 -2.695 . . . . 0.0 113.951 165.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -74.46 -16.92 60.84 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.161 0.584 . . . . 0.0 110.569 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -104.49 -15.24 15.42 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 113.634 -3.079 . . . . 0.0 113.372 -166.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 92' ' ' ALA . . . . . 0.478 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 45.07 87.19 0.12 Allowed Pre-proline 0 N--CA 1.449 -0.513 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 165.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 93' ' ' PRO . . . . . 0.478 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 50.7 Cg_exo 34.19 42.24 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.168 0 C-N-CA 122.447 -1.897 . . . . 0.0 115.861 36.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 94' ' ' VAL . . . . . 0.45 HG22 ' HB1' ' D' ' 92' ' ' ALA . 0.2 OUTLIER -72.73 15.19 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 111.062 -2.79 . . . . 0.0 110.743 -170.68 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 95' ' ' GLU . . . . . 0.442 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -144.25 -30.0 0.48 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -169.066 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 58.8 tp -50.82 -55.38 17.15 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.663 157.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . 0.31 24.2 ptt180 -59.3 -37.19 77.09 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 112.685 -3.531 . . . . 0.0 112.512 -176.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -71.16 -23.52 62.08 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.455 2.302 . . . . 0.0 110.72 176.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . 0.255 79.3 t90 -87.28 -42.48 12.89 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.709 1.204 . . . . 0.0 111.398 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 51.6 mt -59.76 -55.02 39.49 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 129.454 3.102 . . . . 0.0 106.432 169.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -44.47 -31.36 1.07 Allowed 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 173.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -89.49 -29.34 19.04 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 69.5 t -91.15 -22.83 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 O-C-N 121.316 -0.865 . . . . 0.0 110.729 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 65.9 mt -102.84 -27.67 12.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 119.915 -1.741 . . . . 0.0 112.308 -172.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 28.5 mt -101.78 12.01 37.78 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -62.2 152.16 34.03 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 127.478 2.986 . . . . 0.0 109.77 -171.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 47.8 m -66.38 -27.3 67.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 117.751 2.5 . . . . 0.0 117.751 -168.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . 0.255 0.6 OUTLIER . . . . . 0 C--O 1.25 1.099 0 O-C-N 126.899 2.625 . . . . 0.0 116.256 169.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.96 -28.78 69.16 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 116.587 2.069 . . . . 0.0 116.587 -163.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -77.89 -44.21 27.78 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 125.853 1.971 . . . . 0.0 112.257 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . 0.25 55.0 tt0 -79.33 -20.73 47.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.448 -178.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.7 p -57.54 172.67 0.4 Allowed Pre-proline 0 N--CA 1.45 -0.428 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 171.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -64.91 -32.22 55.3 Favored 'Trans proline' 0 N--CA 1.449 -1.113 0 N-CA-C 119.929 3.011 . . . . 0.0 119.929 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -156.05 127.71 7.3 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 176.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.0 t -85.66 95.73 9.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.802 -0.561 . . . . 0.0 110.738 172.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.69 90.61 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.499 -1.239 . . . . 0.0 111.294 160.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.01 -38.57 86.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 120.602 1.546 . . . . 0.0 112.7 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.4 ttp -81.07 -24.92 37.45 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 121.433 1.924 . . . . 0.0 112.344 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.87 -25.5 60.07 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 124.617 2.151 . . . . 0.0 116.691 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -64.91 -30.41 71.4 Favored 'General case' 0 N--CA 1.445 -0.698 0 O-C-N 120.07 -1.644 . . . . 0.0 113.337 165.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -80.65 -38.69 28.68 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 118.563 -1.255 . . . . 0.0 108.232 -170.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.7 mmt-85 -62.11 -25.03 67.48 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 125.8 1.938 . . . . 0.0 114.839 176.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.0 t60 -61.52 -46.64 89.12 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 117.836 2.532 . . . . 0.0 117.836 171.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -68.93 -26.09 64.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 171.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -72.13 -48.79 41.09 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.462 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG . 20.2 t-105 -60.91 -45.59 94.03 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.31 1.844 . . . . 0.0 112.22 172.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.52 -18.94 62.95 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 177.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -69.45 -29.09 66.7 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 119.003 0.819 . . . . 0.0 110.205 170.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -62.1 -46.28 89.79 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 120.315 -1.491 . . . . 0.0 112.092 165.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.8 t -84.46 -0.21 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 115.6 1.704 . . . . 0.0 115.6 -170.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -96.52 -39.07 9.73 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 113.894 -1.503 . . . . 0.0 109.485 164.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 66.0 tp -60.68 -34.52 74.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 127.121 2.168 . . . . 0.0 108.382 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.6 tp -85.18 -22.87 28.58 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 126.8 2.563 . . . . 0.0 109.741 -169.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -79.62 -31.53 41.68 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 121.399 -0.813 . . . . 0.0 112.013 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . 0.256 25.9 m-20 -82.17 -22.27 36.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 118.683 -2.511 . . . . 0.0 111.153 175.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.76 -43.54 92.94 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 169.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -55.47 -46.51 76.84 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 123.684 1.707 . . . . 0.0 111.391 172.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -66.31 -24.86 66.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.562 1.945 . . . . 0.0 112.806 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -104.96 11.13 33.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 113.855 -2.974 . . . . 0.0 114.209 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.417 1.8 m-20 61.03 22.38 12.64 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 125.64 1.838 . . . . 0.0 112.144 174.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.3 mt -109.88 4.15 21.32 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.365 1.866 . . . . 0.0 112.837 177.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -49.53 -43.55 45.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 -179.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 36' ' ' LEU 0.391 80.1 mt -58.13 -60.49 9.95 Favored Pre-proline 0 N--CA 1.45 -0.46 0 N-CA-C 116.314 1.968 . . . . 0.0 116.314 172.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . 0.269 27.2 Cg_endo -60.21 -39.97 63.75 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 117.225 -1.383 . . . . 0.0 112.704 -176.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 tp -55.29 -40.33 70.92 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.488 -2.633 . . . . 0.0 115.846 172.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 85.5 mt -75.12 -35.13 61.74 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.766 0.826 . . . . 0.0 109.036 178.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -62.74 -40.5 97.42 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 123.521 0.513 . . . . 0.0 111.052 176.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.9 tp -68.25 -30.39 69.41 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 115.674 -2.108 . . . . 0.0 114.088 174.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 85.3 mmm -97.64 -22.15 16.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 123.494 2.861 . . . . 0.0 112.372 -168.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mp -134.13 150.13 51.11 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 126.091 1.757 . . . . 0.0 109.661 -176.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.445 ' HB ' ' HD2' ' A' ' 45' ' ' PRO . 64.3 p -81.57 163.34 54.69 Favored Pre-proline 0 N--CA 1.451 -0.401 0 C-N-CA 126.704 2.002 . . . . 0.0 111.724 173.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.445 ' HD2' ' HB ' ' A' ' 44' ' ' THR . 24.7 Cg_endo -64.15 -32.45 63.31 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 CA-C-N 119.509 0.86 . . . . 0.0 111.998 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.19 -35.32 77.81 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 115.645 -2.121 . . . . 0.0 110.432 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.21 -24.07 60.47 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 122.955 2.616 . . . . 0.0 114.18 174.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.0 mtm-85 -84.98 -35.31 22.07 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 126.014 2.071 . . . . 0.0 115.204 171.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.3 -39.14 82.08 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.404 1.882 . . . . 0.0 110.316 170.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.47 83.86 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 130.565 3.546 . . . . 0.0 113.486 174.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.2 mt -72.33 -36.47 68.85 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 118.017 -2.927 . . . . 0.0 107.143 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.03 -51.39 54.14 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 174.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.25 8.8 m -62.99 -30.82 71.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 128.889 2.876 . . . . 0.0 113.143 175.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.7 mtt180 -80.88 -32.79 34.75 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 117.715 -1.594 . . . . 0.0 108.373 -168.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.447 ' HA ' ' HE1' ' B' ' 42' ' ' MET . 83.8 t -45.43 -46.4 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-O 115.16 -2.353 . . . . 0.0 114.738 154.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -79.51 -27.98 41.41 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.448 2.386 . . . . 0.0 108.657 -169.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.6 mt -63.53 -55.21 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 C-N-CA 125.27 1.428 . . . . 0.0 110.49 166.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.1 t -61.72 -35.16 65.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 117.019 -1.872 . . . . 0.0 113.514 -173.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . 0.256 28.8 tt0 -46.6 -60.09 2.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 118.137 -2.852 . . . . 0.0 113.136 166.04 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -58.82 -29.33 66.8 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 175.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 42.3 mt -76.09 -28.75 57.68 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 118.701 -1.2 . . . . 0.0 112.427 173.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.3 mt -74.28 -31.32 62.47 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 119.117 -2.239 . . . . 0.0 113.196 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 43.3 ttm105 -71.95 -41.48 67.73 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 129.805 3.242 . . . . 0.0 112.918 173.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.54 35.15 21.56 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 120.065 2.786 . . . . 0.0 120.065 -174.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -98.2 -37.43 9.7 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 119.863 1.831 . . . . 0.0 113.096 168.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 42.5 mtt -75.28 127.19 32.6 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 118.939 -1.105 . . . . 0.0 109.568 -177.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 54.0 p -47.94 165.75 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 127.227 2.211 . . . . 0.0 114.59 151.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -68.58 -33.65 74.43 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 127.407 2.283 . . . . 0.0 109.63 170.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.3 tpt85 -55.3 -54.35 44.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.248 1.019 . . . . 0.0 111.247 168.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -58.49 -48.58 80.34 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 175.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.5 mt -54.53 -29.09 49.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 115.463 1.653 . . . . 0.0 115.463 171.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -77.52 -50.03 13.48 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 118.305 -2.747 . . . . 0.0 109.084 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -64.18 -41.82 96.94 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 119.606 3.187 . . . . 0.0 119.606 172.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -81.06 -42.24 21.34 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 125.539 2.59 . . . . 0.0 114.072 -171.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.8 mt -120.9 -5.41 9.6 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 117.984 -2.948 . . . . 0.0 114.12 -172.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 82.32 -12.18 46.5 Favored Glycine 0 CA--C 1.523 0.577 0 O-C-N 116.664 -3.772 . . . . 0.0 115.686 175.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.45 ' HB1' HG12 ' A' ' 82' ' ' ILE . . . -71.55 120.69 17.49 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 125.498 1.352 . . . . 0.0 111.242 -174.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.8 -172.26 41.33 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-N 113.407 -1.724 . . . . 0.0 115.815 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.7 mt -55.37 -46.86 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-O 114.395 -2.717 . . . . 0.0 110.427 165.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.12 86.7 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 122.091 2.223 . . . . 0.0 115.228 -171.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 62.5 p -94.19 -25.57 17.03 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 124.003 1.859 . . . . 0.0 115.957 -174.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.45 HG12 ' HB1' ' A' ' 77' ' ' ALA . 31.1 mm -74.28 -34.2 36.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 O-C-N 118.446 -2.659 . . . . 0.0 107.717 171.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.1 m -62.39 -52.78 62.21 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 121.889 2.132 . . . . 0.0 109.071 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.6 ttt180 -63.17 -57.92 8.94 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 117.706 -1.14 . . . . 0.0 109.688 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.09 -31.42 4.38 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-O 123.19 1.439 . . . . 0.0 116.244 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.2 m -69.33 -50.79 43.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 119.998 -1.883 . . . . 0.0 111.108 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -56.82 -39.6 74.47 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 119.927 -1.733 . . . . 0.0 114.378 175.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.4 m -72.17 -41.32 67.17 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 115.018 -2.42 . . . . 0.0 112.263 176.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.7 tt -67.21 -40.91 86.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 122.844 2.566 . . . . 0.0 114.374 173.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -67.6 -23.3 65.36 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 118.121 2.637 . . . . 0.0 118.121 177.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.47 -13.66 25.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.848 1.659 . . . . 0.0 113.467 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.97 154.25 92.77 Favored Pre-proline 0 N--CA 1.452 -0.348 0 O-C-N 118.941 -2.349 . . . . 0.0 111.223 -177.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -64.99 141.52 70.9 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 125.008 3.805 . . . . 0.0 113.36 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.8 m -54.4 -32.04 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 O-C-N 126.877 2.611 . . . . 0.0 113.687 -177.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.5 pm0 -75.53 -22.91 56.69 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.559 -1.655 . . . . 0.0 113.739 -177.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 20.1 tp -76.76 -42.15 42.05 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 119.033 -2.292 . . . . 0.0 106.475 174.158 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . 0.331 22.9 mtm180 -67.76 -54.94 15.22 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 123.714 1.721 . . . . 0.0 114.415 -164.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -59.29 -13.96 9.7 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 129.983 3.313 . . . . 0.0 115.026 169.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 37.4 t90 -96.47 -28.49 14.4 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 115.092 -2.385 . . . . 0.0 109.675 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 84.9 mt -77.99 -35.79 49.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 123.834 3.015 . . . . 0.0 113.916 173.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.08 -30.5 71.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 116.551 -2.059 . . . . 0.0 115.305 170.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -65.79 -55.02 19.39 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 118.282 2.697 . . . . 0.0 118.282 162.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 84.9 t -80.83 -26.74 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 O-C-N 120.477 -1.389 . . . . 0.0 110.203 -167.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.9 mt -96.59 -32.53 12.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -175.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 44.2 mt -98.59 -11.27 22.31 Favored 'General case' 0 N--CA 1.446 -0.658 0 O-C-N 117.785 -3.072 . . . . 0.0 114.36 -171.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -98.18 42.22 1.1 Allowed 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 124.089 0.868 . . . . 0.0 112.182 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.0 m -119.73 -42.1 2.64 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 175.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 . . . . . 0 C--O 1.253 1.253 0 O-C-N 127.646 3.091 . . . . 0.0 113.136 179.258 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 27.7 ttp . . . . . 0 N--CA 1.469 0.508 0 CA-C-O 119.327 -0.368 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.48 -20.93 64.63 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 114.738 1.385 . . . . 0.0 114.738 -154.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -96.84 -22.27 17.02 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 120.844 1.657 . . . . 0.0 112.277 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -71.4 -34.47 70.39 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 126.216 1.806 . . . . 0.0 113.946 164.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 28.8 m -60.57 146.32 85.65 Favored Pre-proline 0 N--CA 1.446 -0.646 0 CA-C-O 116.803 -1.57 . . . . 0.0 112.302 177.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -71.0 -31.65 14.67 Favored 'Trans proline' 0 N--CA 1.449 -1.145 0 O-C-N 124.169 1.615 . . . . 0.0 113.654 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -144.98 159.99 42.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 127.539 2.336 . . . . 0.0 112.691 177.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 10.9 t -144.49 117.41 8.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 121.275 1.852 . . . . 0.0 112.433 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.77 87.22 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 129.072 2.949 . . . . 0.0 111.475 -170.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.99 -50.85 72.53 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 128.466 2.706 . . . . 0.0 110.771 176.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 12.3 ttm -70.86 -32.79 69.92 Favored 'General case' 0 N--CA 1.45 -0.448 1 O-C-N 116.047 -4.158 . . . . 0.0 108.654 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.56 -37.99 80.39 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.738 1.732 . . . . 0.0 111.825 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -61.76 -53.37 56.91 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.247 -2.158 . . . . 0.0 109.45 175.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -55.56 -20.37 13.11 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 117.497 2.406 . . . . 0.0 117.497 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 14.1 mmm180 -84.38 -33.51 23.79 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 170.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -66.35 -34.07 77.15 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 115.439 -2.22 . . . . 0.0 112.764 166.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -79.59 -27.52 41.1 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 115.808 -2.044 . . . . 0.0 109.838 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -65.29 -30.29 71.14 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 120.929 1.695 . . . . 0.0 114.96 164.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 18.6 t-105 -74.84 -45.68 41.6 Favored 'General case' 0 N--CA 1.445 -0.685 1 O-C-N 114.806 -4.934 . . . . 0.0 112.903 173.354 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 8.9 mt -60.72 -23.36 64.85 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 113.15 -3.309 . . . . 0.0 114.038 166.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 53.6 ttt180 -72.31 -34.37 68.07 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 125.325 3.693 . . . . 0.0 111.55 173.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -55.82 -50.69 69.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 119.649 1.113 . . . . 0.0 112.416 167.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 87.3 t -74.08 -33.58 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 O-C-N 127.159 2.787 . . . . 0.0 108.874 -171.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.82 -45.76 93.18 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 119.878 -1.764 . . . . 0.0 115.384 167.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 23.0 tp -62.75 -46.75 86.59 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.14 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 59.7 tp -69.32 -25.7 64.35 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 118.353 -2.717 . . . . 0.0 117.178 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -59.02 -61.28 2.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 118.265 -2.772 . . . . 0.0 110.011 162.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -60.32 -29.52 68.92 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.179 -3.451 . . . . 0.0 111.82 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.67 -32.28 69.49 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 130.766 3.626 . . . . 0.0 115.034 175.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -66.05 -52.46 48.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.962 1.305 . . . . 0.0 110.653 172.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -50.57 -43.38 56.35 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 115.94 -1.981 . . . . 0.0 115.511 167.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -91.18 3.68 54.2 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 130.27 3.428 . . . . 0.0 108.775 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.365 6.1 m-20 62.57 21.06 12.42 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 118.922 2.934 . . . . 0.0 118.922 -177.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -104.11 12.68 33.67 Favored 'General case' 0 N--CA 1.446 -0.636 1 O-C-N 114.46 -5.15 . . . . 0.0 114.651 -175.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 11.5 p-80 -57.86 -49.13 77.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 128.001 2.52 . . . . 0.0 116.151 -170.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 15.6 mt -66.21 -39.44 28.09 Favored Pre-proline 0 N--CA 1.449 -0.494 0 C-N-CA 126.881 2.072 . . . . 0.0 116.418 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.301 26.5 Cg_exo -59.03 -45.34 28.72 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 N-CA-C 115.193 1.19 . . . . 0.0 115.193 164.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 29.5 tp -56.62 -54.09 50.1 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 119.963 -1.711 . . . . 0.0 112.166 176.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 63.1 mt -54.58 -34.76 62.46 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 119.524 -1.985 . . . . 0.0 113.537 170.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -71.27 -29.44 65.08 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 117.796 -1.097 . . . . 0.0 110.685 173.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . 0.408 16.1 tp -75.04 -43.42 53.59 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 116.238 -1.839 . . . . 0.0 114.544 174.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' MET . . . . . 0.447 ' HE1' ' HA ' ' A' ' 55' ' ' VAL . 19.5 mmt -94.84 -20.92 19.04 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 125.283 1.614 . . . . 0.0 112.272 -168.259 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -114.28 133.93 55.3 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 121.077 1.762 . . . . 0.0 111.122 173.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 73.2 p -72.98 152.95 90.93 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 122.038 2.199 . . . . 0.0 110.971 170.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 99.4 Cg_exo -28.3 -54.87 0.14 Allowed 'Trans proline' 0 N--CA 1.449 -1.105 1 C-N-CA 126.325 4.683 . . . . 0.0 112.559 166.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -62.3 -43.02 99.79 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 127.627 3.08 . . . . 0.0 115.847 -175.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -64.19 -39.23 93.56 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 119.611 3.189 . . . . 0.0 119.611 166.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' ARG . . . . . 0.462 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 37.8 mtm-85 -61.42 -40.34 94.05 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 115.006 -2.426 . . . . 0.0 107.209 169.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -66.5 -31.36 72.05 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 124.25 3.205 . . . . 0.0 113.151 175.116 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.2 -47.55 82.12 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 118.38 -2.7 . . . . 0.0 114.323 168.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.12 -37.57 83.28 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 120.007 3.336 . . . . 0.0 120.007 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.09 -18.76 76.72 Favored Glycine 0 C--N 1.34 0.767 0 C-N-CA 117.705 -2.188 . . . . 0.0 112.009 176.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -85.06 -36.31 21.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 119.243 -2.328 . . . . 0.0 109.82 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 85.9 mtt180 -60.3 -25.9 66.11 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.327 1.451 . . . . 0.0 114.216 171.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . 0.319 16.6 t -59.37 -56.96 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 C-N-CA 126.085 1.754 . . . . 0.0 111.025 164.113 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -72.25 -32.49 66.73 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 120.369 1.44 . . . . 0.0 112.422 -176.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 9.1 mt -59.6 -56.14 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 121.221 1.828 . . . . 0.0 113.214 162.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.261 29.6 t -66.7 -36.24 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 O-C-N 117.818 -3.051 . . . . 0.0 112.759 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -45.19 -59.49 2.61 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 128.972 2.909 . . . . 0.0 112.248 159.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -69.2 -21.07 63.98 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 119.024 -2.297 . . . . 0.0 114.852 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 12.2 mt -67.03 -19.03 65.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 116.705 -3.747 . . . . 0.0 110.468 167.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mt -96.02 -40.56 9.2 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 122.694 2.497 . . . . 0.0 109.874 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 27.6 ttm180 -58.79 -59.24 5.75 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 125.006 1.441 . . . . 0.0 113.25 174.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.49 48.48 23.4 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 115.983 -3.008 . . . . 0.0 115.347 -179.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -126.49 -27.71 3.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 126.568 1.981 . . . . 0.0 114.371 -178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 16.9 mtt -62.77 141.52 58.56 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 115.44 1.645 . . . . 0.0 115.44 177.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.7 p -72.65 157.97 36.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 162.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -64.29 -16.12 61.54 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 115.719 -2.086 . . . . 0.0 113.894 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -67.3 -48.48 67.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.708 1.203 . . . . 0.0 113.788 166.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -67.43 -34.06 76.44 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 128.506 2.723 . . . . 0.0 110.314 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.541 HD22 HD11 ' B' ' 82' ' ' ILE 0.252 79.4 mt -61.07 -55.14 36.07 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 123.501 1.62 . . . . 0.0 112.194 175.517 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -63.73 -44.79 92.52 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 119.844 -1.785 . . . . 0.0 110.56 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -97.23 -24.65 15.6 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 116.356 -1.783 . . . . 0.0 113.402 -160.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -117.1 -35.39 4.09 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 116.826 -1.95 . . . . 0.0 112.373 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 45.0 mt -92.43 -7.3 47.97 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 129.018 2.927 . . . . 0.0 115.38 177.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 55.31 41.17 78.85 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-O 118.893 -0.948 . . . . 0.0 115.156 -176.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.28 101.37 7.93 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 117.003 -1.475 . . . . 0.0 111.599 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.8 171.28 30.99 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 119.966 2.746 . . . . 0.0 119.966 161.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . 0.251 55.0 mt -40.9 -41.33 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 175.237 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . 0.334 . . -58.73 -37.87 77.12 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.639 1.175 . . . . 0.0 113.136 176.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.2 m -79.76 -35.01 39.32 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 120.785 -1.197 . . . . 0.0 113.161 178.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 82' ' ' ILE . . . . . 0.541 HD11 HD22 ' B' ' 71' ' ' LEU . 16.3 mm -70.76 -39.66 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-O 118.011 -0.995 . . . . 0.0 109.943 174.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 93.1 m -59.68 -59.18 5.85 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.715 2.406 . . . . 0.0 112.41 171.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -70.91 -33.53 70.63 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -173.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.25 -34.52 85.92 Favored Glycine 0 CA--C 1.524 0.649 0 O-C-N 116.68 -3.762 . . . . 0.0 115.116 169.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 75.1 m -76.16 -34.39 59.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -67.52 -27.58 67.1 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 119.478 -2.014 . . . . 0.0 112.135 172.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 22.4 m -76.64 -32.91 58.3 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 126.842 2.057 . . . . 0.0 113.593 176.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.4 mt -65.4 -48.62 72.23 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 116.54 -1.695 . . . . 0.0 112.991 168.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -71.27 -25.98 62.69 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 126.987 2.68 . . . . 0.0 112.874 -178.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . 0.367 . . -84.47 4.62 30.88 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 116.943 -3.598 . . . . 0.0 114.969 170.166 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.53 167.47 29.88 Favored Pre-proline 0 N--CA 1.448 -0.555 0 CA-C-N 119.595 1.089 . . . . 0.0 113.77 166.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -74.21 155.54 46.79 Favored 'Trans proline' 0 N--CA 1.448 -1.191 0 N-CA-C 117.068 1.911 . . . . 0.0 117.068 169.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 m -61.58 -39.55 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 115.918 -1.991 . . . . 0.0 115.15 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 12.3 pm0 -66.78 -25.33 66.42 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 126.27 2.231 . . . . 0.0 110.636 173.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.5 tp -73.51 -39.76 64.57 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.408 -3.308 . . . . 0.0 111.458 174.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 89.5 mtm-85 -68.12 -33.2 74.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 114.029 -2.891 . . . . 0.0 115.163 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -66.05 -30.25 70.75 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 128.371 3.544 . . . . 0.0 105.593 168.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -84.69 -45.74 12.16 Favored 'General case' 0 N--CA 1.45 -0.465 1 O-C-N 115.882 -4.262 . . . . 0.0 105.63 -169.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 22.4 mt -70.8 -35.82 72.7 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 124.96 1.412 . . . . 0.0 114.661 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -61.85 -17.65 57.18 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 170.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -102.92 -19.77 14.5 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 177.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 92.6 t -95.02 -38.91 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 CA-C-O 124.115 1.912 . . . . 0.0 112.754 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 6.6 mt -86.74 -68.33 0.75 Allowed 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 117.768 -3.083 . . . . 0.0 111.13 -174.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 79.9 mt -64.01 -33.61 76.14 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 126.888 3.233 . . . . 0.0 113.459 -165.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -55.17 -17.23 3.96 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.11 2.964 . . . . 0.0 114.175 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 3.4 m -71.47 -20.75 62.04 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 170.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.695 2.798 . . . . 0.0 113.266 171.105 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.47 0.539 0 N-CA-C 104.908 -2.256 . . . . 0.0 104.908 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -51.26 134.65 27.46 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 124.783 2.23 . . . . 0.0 114.751 -175.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -109.11 148.72 30.4 Favored 'General case' 0 N--CA 1.445 -0.724 1 N-CA-C 121.97 4.063 . . . . 0.0 121.97 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -165.13 152.53 11.01 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 121.166 1.803 . . . . 0.0 109.062 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 12.6 p -152.71 162.67 25.83 Favored Pre-proline 0 N--CA 1.448 -0.55 0 C-N-CA 128.176 2.59 . . . . 0.0 108.896 164.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -47.73 -25.25 5.55 Favored 'Trans proline' 0 N--CA 1.449 -1.091 1 N-CA-C 124.069 4.603 . . . . 0.0 124.069 -158.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -142.81 160.72 39.79 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.288 178.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 13.6 t -157.32 125.94 5.7 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 127.095 2.158 . . . . 0.0 110.297 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.39 -27.73 59.2 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 119.412 -2.055 . . . . 0.0 112.697 175.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.15 -36.54 83.39 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 -170.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 34.0 mtt -77.82 -31.25 51.56 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 117.534 -3.229 . . . . 0.0 115.539 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.76 95.16 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.811 1.244 . . . . 0.0 112.248 174.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 tp10 -72.54 -29.46 63.59 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 126.648 2.468 . . . . 0.0 111.54 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . 0.301 50.9 tt0 -72.26 -36.01 68.92 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.652 0.739 . . . . 0.0 111.991 164.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -31.53 71.74 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 118.061 -2.9 . . . . 0.0 114.88 177.089 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -64.58 -51.43 62.76 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.417 2.287 . . . . 0.0 112.869 170.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.376 80.8 mm-40 -55.97 -42.53 76.43 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 114.877 -2.487 . . . . 0.0 112.621 170.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 68.2 mt-10 -66.74 -52.47 44.0 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 125.777 1.923 . . . . 0.0 112.44 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -55.93 -37.75 69.38 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 170.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.66 -29.64 68.98 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 117.849 -3.032 . . . . 0.0 115.165 167.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 37.5 ttt-85 -71.74 -27.26 62.87 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 127.126 2.766 . . . . 0.0 109.548 170.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -66.62 -54.13 26.71 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.894 -2.379 . . . . 0.0 111.397 171.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 88.7 t -57.7 -39.64 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 123.618 1.675 . . . . 0.0 112.429 -174.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -61.13 -58.5 8.11 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.712 2.005 . . . . 0.0 108.215 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 58.8 tp -50.78 -39.37 52.36 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 129.768 3.227 . . . . 0.0 112.321 175.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 26' ' ' LEU . . . . . 0.476 HD11 HD21 ' C' ' 39' ' ' LEU . 46.6 tp -68.03 -50.04 57.77 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.726 2.41 . . . . 0.0 105.602 179.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -70.95 -29.39 65.4 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 120.23 -1.544 . . . . 0.0 114.868 -175.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -63.49 -32.09 73.44 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.848 -1.549 . . . . 0.0 113.85 166.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.99 -23.35 60.63 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.78 1.632 . . . . 0.0 112.852 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -69.88 -11.21 60.7 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 116.699 -3.75 . . . . 0.0 117.205 171.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -87.54 -25.61 23.56 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 128.955 2.902 . . . . 0.0 111.812 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -124.74 17.71 8.71 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 124.144 3.156 . . . . 0.0 111.44 -178.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 61.23 31.18 19.5 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 116.135 -1.888 . . . . 0.0 114.629 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 mt -103.36 13.99 32.48 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 175.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -78.39 -26.82 46.64 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 -170.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.4 83.8 mt -69.42 -48.11 25.63 Favored Pre-proline 0 N--CA 1.448 -0.553 0 O-C-N 126.691 2.494 . . . . 0.0 114.772 168.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -55.51 -38.96 93.55 Favored 'Trans proline' 0 N--CA 1.447 -1.261 1 C-N-CA 127.576 5.518 . . . . 0.0 111.995 171.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 40.2 tp -77.35 -37.64 51.92 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 119.524 -1.985 . . . . 0.0 112.323 -176.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 39' ' ' LEU . . . . . 0.476 HD21 HD11 ' C' ' 26' ' ' LEU . 34.2 mt -74.42 -31.29 62.26 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 122.19 2.268 . . . . 0.0 107.344 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -70.16 -35.6 74.13 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 167.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 30.5 tp -63.52 -43.72 96.34 Favored 'General case' 0 N--CA 1.448 -0.543 1 O-C-N 115.969 -4.207 . . . . 0.0 111.136 170.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 12.9 mmt -74.01 -49.93 22.12 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.931 2.892 . . . . 0.0 116.374 -174.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.7 mp -106.5 130.0 54.36 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 129.948 3.299 . . . . 0.0 112.276 -176.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 71.0 p -56.35 153.45 19.65 Favored Pre-proline 0 N--CA 1.448 -0.555 0 O-C-N 127.241 2.838 . . . . 0.0 117.867 157.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . 0.271 13.5 Cg_exo -49.92 -39.96 49.18 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 C-N-CA 115.803 -2.331 . . . . 0.0 115.418 171.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.95 -31.6 71.15 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.706 1.602 . . . . 0.0 114.979 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -77.42 -30.94 53.73 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 113.666 -3.064 . . . . 0.0 111.429 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 46.4 mtm-85 -81.33 -27.68 34.85 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 126.478 2.361 . . . . 0.0 111.859 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -68.63 -43.38 76.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 119.261 -2.15 . . . . 0.0 113.199 163.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.29 86.5 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 116.845 -1.55 . . . . 0.0 112.5 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 19.4 mt -78.37 -25.66 46.36 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 117.876 2.547 . . . . 0.0 117.876 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.18 -35.72 70.74 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 119.07 -1.538 . . . . 0.0 114.157 169.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 7.0 m -54.55 -49.09 71.15 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 118.528 -2.748 . . . . 0.0 114.966 163.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -58.14 -24.14 57.76 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 126.014 2.071 . . . . 0.0 113.322 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 40.6 t -71.72 -37.27 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 115.541 -2.171 . . . . 0.0 110.003 170.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -73.29 -16.38 61.38 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 122.49 2.404 . . . . 0.0 113.429 174.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 11.6 mt -73.62 -35.27 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 121.271 -0.893 . . . . 0.0 111.354 170.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 47.6 t -70.78 -43.86 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 O-C-N 120.728 -1.233 . . . . 0.0 109.865 170.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.05 -42.22 98.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 117.671 -3.143 . . . . 0.0 115.852 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -68.71 -25.65 64.87 Favored 'General case' 0 N--CA 1.449 -0.508 1 O-C-N 115.741 -4.349 . . . . 0.0 113.822 174.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 86.7 mt -87.91 8.95 23.83 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 116.843 -3.661 . . . . 0.0 112.525 172.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 62.5 mt -112.99 -20.25 11.61 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 120.152 1.342 . . . . 0.0 111.935 162.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 39.0 ttm105 -78.15 -38.08 44.46 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 127.836 2.455 . . . . 0.0 112.978 171.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.58 25.71 67.52 Favored Glycine 0 CA--C 1.524 0.653 0 CA-C-O 126.22 3.122 . . . . 0.0 115.449 161.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -92.83 -33.9 14.07 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 112.306 -1.947 . . . . 0.0 113.989 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 53.9 mtt -62.87 142.74 58.14 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 127.356 2.91 . . . . 0.0 112.007 178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 61.0 p -71.54 159.31 34.69 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.91 1.284 . . . . 0.0 113.15 160.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -59.8 -28.47 67.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 166.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . 0.254 23.6 ttp-105 -53.13 -49.18 67.08 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 127.772 2.429 . . . . 0.0 113.366 162.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -68.39 -59.38 3.22 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.108 1.763 . . . . 0.0 111.13 170.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mt -44.23 -38.85 4.04 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.991 -2.943 . . . . 0.0 116.481 176.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -53.15 -43.45 67.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 126.761 2.024 . . . . 0.0 115.374 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -112.21 -41.98 3.82 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 120.637 1.562 . . . . 0.0 112.479 -171.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -90.54 -33.1 16.05 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 120.176 -1.578 . . . . 0.0 109.157 -166.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 6.2 tp -84.24 -21.88 31.0 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 119.447 -2.033 . . . . 0.0 114.778 168.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.95 -174.77 28.8 Favored Glycine 0 C--N 1.335 0.508 0 N-CA-C 121.393 3.317 . . . . 0.0 121.393 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.21 68.26 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 111.895 -2.153 . . . . 0.0 115.87 -168.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.58 -13.17 2.77 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 121.191 3.236 . . . . 0.0 121.191 169.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 9.3 tt -60.22 -20.57 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.82 -27.78 58.04 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 120.532 -1.355 . . . . 0.0 111.356 -179.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 81' ' ' THR . . . . . 0.64 HG23 HG23 ' D' ' 44' ' ' THR . 93.2 m -64.83 -29.88 70.86 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 127.103 2.161 . . . . 0.0 110.2 172.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 7.5 mm -96.38 -31.17 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 115.835 -2.031 . . . . 0.0 110.98 -174.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 29.7 p -117.57 -0.86 11.78 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 125.425 1.703 . . . . 0.0 113.597 -163.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -124.06 148.94 46.68 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 120.998 -1.064 . . . . 0.0 113.007 172.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 98.79 169.74 31.18 Favored Glycine 0 C--N 1.338 0.639 0 CA-C-O 123.713 1.73 . . . . 0.0 112.19 -171.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 92.7 p -66.63 -34.52 78.06 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -177.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -89.34 10.69 21.48 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 115.195 -2.336 . . . . 0.0 112.022 -176.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 60.4 p -79.3 169.8 17.57 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 126.443 2.339 . . . . 0.0 114.542 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 21.0 tp -51.25 -42.76 61.25 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 116.822 -3.673 . . . . 0.0 113.922 -165.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -97.18 24.17 6.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 124.016 3.098 . . . . 0.0 111.791 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -141.43 -19.99 0.77 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 115.648 -2.12 . . . . 0.0 112.304 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.04 150.87 1.26 Allowed Pre-proline 0 N--CA 1.449 -0.495 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 164.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.54 156.1 62.71 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 CA-C-N 121.886 1.709 . . . . 0.0 113.475 -174.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 70.6 t -77.22 -27.5 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-O 112.757 -3.496 . . . . 0.0 108.338 -161.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -68.79 -29.32 67.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 124.849 3.477 . . . . 0.0 113.509 173.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 18.3 tp -78.75 -45.7 20.53 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 120.472 1.487 . . . . 0.0 108.547 176.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -50.38 -39.31 46.43 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 170.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -74.24 -35.88 63.87 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.235 -1.364 . . . . 0.0 108.347 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 36.2 t90 -81.55 -22.3 37.93 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 118.334 2.716 . . . . 0.0 118.334 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.15 -32.26 70.16 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.971 -0.456 . . . . 0.0 111.709 171.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.98 -35.18 80.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 115.0 1.482 . . . . 0.0 115.0 171.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -83.3 -29.29 28.47 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 118.512 -2.617 . . . . 0.0 115.258 -173.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 t -85.46 -41.24 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 171.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 7.0 mt -88.38 -5.02 58.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 121.771 3.989 . . . . 0.0 121.771 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . 0.286 99.3 mt -129.56 50.6 2.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 125.972 2.045 . . . . 0.0 112.11 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 16.8 pttt -115.1 139.05 50.21 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 117.925 -2.984 . . . . 0.0 113.07 -166.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 44.8 m -123.32 63.39 1.01 Allowed 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 123.011 1.386 . . . . 0.0 108.292 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 33.8 t0 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 116.277 -1.821 . . . . 0.0 113.324 -167.028 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 33.8 ttp . . . . . 0 N--CA 1.471 0.582 0 CA-C-O 122.061 0.934 . . . . 0.0 108.542 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.42 149.56 42.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -167.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 66.3 tt0 -150.9 130.57 13.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 128.249 2.62 . . . . 0.0 113.765 172.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -155.69 146.79 22.47 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 126.85 2.594 . . . . 0.0 109.21 168.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 3.4 p -87.36 167.84 19.68 Favored Pre-proline 0 N--CA 1.45 -0.432 0 C-N-CA 126.159 1.784 . . . . 0.0 108.991 175.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.64 -52.3 2.51 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-N 123.763 2.38 . . . . 0.0 110.808 177.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -141.73 128.87 20.91 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 128.905 2.882 . . . . 0.0 113.295 167.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.6 t -61.21 137.41 58.24 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 118.682 2.845 . . . . 0.0 118.682 -175.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.61 -35.49 72.54 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 131.047 3.739 . . . . 0.0 110.272 170.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.56 -14.23 59.71 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.494 -2.629 . . . . 0.0 112.21 175.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 11.3 mmt -87.14 -31.85 20.18 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.588 1.995 . . . . 0.0 115.381 168.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . 0.303 . . -62.88 -33.69 75.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.369 -2.253 . . . . 0.0 116.324 167.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -61.54 -38.26 86.78 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 128.382 3.551 . . . . 0.0 113.935 168.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -81.56 -35.47 30.2 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 114.179 -2.82 . . . . 0.0 109.534 -169.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 15' ' ' ARG . . . . . 0.45 HH11 ' HD3' ' D' ' 15' ' ' ARG . 0.0 OUTLIER -63.62 -21.5 66.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 117.392 2.367 . . . . 0.0 117.392 174.2 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -84.57 -37.16 21.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.995 2.118 . . . . 0.0 113.312 173.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -76.86 -37.23 55.96 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 125.08 1.487 . . . . 0.0 111.579 176.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -63.85 -18.99 64.71 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 116.072 -2.251 . . . . 0.0 112.422 166.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 -79.89 -47.61 14.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.835 1.254 . . . . 0.0 110.986 175.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 63.2 mt -52.52 -32.84 42.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.2 -2.333 . . . . 0.0 113.972 170.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 41.5 ttt180 -76.73 -19.49 57.6 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 114.867 -2.492 . . . . 0.0 110.265 173.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -75.56 -41.94 53.56 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 123.91 3.05 . . . . 0.0 114.836 155.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 77.8 t -60.19 -38.24 76.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 121.557 1.98 . . . . 0.0 111.826 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -74.44 -32.12 62.52 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 120.778 3.621 . . . . 0.0 120.778 168.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 21.4 tp -63.1 -44.08 96.69 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 165.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 26' ' ' LEU . . . . . 0.419 HD11 ' CE1' ' D' ' 30' ' ' TYR . 26.2 tp -67.71 -43.16 80.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 120.462 1.483 . . . . 0.0 109.377 178.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 27' ' ' LYS . . . . . 0.472 ' HE2' ' HB3' ' D' ' 27' ' ' LYS . 35.9 ttpt -57.34 -41.43 79.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 118.479 -2.638 . . . . 0.0 115.397 175.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -69.7 -32.49 71.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 116.674 -1.631 . . . . 0.0 110.243 171.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.263 . . -68.7 -20.93 64.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 121.419 1.918 . . . . 0.0 115.239 168.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 30' ' ' TYR . . . . . 0.419 ' CE1' HD11 ' D' ' 26' ' ' LEU . 15.2 m-85 -66.42 -45.61 79.32 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 123.236 2.744 . . . . 0.0 108.686 170.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -67.33 -5.79 15.88 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.628 -1.92 . . . . 0.0 114.644 -166.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 39.4 p-10 -137.25 16.08 2.99 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 125.428 1.705 . . . . 0.0 112.442 165.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 60.92 33.91 19.7 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 115.927 1.825 . . . . 0.0 115.927 172.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 48.1 mt -93.18 3.1 56.25 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 111.169 -2.741 . . . . 0.0 115.984 161.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.28 -60.68 2.99 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 130.753 3.621 . . . . 0.0 113.741 -178.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.13 -47.89 89.35 Favored Pre-proline 0 N--CA 1.451 -0.421 0 O-C-N 117.376 -3.327 . . . . 0.0 113.866 -174.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -64.01 -18.61 64.34 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 CA-C-N 123.035 2.119 . . . . 0.0 111.0 174.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . 0.315 38.1 tp -64.64 -70.81 0.21 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 123.353 2.797 . . . . 0.0 110.148 167.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 39' ' ' LEU . . . . . 0.427 ' H ' ' HG ' ' D' ' 39' ' ' LEU . 3.9 mt -36.09 -53.32 0.79 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 116.469 -1.729 . . . . 0.0 115.289 170.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . 0.291 26.8 m-20 -74.89 -22.27 58.74 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 116.998 -1.881 . . . . 0.0 111.194 -176.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 35.9 tp -65.65 -38.5 89.54 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 121.723 2.056 . . . . 0.0 112.84 166.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 72.1 mmm -89.85 -32.74 16.76 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 126.191 2.182 . . . . 0.0 114.223 -165.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 73.4 mt -105.61 122.3 45.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 118.041 -2.912 . . . . 0.0 112.888 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 44' ' ' THR . . . . . 0.64 HG23 HG23 ' C' ' 81' ' ' THR 0.323 73.1 p -57.23 151.82 34.35 Favored Pre-proline 0 N--CA 1.45 -0.47 0 N-CA-C 119.223 3.046 . . . . 0.0 119.223 160.206 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -42.26 -53.3 3.7 Favored 'Trans proline' 0 N--CA 1.448 -1.201 0 C-N-CA 124.816 3.677 . . . . 0.0 116.864 -175.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.299 0.9 OUTLIER -84.22 -3.93 58.5 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 115.762 -2.066 . . . . 0.0 112.045 -169.704 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -75.41 -44.1 46.44 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 125.863 1.665 . . . . 0.0 109.199 162.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 36.9 mtm-85 -67.61 -33.58 75.27 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 115.318 -2.277 . . . . 0.0 111.781 171.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -67.59 -44.83 77.19 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 175.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.25 . . -56.31 -48.07 77.44 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 121.446 1.93 . . . . 0.0 113.289 176.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 mt -65.78 -39.38 90.94 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.877 -1.765 . . . . 0.0 114.429 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.33 -36.74 53.78 Favored Glycine 0 N--CA 1.448 -0.504 0 O-C-N 119.526 -1.984 . . . . 0.0 113.601 167.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 29.5 m -94.73 -31.83 13.61 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 120.203 -1.763 . . . . 0.0 109.438 -171.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -52.37 -33.84 45.09 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 119.273 3.064 . . . . 0.0 119.273 170.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.46 -39.47 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 N-CA-C 115.932 1.827 . . . . 0.0 115.932 173.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -80.25 -25.08 39.69 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 174.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 78.8 mt -56.22 -50.21 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 O-C-N 120.631 -1.293 . . . . 0.0 112.34 158.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 41.9 t -64.47 -50.54 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 O-C-N 125.338 1.649 . . . . 0.0 114.349 176.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -51.67 -42.28 62.01 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 125.165 2.412 . . . . 0.0 109.823 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -72.78 -19.3 61.38 Favored 'General case' 0 N--CA 1.451 -0.409 1 O-C-N 115.051 -4.78 . . . . 0.0 117.193 178.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 62.8 mt -79.49 -18.93 50.92 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 126.449 2.343 . . . . 0.0 115.425 166.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 10.4 mt -94.83 -25.99 16.39 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.956 2.102 . . . . 0.0 108.548 175.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 31.4 ttm105 -77.23 -38.47 51.17 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 122.627 2.467 . . . . 0.0 110.822 163.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.37 17.63 74.51 Favored Glycine 0 C--N 1.339 0.696 0 CA-C-N 123.441 2.837 . . . . 0.0 116.869 169.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -92.93 -40.49 10.55 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 119.034 1.417 . . . . 0.0 110.841 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 49.5 mtm -75.15 44.51 0.25 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.094 2.558 . . . . 0.0 108.154 173.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 85.5 p -87.24 175.45 8.03 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 119.673 3.212 . . . . 0.0 119.673 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 63.92 -33.33 0.13 Allowed 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 129.918 3.287 . . . . 0.0 112.797 174.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -146.75 -46.13 0.18 Allowed 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 129.119 2.968 . . . . 0.0 108.771 -176.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -75.39 -40.79 57.56 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 117.738 -3.101 . . . . 0.0 118.537 -149.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 tt -62.83 -43.0 99.96 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.81 0.844 . . . . 0.0 109.575 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -54.0 -22.51 10.68 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.133 0.973 . . . . 0.0 112.434 175.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -110.78 -37.56 5.39 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 116.942 2.201 . . . . 0.0 116.942 174.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -64.6 -51.12 64.37 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.435 3.094 . . . . 0.0 115.79 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.37 1.3 mm? -99.23 -22.75 15.48 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.563 1.545 . . . . 0.0 109.884 170.465 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 77.57 -149.7 35.49 Favored Glycine 0 CA--C 1.523 0.593 1 N-CA-C 123.949 4.34 . . . . 0.0 123.949 166.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -45.51 -24.1 0.29 Allowed 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 128.031 2.842 . . . . 0.0 118.154 -164.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.05 -20.43 79.97 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-O 125.72 2.845 . . . . 0.0 118.984 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . 0.308 2.1 tt -44.31 -39.13 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 111.846 -2.177 . . . . 0.0 114.739 176.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.79 -17.43 44.15 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 129.548 3.139 . . . . 0.0 110.414 -175.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 1.7 m -74.73 -39.61 61.76 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 125.473 2.558 . . . . 0.0 112.598 164.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 15.2 mm -73.62 -19.87 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 120.991 3.7 . . . . 0.0 120.991 173.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 72.5 p -111.54 -40.98 4.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 117.565 -3.209 . . . . 0.0 105.826 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.279 35.0 mtp85 -70.79 169.53 14.39 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 122.765 2.53 . . . . 0.0 114.28 171.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 100.73 133.37 8.11 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 104.763 -3.335 . . . . 0.0 104.763 -174.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -49.68 -24.79 2.44 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -145.11 42.89 1.31 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 127.688 2.395 . . . . 0.0 112.847 -169.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 60.2 p -75.95 -177.93 4.1 Favored 'General case' 0 N--CA 1.45 -0.464 1 O-C-N 129.252 4.095 . . . . 0.0 107.918 174.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.285 3.0 tt -52.98 -31.67 42.05 Favored 'General case' 0 N--CA 1.45 -0.44 1 N-CA-C 122.356 4.206 . . . . 0.0 122.356 160.152 . . . . . . . . 3 2 . 1 . 002 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -72.09 -24.59 61.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.418 1.887 . . . . 0.0 112.214 172.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.69 -19.57 16.0 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.614 -1.66 . . . . 0.0 114.728 -175.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 41.5 84.5 0.18 Allowed Pre-proline 0 N--CA 1.449 -0.489 0 C-N-CA 128.736 2.814 . . . . 0.0 113.581 163.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 93' ' ' PRO . . . . . 0.473 ' C ' ' H ' ' D' ' 95' ' ' GLU . 50.2 Cg_exo 22.82 54.07 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 O-C-N 115.231 -3.089 . . . . 0.0 112.933 58.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 4.7 t -74.03 31.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 CA-C-O 122.612 1.196 . . . . 0.0 110.325 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 95' ' ' GLU . . . . . 0.473 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -137.18 -37.42 0.64 Allowed 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 116.199 -1.858 . . . . 0.0 114.788 174.597 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . 0.259 26.4 tp -55.68 -46.46 77.57 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.588 -1.672 . . . . 0.0 109.204 163.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 26.2 ptt180 -65.38 -35.04 79.76 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 117.0 -1.88 . . . . 0.0 114.217 -176.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -71.08 -35.54 71.89 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 115.038 1.495 . . . . 0.0 115.038 -172.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 29.9 t90 -63.65 -46.91 83.48 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 160.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 21.2 mt -63.22 -38.79 92.57 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 122.776 1.274 . . . . 0.0 113.234 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -47.38 -42.71 22.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 117.797 2.517 . . . . 0.0 117.797 163.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -95.15 -20.59 19.13 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 118.349 -2.719 . . . . 0.0 108.352 -166.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 89.8 t -85.61 -32.79 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 128.532 2.733 . . . . 0.0 114.185 165.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 64.9 mt -102.26 -6.09 23.54 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -171.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 51.9 mt -120.54 21.33 11.62 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 119.992 -1.692 . . . . 0.0 108.465 170.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 14.1 pttp -59.59 159.89 7.86 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 116.648 2.092 . . . . 0.0 116.648 -173.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.8 m -71.46 5.64 2.23 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 119.881 3.289 . . . . 0.0 119.881 -172.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 C--O 1.248 0.992 0 C-N-CA 127.167 2.187 . . . . 0.0 112.68 150.33 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.61 -31.61 69.65 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 116.437 -3.914 . . . . 0.0 117.522 -169.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -82.45 -29.14 30.84 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 115.72 -2.086 . . . . 0.0 110.24 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -71.9 -26.83 62.48 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 121.2 1.818 . . . . 0.0 108.113 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.6 p -80.53 172.56 9.5 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 129.069 2.948 . . . . 0.0 109.407 -171.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -64.85 -32.41 55.57 Favored 'Trans proline' 0 N--CA 1.45 -1.076 0 CA-C-O 116.349 -1.604 . . . . 0.0 114.269 -170.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -149.65 132.91 16.43 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.989 2.115 . . . . 0.0 112.007 177.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.2 t -89.8 97.84 11.42 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 124.738 2.209 . . . . 0.0 110.334 -167.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.53 -16.08 44.27 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 112.518 -2.128 . . . . 0.0 111.806 173.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.32 -36.51 29.67 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 120.784 -1.197 . . . . 0.0 108.764 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.5 ttp -74.9 -26.27 59.53 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 125.254 2.454 . . . . 0.0 114.685 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.78 -26.43 67.25 Favored 'General case' 0 N--CA 1.452 -0.346 1 O-C-N 114.173 -5.329 . . . . 0.0 111.616 166.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -88.19 -27.21 21.97 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 127.077 2.151 . . . . 0.0 114.485 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -85.15 -44.01 13.33 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 103.447 -2.797 . . . . 0.0 103.447 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.414 ' HD3' ' HA ' ' A' ' 15' ' ' ARG . 9.8 mmt180 -67.18 -45.63 76.38 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 104.054 -2.573 . . . . 0.0 104.054 -175.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -59.09 -46.29 88.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 117.737 -1.585 . . . . 0.0 114.349 175.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.11 -24.18 67.36 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 120.318 -1.488 . . . . 0.0 108.42 178.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.54 -28.83 61.13 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.969 -2.957 . . . . 0.0 109.569 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -94.52 -33.8 12.93 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 125.53 2.586 . . . . 0.0 112.583 -172.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.7 mt -60.75 -15.06 25.43 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 116.943 -3.598 . . . . 0.0 119.699 163.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -68.87 -48.32 63.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 130.472 3.509 . . . . 0.0 105.39 173.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -71.93 -37.29 70.04 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.549 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.3 t -65.45 -41.19 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-O 124.453 2.073 . . . . 0.0 112.264 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -69.96 -34.66 73.69 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 119.634 -1.916 . . . . 0.0 110.202 172.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 24.5 tp -73.96 -45.72 48.42 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 117.847 -3.033 . . . . 0.0 109.579 -173.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 tp -59.09 -36.59 75.38 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.432 ' HB2' ' CE1' ' B' ' 30' ' ' TYR . 69.8 tttt -62.62 -46.65 87.29 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 112.434 -2.166 . . . . 0.0 115.47 170.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -57.21 -39.19 74.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 126.205 1.802 . . . . 0.0 106.963 172.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.98 -31.27 56.39 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 114.395 -2.716 . . . . 0.0 108.597 -177.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -58.24 -42.2 85.86 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 173.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -75.68 -15.09 60.35 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 127.536 2.334 . . . . 0.0 110.553 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -131.78 16.69 4.76 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.34 3.4 m-20 73.3 1.75 4.1 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 168.007 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.2 mt -75.29 6.0 4.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.529 1.157 . . . . 0.0 113.562 168.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . 0.341 17.2 p-80 -67.47 -62.39 1.44 Allowed 'General case' 0 N--CA 1.451 -0.416 1 O-C-N 113.847 -5.533 . . . . 0.0 111.564 -166.436 . . . . . . . . 3 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.262 26.7 mt -49.1 -46.79 76.12 Favored Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-O 114.115 -2.85 . . . . 0.0 117.338 167.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -58.96 -42.88 47.71 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 124.665 3.577 . . . . 0.0 113.089 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 17.7 tp -69.69 -46.83 65.14 Favored 'General case' 0 N--CA 1.452 -0.372 1 O-C-N 115.025 -4.797 . . . . 0.0 110.726 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 74.7 mt -55.16 -42.46 73.15 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 126.416 2.323 . . . . 0.0 115.577 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -77.82 -4.6 47.35 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.084 1.353 . . . . 0.0 113.388 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 23.6 tp -99.36 -29.13 12.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 114.144 -2.836 . . . . 0.0 113.276 169.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 59.8 mmm -107.72 -9.48 15.81 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.076 2.11 . . . . 0.0 116.543 -177.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.5 mp -118.36 152.11 36.46 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 118.839 -2.413 . . . . 0.0 109.339 159.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.8 p -110.46 165.45 12.66 Favored Pre-proline 0 N--CA 1.452 -0.343 0 C-N-CA 124.972 1.309 . . . . 0.0 107.79 -170.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -61.34 -40.68 47.2 Favored 'Trans proline' 0 N--CA 1.446 -1.315 0 C-N-CA 124.307 3.338 . . . . 0.0 117.994 -163.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -22.56 62.56 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 116.632 -1.651 . . . . 0.0 109.969 176.316 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -72.0 -41.86 67.1 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 121.219 1.827 . . . . 0.0 112.517 175.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 20.6 mtm180 -65.23 -49.82 68.2 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 123.946 0.899 . . . . 0.0 110.944 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -55.92 -39.3 71.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 171.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.43 -37.15 84.56 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 117.261 -1.352 . . . . 0.0 110.14 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 30.2 mt -74.88 -27.88 60.42 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 124.664 3.393 . . . . 0.0 110.571 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.41 -44.39 98.09 Favored Glycine 0 CA--C 1.522 0.517 0 O-C-N 119.757 -1.839 . . . . 0.0 113.67 171.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -60.66 -32.13 71.33 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.288 1.435 . . . . 0.0 114.131 171.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.262 93.9 mtt180 -68.67 -34.42 75.66 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.545 -0.74 . . . . 0.0 111.232 -177.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.96 -48.21 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 168.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -55.01 -39.43 69.07 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 112.624 -3.56 . . . . 0.0 114.473 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 52.8 mt -63.43 -49.13 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 123.285 2.766 . . . . 0.0 111.849 167.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.0 -35.33 71.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 O-C-N 117.772 -3.08 . . . . 0.0 108.541 -174.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -60.45 -54.53 44.4 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 118.824 -2.423 . . . . 0.0 108.686 174.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -60.5 -27.6 67.72 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 171.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.5 mt -76.28 -25.31 54.77 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 117.456 -3.277 . . . . 0.0 111.149 176.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.9 mt -92.35 -40.06 11.12 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 127.725 2.41 . . . . 0.0 112.226 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.6 ttm105 -46.73 -56.49 6.11 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 117.044 -3.535 . . . . 0.0 112.454 148.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.67 44.94 61.12 Favored Glycine 0 C--N 1.337 0.611 0 C-N-CA 117.602 -2.237 . . . . 0.0 112.702 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -121.04 -52.08 2.09 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 127.653 2.381 . . . . 0.0 114.762 178.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.0 mtt -67.7 130.81 44.17 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 119.101 -2.249 . . . . 0.0 114.516 175.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.1 p -83.54 178.32 8.05 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 120.459 1.481 . . . . 0.0 110.033 -178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -63.87 -46.45 84.92 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 116.507 -2.077 . . . . 0.0 112.855 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.9 tpt85 -63.01 -10.07 12.46 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 119.792 3.256 . . . . 0.0 119.792 170.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -86.66 -42.89 13.05 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 120.938 1.699 . . . . 0.0 110.668 165.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 19.8 mt -63.83 -26.32 68.57 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.963 -1.71 . . . . 0.0 111.259 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -63.45 -21.81 66.52 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.356 1.062 . . . . 0.0 111.427 -176.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -102.08 -53.03 3.02 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 129.36 3.064 . . . . 0.0 111.125 166.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -74.59 -27.06 60.32 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 124.011 3.096 . . . . 0.0 115.523 -168.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.4 mt -121.83 -5.23 9.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 118.707 2.854 . . . . 0.0 118.707 170.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 82.35 5.15 89.83 Favored Glycine 0 CA--C 1.523 0.555 0 CA-C-O 116.137 -2.48 . . . . 0.0 115.027 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.67 138.78 43.08 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 117.438 2.384 . . . . 0.0 117.438 -170.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.73 171.53 55.13 Favored Glycine 0 C--N 1.34 0.779 0 CA-C-O 124.552 2.196 . . . . 0.0 116.159 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.8 mt -54.31 -59.29 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 1 O-C-N 115.096 -4.767 . . . . 0.0 112.656 173.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.11 -34.96 75.79 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.99 1.716 . . . . 0.0 113.842 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.15 -36.2 66.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 124.121 0.968 . . . . 0.0 110.538 177.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.39 49.7 mm -69.33 -45.15 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 O-C-N 118.465 -2.647 . . . . 0.0 114.338 164.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.1 m -65.36 -52.35 54.26 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.629 -177.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -74.55 -32.86 62.57 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 121.201 1.818 . . . . 0.0 110.462 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.12 -34.97 90.75 Favored Glycine 0 C--N 1.338 0.668 0 O-C-N 120.142 -1.599 . . . . 0.0 111.566 169.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.0 m -68.67 -45.0 72.87 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.126 -2.985 . . . . 0.0 111.036 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -57.94 -40.87 81.57 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 172.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 75.8 m -72.16 -25.94 61.89 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 113.656 -1.611 . . . . 0.0 113.848 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.6 tp -71.0 -33.09 70.06 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 166.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -69.04 -32.51 72.07 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 113.491 -3.147 . . . . 0.0 112.193 169.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.91 -5.68 40.09 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 128.109 3.381 . . . . 0.0 114.892 170.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.4 143.0 87.33 Favored Pre-proline 0 N--CA 1.448 -0.538 1 O-C-N 115.679 -4.388 . . . . 0.0 108.692 172.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -73.2 149.15 45.31 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 123.574 2.849 . . . . 0.0 110.202 175.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.2 m -65.98 -32.47 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 116.873 -3.642 . . . . 0.0 107.953 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.265 18.2 pm0 -65.07 -26.24 68.15 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 119.92 1.236 . . . . 0.0 111.192 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 48.2 tp -80.99 -41.9 22.02 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 116.757 -1.592 . . . . 0.0 110.853 177.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -68.59 -38.09 80.37 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 121.89 2.132 . . . . 0.0 111.79 176.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -53.79 -37.27 63.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 129.534 3.133 . . . . 0.0 111.815 168.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 34.2 t90 -77.19 -49.69 14.61 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.891 1.276 . . . . 0.0 109.098 176.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 79.1 mt -68.64 -33.42 73.99 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 -174.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.21 -36.18 81.16 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 121.64 2.018 . . . . 0.0 113.855 169.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -74.55 -34.43 62.94 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 118.959 -2.338 . . . . 0.0 114.548 170.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.4 t -70.55 -44.07 77.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 O-C-N 119.589 -1.944 . . . . 0.0 110.184 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . 0.286 12.0 mt -97.34 -27.98 14.24 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -172.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.6 mt -103.82 19.81 19.26 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 117.162 -3.461 . . . . 0.0 114.991 -167.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -126.61 17.13 7.53 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 119.848 -1.783 . . . . 0.0 115.417 -170.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.8 m -99.54 -58.44 1.93 Allowed 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 126.779 2.549 . . . . 0.0 110.388 -168.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 . . . . . 0 C--O 1.252 1.198 0 N-CA-C 117.38 2.363 . . . . 0.0 117.38 -173.88 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 24.5 ttp . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.67 -16.98 63.64 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 126.719 2.512 . . . . 0.0 111.467 -159.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -86.85 -22.01 26.04 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 120.527 -1.358 . . . . 0.0 110.738 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -69.75 -37.24 76.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.23 -2.169 . . . . 0.0 110.616 172.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 14.6 m -75.21 143.71 77.39 Favored Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.865 -167.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -52.13 -42.76 57.43 Favored 'Trans proline' 0 N--CA 1.449 -1.121 1 C-N-CA 126.916 5.077 . . . . 0.0 112.369 163.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -116.83 148.06 41.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.138 1.775 . . . . 0.0 114.838 173.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.431 ' HB3' ' HG3' ' B' ' 11' ' ' MET . 13.8 t -148.09 132.48 17.58 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.713 1.605 . . . . 0.0 111.823 158.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.23 -44.91 43.9 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 124.907 2.289 . . . . 0.0 110.204 163.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.91 -24.02 62.38 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 116.617 -3.802 . . . . 0.0 109.581 -172.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.431 ' HG3' ' HB3' ' B' ' 8' ' ' SER . 4.0 mtt -87.61 -43.0 12.3 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 103.95 -2.611 . . . . 0.0 103.95 -176.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.65 -37.36 63.05 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 128.114 2.566 . . . . 0.0 116.183 170.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -66.23 -57.27 7.94 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 130.559 3.544 . . . . 0.0 107.724 -178.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -47.93 -46.14 31.71 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 129.397 3.079 . . . . 0.0 115.394 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -74.7 -43.27 55.99 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 126.407 1.883 . . . . 0.0 109.837 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -62.9 -26.66 68.9 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.179 1.354 . . . . 0.0 114.393 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -73.81 -50.72 19.14 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 116.278 -1.82 . . . . 0.0 110.581 174.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -43.12 -51.84 5.72 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 127.718 3.136 . . . . 0.0 114.26 163.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 -57.09 -49.84 74.64 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.934 1.694 . . . . 0.0 115.028 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 38.7 mt -63.46 -23.34 67.36 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 119.751 -1.843 . . . . 0.0 112.009 -176.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . 0.259 67.5 ttt180 -67.93 -30.19 69.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.788 2.035 . . . . 0.0 112.301 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -79.77 -36.83 36.59 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 115.899 -2.0 . . . . 0.0 111.358 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 20.9 t -59.28 -39.69 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 O-C-N 126.402 2.314 . . . . 0.0 112.914 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -80.1 -35.23 37.17 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 116.464 -1.732 . . . . 0.0 114.872 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 25.8 tp -58.74 -47.43 84.66 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 126.175 2.893 . . . . 0.0 114.63 168.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 28.8 tp -70.53 -32.93 70.58 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 116.863 -3.648 . . . . 0.0 112.526 -177.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . 0.317 59.2 tttt -49.7 -50.59 43.21 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 126.318 2.961 . . . . 0.0 110.854 165.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -81.91 -20.04 39.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 116.958 -3.588 . . . . 0.0 111.51 -174.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.49 -36.32 57.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 172.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' TYR . . . . . 0.432 ' CE1' ' HB2' ' A' ' 27' ' ' LYS . 6.3 m-85 -50.53 -39.73 49.78 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 170.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -90.28 6.28 43.6 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.375 2.361 . . . . 0.0 117.375 178.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -119.67 6.21 11.01 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 119.409 -2.057 . . . . 0.0 107.93 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 57.82 43.5 21.65 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 117.231 -3.418 . . . . 0.0 112.793 -173.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 89.3 mt -125.15 5.51 7.86 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.46 -2.65 . . . . 0.0 111.523 -174.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -62.76 -39.49 94.31 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 119.197 -2.189 . . . . 0.0 113.555 -178.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' B' ' 36' ' ' LEU . 12.3 mt -66.54 -52.42 35.59 Favored Pre-proline 0 N--CA 1.446 -0.662 1 O-C-N 115.21 -4.681 . . . . 0.0 109.143 -173.281 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' B' ' 36' ' ' LEU . 38.9 Cg_endo -70.53 -26.16 24.26 Favored 'Trans proline' 0 N--CA 1.447 -1.215 0 C-N-CA 121.665 1.576 . . . . 0.0 110.833 -177.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 tp -64.76 -44.47 89.93 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.583 1.553 . . . . 0.0 114.864 174.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 83.1 mt -78.84 -32.03 45.97 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.848 2.459 . . . . 0.0 111.456 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -62.33 -28.06 69.48 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 123.567 2.894 . . . . 0.0 109.276 165.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 51.6 tp -89.36 -34.79 16.4 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.643 1.977 . . . . 0.0 113.844 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 16.6 mmt -86.99 -21.47 26.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 115.085 -2.388 . . . . 0.0 112.077 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 44.5 mt -137.81 124.55 21.08 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 128.891 2.876 . . . . 0.0 110.153 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 77.1 p -68.9 166.79 24.23 Favored Pre-proline 0 N--CA 1.451 -0.423 0 C-N-CA 124.769 1.228 . . . . 0.0 112.292 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -40.54 -52.51 3.07 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 124.65 3.567 . . . . 0.0 113.726 167.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -66.7 -24.63 66.28 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 121.719 2.054 . . . . 0.0 114.816 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -83.49 -33.79 25.49 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 127.296 2.239 . . . . 0.0 115.912 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 56.6 mtm-85 -72.71 -40.53 66.11 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 127.442 2.297 . . . . 0.0 108.848 177.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.286 38.8 tt0 -63.57 -37.47 87.45 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 126.579 2.425 . . . . 0.0 115.688 176.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.7 -53.44 58.01 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.987 174.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.0 mt -59.14 -37.48 77.37 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 121.134 3.753 . . . . 0.0 121.134 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.19 -30.73 74.6 Favored Glycine 0 CA--C 1.523 0.594 0 C-N-CA 126.638 2.066 . . . . 0.0 115.313 166.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 74.1 m -87.29 -45.08 10.92 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 112.191 -3.766 . . . . 0.0 104.221 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -51.01 -45.93 61.35 Favored 'General case' 0 N--CA 1.452 -0.359 1 CA-C-N 126.227 4.103 . . . . 0.0 109.879 176.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.0 t -50.62 -55.07 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 116.627 -1.654 . . . . 0.0 111.773 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -56.18 -35.02 66.77 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 116.116 1.895 . . . . 0.0 116.116 172.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 80.7 mt -67.55 -45.37 85.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 120.545 1.521 . . . . 0.0 113.33 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 43.7 t -83.56 -1.9 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 126.285 1.834 . . . . 0.0 114.608 -172.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . 0.292 57.4 tt0 -92.36 -28.21 17.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.062 -1.829 . . . . 0.0 106.062 171.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -78.57 -20.96 49.4 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 126.467 1.907 . . . . 0.0 115.616 177.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 91.9 mt -63.93 -33.79 76.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 160.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . 0.267 13.2 mt -77.03 -33.27 57.37 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 120.6 3.556 . . . . 0.0 120.6 174.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 37.4 ttm105 -87.42 -58.67 2.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 127.867 3.229 . . . . 0.0 108.5 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.71 39.5 20.93 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 118.98 2.352 . . . . 0.0 118.98 175.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -123.5 -6.09 8.15 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 117.705 -1.141 . . . . 0.0 111.648 -168.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 5.1 mtt -83.37 152.33 25.1 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 30.5 p -83.45 159.56 21.73 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 117.662 -3.149 . . . . 0.0 115.989 157.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -61.97 -31.15 71.48 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 119.86 -1.775 . . . . 0.0 109.119 -173.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -59.29 -39.76 84.03 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 119.275 -2.141 . . . . 0.0 114.497 171.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -72.1 -38.1 69.41 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 119.822 -1.799 . . . . 0.0 108.5 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 46.3 mt -55.98 -48.85 75.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 118.95 -2.344 . . . . 0.0 107.554 176.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -66.39 -40.3 89.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 116.505 -2.078 . . . . 0.0 114.881 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -99.38 -17.86 17.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 125.691 2.663 . . . . 0.0 117.317 -164.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -105.2 -49.62 3.42 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 128.98 2.912 . . . . 0.0 112.236 176.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 60.7 mt -95.85 -4.83 42.98 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 126.452 2.345 . . . . 0.0 113.604 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.84 19.27 60.74 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-O 118.895 -0.947 . . . . 0.0 114.14 -178.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -100.79 118.25 36.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 116.418 2.007 . . . . 0.0 116.418 -165.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.01 167.98 54.36 Favored Glycine 0 CA--C 1.523 0.556 1 CA-C-O 128.364 4.313 . . . . 0.0 110.688 174.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 80.6 mt -52.23 -39.71 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 O-C-N 116.467 -3.961 . . . . 0.0 112.399 171.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . 0.275 . . -78.65 -39.29 37.39 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 116.798 -3.689 . . . . 0.0 115.013 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 9.2 m -56.92 -36.82 70.65 Favored 'General case' 0 N--CA 1.454 -0.272 1 O-C-N 114.22 -5.3 . . . . 0.0 113.171 166.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 14.3 mm -64.1 -53.07 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 170.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 24.1 m -55.07 -48.28 73.74 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 121.309 1.868 . . . . 0.0 114.455 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 20.1 ttt180 -63.88 -41.37 97.76 Favored 'General case' 0 N--CA 1.451 -0.408 1 O-C-N 116.239 -4.038 . . . . 0.0 112.524 175.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.68 -46.82 66.04 Favored Glycine 0 C--N 1.334 0.46 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 172.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m -71.6 -29.66 64.93 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 117.008 -1.472 . . . . 0.0 113.953 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -61.27 -58.79 6.82 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 119.79 1.177 . . . . 0.0 111.119 169.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -60.04 -33.24 71.75 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.078 2.151 . . . . 0.0 114.225 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 20.2 mt -58.69 -36.25 73.92 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 113.59 -3.1 . . . . 0.0 114.446 162.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 58.8 mttt -70.33 1.79 4.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 122.6 2.455 . . . . 0.0 112.39 173.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -117.52 -5.79 11.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 127.897 2.479 . . . . 0.0 115.761 174.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.4 131.84 64.15 Favored Pre-proline 0 N--CA 1.448 -0.567 0 C-N-CA 124.225 1.01 . . . . 0.0 109.809 -174.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -61.69 153.27 68.51 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 117.843 -0.971 . . . . 0.0 109.839 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.0 m -55.89 -33.77 35.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 126.52 2.388 . . . . 0.0 114.084 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 -74.49 -27.89 60.76 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 117.508 2.41 . . . . 0.0 117.508 -177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 52.7 tp -66.34 -50.79 62.38 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 117.343 -3.348 . . . . 0.0 111.437 164.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 15.3 mtm180 -61.47 -45.02 96.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 -173.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -53.98 -38.8 65.43 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 118.679 -2.513 . . . . 0.0 115.651 163.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -74.16 -35.44 64.03 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.42 -31.31 72.43 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 175.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -75.54 -18.78 59.68 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 124.488 1.117 . . . . 0.0 113.035 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -84.6 -31.85 24.07 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 131.617 3.967 . . . . 0.0 115.663 170.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 84.8 t -104.68 -52.63 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 116.287 -1.816 . . . . 0.0 111.956 -170.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 79.1 mt -76.41 -50.11 14.98 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 121.446 1.93 . . . . 0.0 108.665 -173.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 45.0 mt -67.91 -30.45 69.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.226 2.204 . . . . 0.0 110.376 -173.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . 0.283 89.1 mttt -70.06 -11.69 61.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 120.038 -1.664 . . . . 0.0 114.281 172.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.3 m -82.31 -9.37 59.5 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 116.554 -3.842 . . . . 0.0 116.506 168.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 . . . . . 0 C--O 1.248 1.013 0 CA-C-N 123.608 2.913 . . . . 0.0 112.428 170.165 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 14.9 ttt . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 124.975 2.321 . . . . 0.0 108.466 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.53 159.44 31.28 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 111.867 -2.424 . . . . 0.0 114.166 -168.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -131.86 148.4 52.54 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -127.09 127.22 44.3 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 128.462 2.705 . . . . 0.0 110.943 169.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 74.5 p -119.95 167.92 11.41 Favored Pre-proline 0 N--CA 1.451 -0.382 0 O-C-N 127.735 3.147 . . . . 0.0 113.45 168.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . 0.269 87.4 Cg_exo -59.52 -31.59 94.84 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.983 3.122 . . . . 0.0 117.18 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . 0.271 68.9 t80 -148.66 141.56 24.74 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 119.346 -2.096 . . . . 0.0 108.539 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 2.7 t -141.37 120.89 13.26 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.443 -1.253 . . . . 0.0 112.328 166.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.82 -5.74 22.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 121.558 3.91 . . . . 0.0 121.558 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.91 -17.02 59.2 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 117.596 2.443 . . . . 0.0 117.596 171.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 33.1 mtt -86.58 -39.31 16.29 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 126.215 1.806 . . . . 0.0 108.015 173.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.07 -28.06 54.5 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 177.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -70.89 -28.93 64.9 Favored 'General case' 0 N--CA 1.449 -0.494 1 O-C-N 116.287 -4.008 . . . . 0.0 109.942 170.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -76.07 -31.66 58.88 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 115.86 -2.019 . . . . 0.0 113.457 171.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -35.34 79.09 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 121.535 1.97 . . . . 0.0 109.576 165.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -66.29 -49.56 66.67 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 125.92 2.012 . . . . 0.0 107.414 -174.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 71.4 mm-40 -63.9 -30.58 71.65 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -67.36 -34.31 77.03 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.199 -2.188 . . . . 0.0 109.207 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 19' ' ' TRP . . . . . 0.507 ' CE2' ' HD2' ' D' ' 48' ' ' ARG . 58.3 t-105 -82.98 -40.27 20.24 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 -175.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 21.8 mt -64.85 -37.14 86.62 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 117.463 -1.695 . . . . 0.0 112.318 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -53.59 -36.78 62.31 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 128.172 2.589 . . . . 0.0 113.627 167.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . 0.274 75.7 t80 -52.24 -59.92 3.82 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 127.239 2.216 . . . . 0.0 106.153 171.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 98.8 t -74.38 -32.48 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 125.162 1.538 . . . . 0.0 110.671 -170.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -68.4 -34.34 75.86 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 116.698 -3.751 . . . . 0.0 112.02 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 25' ' ' LEU . . . . . 0.438 ' CD1' HG11 ' D' ' 103' ' ' VAL . 35.8 tp -77.44 -28.35 52.44 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 119.095 -2.253 . . . . 0.0 109.276 174.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 26' ' ' LEU . . . . . 0.445 HD11 HD21 ' C' ' 39' ' ' LEU . 15.6 tp -70.72 -28.33 64.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 115.652 -2.118 . . . . 0.0 113.848 170.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp -88.11 -28.66 21.15 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 121.901 2.137 . . . . 0.0 110.365 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -60.98 -28.67 69.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.863 1.665 . . . . 0.0 110.952 164.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.44 -7.22 48.68 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 122.98 1.371 . . . . 0.0 111.786 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -99.64 0.75 42.66 Favored 'General case' 0 N--CA 1.451 -0.402 1 O-C-N 115.968 -4.207 . . . . 0.0 110.89 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -70.69 -36.56 73.34 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 124.474 3.306 . . . . 0.0 111.402 175.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 49.8 p-10 -124.1 17.65 9.2 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 120.408 -1.432 . . . . 0.0 108.859 -171.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.292 4.2 m-20 56.31 32.55 20.64 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 116.939 2.2 . . . . 0.0 116.939 -175.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 21.9 mt -89.2 10.04 23.51 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.105 -2.872 . . . . 0.0 107.567 173.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -58.23 -47.03 84.8 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 123.011 2.641 . . . . 0.0 110.96 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.283 62.8 mt -67.55 -44.61 45.16 Favored Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-O 113.227 -3.273 . . . . 0.0 110.466 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -70.27 -20.3 32.6 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 CA-C-N 123.731 2.368 . . . . 0.0 111.629 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 26.5 tp -81.17 -30.02 34.5 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 122.088 2.222 . . . . 0.0 115.215 167.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 39' ' ' LEU . . . . . 0.634 HD13 ' CZ2' ' D' ' 19' ' ' TRP . 75.1 mt -65.34 -27.98 68.97 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 120.452 -1.405 . . . . 0.0 111.795 165.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -92.94 -0.64 57.18 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 126.913 2.085 . . . . 0.0 109.235 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 30.7 tp -100.63 -44.41 5.84 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 127.939 3.733 . . . . 0.0 115.106 167.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . 0.252 9.1 mmt -77.57 -36.47 52.04 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 117.51 -3.244 . . . . 0.0 114.284 -175.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.53 152.6 33.77 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 125.128 1.518 . . . . 0.0 111.787 -173.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 27.8 p -76.46 162.43 70.94 Favored Pre-proline 0 N--CA 1.452 -0.347 0 C-N-CA 127.024 2.129 . . . . 0.0 115.909 163.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -56.9 -37.29 98.62 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 CA-C-N 124.241 2.55 . . . . 0.0 116.72 -176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -79.61 -4.32 51.04 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 127.985 3.303 . . . . 0.0 114.871 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -97.38 -16.58 20.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.006 -1.452 . . . . 0.0 113.39 171.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -84.5 -44.62 13.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 117.613 -1.184 . . . . 0.0 111.02 167.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -57.4 -43.9 84.08 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 104.31 -2.478 . . . . 0.0 104.31 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.05 -40.61 64.96 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 118.62 -2.55 . . . . 0.0 110.887 -169.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 51' ' ' LEU . . . . . 0.442 HD22 ' CZ ' ' D' ' 22' ' ' PHE . 3.3 mt -60.29 -45.63 92.68 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 125.427 2.537 . . . . 0.0 108.988 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.66 -43.26 96.36 Favored Glycine 0 CA--C 1.524 0.652 0 CA-C-O 116.781 -2.122 . . . . 0.0 111.667 173.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 60.6 m -60.37 -42.67 96.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.152 1.976 . . . . 0.0 112.982 173.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.309 96.0 mtt180 -57.61 -24.61 57.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 119.716 -1.865 . . . . 0.0 112.543 -172.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 98.5 t -63.8 -38.84 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 106.322 -1.732 . . . . 0.0 106.322 178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 68.2 mtp180 -83.27 -15.53 49.87 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 123.855 1.788 . . . . 0.0 112.048 -171.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 32.6 mt -74.95 -47.23 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 C-N-CA 126.272 1.829 . . . . 0.0 106.522 169.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 35.1 t -61.16 -48.98 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 122.602 1.192 . . . . 0.0 113.553 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -49.83 -42.54 47.48 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 117.44 2.385 . . . . 0.0 117.44 173.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -69.4 -50.74 43.2 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 115.149 -2.357 . . . . 0.0 109.684 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 mt -66.06 -7.22 16.17 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 123.238 2.744 . . . . 0.0 117.464 177.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 80.1 mt -93.74 -33.25 13.69 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.449 2.3 . . . . 0.0 110.387 167.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 45.5 ttm180 -80.02 -38.7 31.47 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.54 22.23 74.95 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 122.672 3.829 . . . . 0.0 122.672 170.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -83.54 -16.08 46.84 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 116.665 -3.844 . . . . 0.0 115.763 165.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 35.4 mtt -77.96 130.13 36.16 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 117.708 -1.597 . . . . 0.0 113.095 173.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 81.7 p -80.8 168.31 18.94 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 124.065 0.853 . . . . 0.0 111.992 159.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -41.37 -43.63 2.57 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 130.023 3.329 . . . . 0.0 110.52 172.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -52.77 -41.62 64.25 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 118.05 -2.906 . . . . 0.0 112.263 -176.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -90.38 -38.3 13.41 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 131.592 3.957 . . . . 0.0 109.616 -169.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 62.8 mt -62.23 -21.49 65.2 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 120.133 -1.604 . . . . 0.0 111.689 174.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 31.7 tttp -80.46 -46.43 15.93 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 118.133 -1.427 . . . . 0.0 113.199 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -86.59 -54.0 4.65 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 119.02 -2.3 . . . . 0.0 112.506 -176.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -71.41 -32.97 69.01 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.327 -1.483 . . . . 0.0 113.67 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 mp -101.22 -3.24 29.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 116.447 2.017 . . . . 0.0 116.447 174.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 72.23 -142.17 32.46 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-O 117.112 -1.938 . . . . 0.0 112.698 159.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -99.48 -7.04 26.56 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 131.446 3.899 . . . . 0.0 114.169 164.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.38 -32.45 52.07 Favored Glycine 0 C--N 1.337 0.595 0 C-N-CA 126.778 2.132 . . . . 0.0 112.567 172.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 13.1 tt -54.29 -40.9 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-O 114.705 -2.569 . . . . 0.0 117.161 175.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.65 -34.28 77.85 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.148 1.53 . . . . 0.0 109.972 -178.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 81' ' ' THR . . . . . 0.464 HG23 ' CG2' ' D' ' 44' ' ' THR . 31.5 m -60.25 -33.13 71.87 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 115.418 -2.229 . . . . 0.0 114.054 168.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 28.1 mm -88.97 -17.41 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 126.825 2.05 . . . . 0.0 111.492 -177.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.2 p -117.48 -19.73 9.35 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -165.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -119.23 151.03 39.1 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 118.494 -2.629 . . . . 0.0 114.609 -175.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.7 170.0 44.17 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 120.879 3.111 . . . . 0.0 120.879 -164.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 67.8 p -84.96 0.85 49.89 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 118.103 -2.998 . . . . 0.0 113.654 -168.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -117.98 5.93 12.13 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.74 2.416 . . . . 0.0 114.325 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 74.6 p -61.14 158.35 14.03 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 119.939 3.311 . . . . 0.0 119.939 175.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 15.7 tp -57.11 -28.18 62.45 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 120.016 -1.677 . . . . 0.0 115.41 -163.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -103.4 16.67 25.93 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -119.68 -7.78 10.02 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 128.181 2.592 . . . . 0.0 112.867 169.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.64 163.32 61.74 Favored Pre-proline 0 N--CA 1.451 -0.379 0 C-N-CA 128.167 2.587 . . . . 0.0 109.587 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -61.63 146.68 96.63 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.504 2.803 . . . . 0.0 110.506 -176.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 12.9 t -67.15 -42.34 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 CA-C-N 113.376 -1.738 . . . . 0.0 113.42 -178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pm0 -56.5 -12.05 1.56 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 160.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . 0.285 14.3 tp -93.36 -41.3 9.92 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.632 -3.168 . . . . 0.0 115.073 164.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -51.68 -34.1 36.87 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 129.243 3.017 . . . . 0.0 113.69 167.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -94.47 -42.13 9.01 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 116.795 -1.574 . . . . 0.0 108.148 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -58.14 -40.49 81.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 116.713 -1.613 . . . . 0.0 113.562 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 82.6 mt -62.61 -38.67 91.09 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 125.707 1.879 . . . . 0.0 110.696 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -71.68 -8.23 52.88 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 172.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -99.25 -5.72 29.35 Favored 'General case' 0 N--CA 1.447 -0.595 2 CA-C-N 127.383 4.628 . . . . 0.0 110.75 175.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 90.0 t -125.49 -42.97 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.675 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 8.3 mt -80.6 -15.24 57.11 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.95 -2.344 . . . . 0.0 109.786 -176.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 83.9 mt -136.42 15.76 3.19 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 116.84 2.163 . . . . 0.0 116.84 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -74.09 132.5 42.35 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 118.441 -2.662 . . . . 0.0 116.409 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 1.5 m -111.49 3.79 18.34 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.964 1.706 . . . . 0.0 112.231 -168.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 17.1 t70 . . . . . 0 C--O 1.247 0.932 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 174.727 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 43.6 ttp . . . . . 0 N--CA 1.473 0.682 0 CA-C-O 116.497 -1.715 . . . . 0.0 113.691 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.95 165.15 22.91 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.267 0.939 . . . . 0.0 111.028 176.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -172.86 133.0 0.55 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.556 1.942 . . . . 0.0 110.268 -169.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -145.93 131.84 19.16 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 120.313 3.449 . . . . 0.0 120.313 -176.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 79.1 p -68.37 133.78 91.16 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 113.934 -2.936 . . . . 0.0 110.7 171.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.42 -27.97 46.68 Favored 'Trans proline' 0 N--CA 1.448 -1.148 1 C-N-CA 128.105 5.87 . . . . 0.0 113.973 -176.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -142.81 145.13 32.91 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 143.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 31.0 t -70.93 129.26 38.57 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 125.435 2.54 . . . . 0.0 110.829 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.45 -19.34 50.12 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 128.911 2.884 . . . . 0.0 108.485 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . 0.252 . . -67.61 -50.85 56.17 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 128.18 2.592 . . . . 0.0 110.285 167.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 17.1 mmt -63.27 -41.64 99.05 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 119.368 -2.082 . . . . 0.0 110.509 168.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.42 -33.62 72.77 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 120.588 1.54 . . . . 0.0 114.427 -176.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -51.89 -65.21 0.6 Allowed 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 119.157 -2.214 . . . . 0.0 114.114 158.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -52.05 -35.5 47.48 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 118.53 2.789 . . . . 0.0 118.53 -174.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -34.67 78.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 120.261 -1.524 . . . . 0.0 113.768 171.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -78.76 -25.01 44.39 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 112.394 -3.67 . . . . 0.0 108.148 165.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -72.0 -33.33 67.99 Favored 'General case' 0 N--CA 1.45 -0.465 1 CA-C-N 126.17 4.077 . . . . 0.0 115.351 177.018 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -70.03 -25.25 63.49 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.095 1.758 . . . . 0.0 112.09 174.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 19' ' ' TRP . . . . . 0.634 ' CZ2' HD13 ' C' ' 39' ' ' LEU . 24.9 t-105 -79.83 -52.34 8.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 127.264 2.852 . . . . 0.0 106.451 177.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 61.5 mt -49.77 -32.97 15.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 116.762 2.134 . . . . 0.0 116.762 167.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -73.07 -31.0 64.1 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.611 1.564 . . . . 0.0 114.011 176.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 22' ' ' PHE . . . . . 0.442 ' CZ ' HD22 ' C' ' 51' ' ' LEU . 69.3 t80 -69.07 -46.43 67.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 126.656 2.472 . . . . 0.0 115.062 165.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 77.5 t -59.07 -36.92 65.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 120.255 1.389 . . . . 0.0 110.787 175.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . 0.326 20.8 t70 -61.26 -62.98 1.45 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 127.081 2.152 . . . . 0.0 111.7 169.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 25' ' ' LEU . . . . . 0.482 HD23 HD21 ' D' ' 38' ' ' LEU . 13.2 tp -47.68 -42.98 26.09 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 115.493 -2.194 . . . . 0.0 110.352 177.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 60.1 tp -71.27 -50.96 27.34 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 127.765 2.426 . . . . 0.0 108.8 -174.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -56.35 -35.21 67.38 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.072 -2.268 . . . . 0.0 114.249 170.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -68.52 -40.46 80.77 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 116.962 -1.895 . . . . 0.0 110.597 173.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.76 -15.32 62.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 127.219 2.208 . . . . 0.0 113.578 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . 0.298 18.3 m-30 -75.26 -26.2 58.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 118.034 -2.916 . . . . 0.0 111.007 161.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -83.91 -23.95 30.97 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 124.288 3.222 . . . . 0.0 114.788 -168.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -103.28 4.74 36.89 Favored 'General case' 0 N--CA 1.451 -0.397 1 N-CA-C 121.863 4.024 . . . . 0.0 121.863 153.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.261 39.9 m-20 68.11 26.56 7.14 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.593 1.957 . . . . 0.0 113.762 170.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 91.1 mt -93.94 5.67 50.92 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.12 2.568 . . . . 0.0 113.294 175.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -52.79 59.83 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.531 2.332 . . . . 0.0 114.063 176.099 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.7 -45.91 66.79 Favored Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-O 115.808 -2.044 . . . . 0.0 108.758 -168.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.251 26.5 Cg_endo -64.4 -28.57 62.76 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 CA-C-N 122.428 1.903 . . . . 0.0 113.211 176.076 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 38' ' ' LEU . . . . . 0.482 HD21 HD23 ' D' ' 25' ' ' LEU . 44.4 tp -68.2 -50.17 55.96 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 -179.366 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 95.4 mt -58.28 -38.37 76.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.542 1.537 . . . . 0.0 114.128 166.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . 0.395 6.1 m-20 -68.01 -29.64 68.7 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 117.503 -1.237 . . . . 0.0 111.04 177.214 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 17.1 tp -75.29 -35.41 61.31 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 123.247 1.499 . . . . 0.0 113.439 172.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 7.4 mmm -87.24 -19.97 27.57 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 116.154 -2.218 . . . . 0.0 114.359 -176.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 93.8 mt -125.78 126.4 44.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.534 -2.604 . . . . 0.0 107.968 -172.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 44' ' ' THR . . . . . 0.464 ' CG2' HG23 ' C' ' 81' ' ' THR . 61.8 p -62.67 157.97 54.34 Favored Pre-proline 0 N--CA 1.449 -0.524 0 CA-C-O 114.152 -2.832 . . . . 0.0 117.646 174.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -59.69 -37.42 87.67 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 CA-C-N 125.429 2.975 . . . . 0.0 117.221 -173.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -63.68 -31.81 73.1 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 120.44 -1.413 . . . . 0.0 113.327 169.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -73.15 -30.13 63.37 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 120.351 -1.468 . . . . 0.0 110.958 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 48' ' ' ARG . . . . . 0.507 ' HD2' ' CE2' ' C' ' 19' ' ' TRP . 77.9 mtm-85 -76.59 -41.17 47.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.933 2.093 . . . . 0.0 111.898 176.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -54.96 -60.44 3.37 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 125.379 1.472 . . . . 0.0 111.933 166.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.15 -43.23 66.85 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 73.3 mt -64.58 -53.92 40.22 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 126.163 2.165 . . . . 0.0 114.08 173.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -37.89 -36.93 0.36 Allowed Glycine 0 C--N 1.336 0.534 0 CA-C-N 120.224 1.374 . . . . 0.0 116.315 159.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 87.3 m -77.84 -35.94 50.55 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.017 2.127 . . . . 0.0 110.633 -176.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 54' ' ' ARG . . . . . 0.43 ' HB3' HD11 ' D' ' 82' ' ' ILE . 22.7 mtt180 -71.87 -20.94 61.73 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 114.199 -2.81 . . . . 0.0 110.445 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 85.8 t -55.79 -46.63 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 116.285 1.957 . . . . 0.0 116.285 166.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -84.81 -26.52 27.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 126.689 2.493 . . . . 0.0 110.22 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 15.4 mt -70.31 -36.72 68.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 O-C-N 118.759 -2.463 . . . . 0.0 108.737 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 58' ' ' VAL . . . . . 0.483 ' CG2' HD12 ' D' ' 82' ' ' ILE . 94.9 t -67.93 -32.62 57.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 118.097 2.629 . . . . 0.0 118.097 170.276 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -70.82 -45.22 64.96 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.407 -1.724 . . . . 0.0 111.667 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.18 -32.7 74.38 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.428 1.491 . . . . 0.0 110.045 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 19.7 mt -71.88 -17.09 62.14 Favored 'General case' 0 N--CA 1.447 -0.579 1 O-C-N 115.027 -4.796 . . . . 0.0 114.676 172.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -91.21 -32.11 15.91 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 124.249 1.976 . . . . 0.0 113.025 165.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 63' ' ' ARG . . . . . 0.576 ' HG2' ' HG3' ' D' ' 65' ' ' GLU . 20.6 ttm180 -61.78 -52.79 62.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.733 -1.854 . . . . 0.0 113.029 170.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.63 26.23 69.61 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-O 115.362 -2.91 . . . . 0.0 118.792 174.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 65' ' ' GLU . . . . . 0.576 ' HG3' ' HG2' ' D' ' 63' ' ' ARG . 81.4 mt-10 -99.75 -45.59 5.69 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 100.808 -3.775 . . . . 0.0 100.808 -166.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 5.1 mtm -88.88 56.57 3.78 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 23.7 p -90.36 -171.77 3.21 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 123.428 1.585 . . . . 0.0 113.629 -168.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.376 7.2 tp60 61.25 -82.64 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 121.3 3.815 . . . . 0.0 121.3 170.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 25.7 ttt85 -93.84 -31.96 14.14 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 126.247 2.217 . . . . 0.0 112.53 175.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -76.49 -44.22 36.27 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 -165.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.54 -44.42 69.2 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 172.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . 0.285 27.1 mtmt -72.96 -19.2 61.28 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 114.988 -2.434 . . . . 0.0 109.674 -177.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -123.9 -11.31 7.66 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 125.872 1.983 . . . . 0.0 111.812 -168.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 -103.85 -47.6 4.16 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 128.642 2.777 . . . . 0.0 109.816 176.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.21 -45.06 11.0 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 128.316 3.51 . . . . 0.0 105.448 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 76.73 -135.0 16.1 Favored Glycine 0 N--CA 1.444 -0.822 0 O-C-N 117.784 -3.072 . . . . 0.0 118.035 172.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.298 . . -78.28 36.83 0.25 Allowed 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 118.683 2.846 . . . . 0.0 118.683 -154.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.41 -15.64 2.7 Favored Glycine 0 N--CA 1.447 -0.594 1 C-N-CA 130.861 4.077 . . . . 0.0 113.626 168.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 3.9 tt -68.21 -15.45 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-O 114.091 -2.862 . . . . 0.0 116.217 -172.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -95.75 -27.32 15.31 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 127.183 2.802 . . . . 0.0 109.853 178.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.3 m -52.46 -39.98 61.74 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 124.289 3.222 . . . . 0.0 111.65 159.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 82' ' ' ILE . . . . . 0.483 HD12 ' CG2' ' D' ' 58' ' ' VAL 0.259 34.2 mm -71.28 -45.03 72.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 C-N-CA 125.447 1.499 . . . . 0.0 112.237 -176.607 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 19.5 p -86.4 -24.02 25.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 115.465 -2.207 . . . . 0.0 114.606 174.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -90.95 168.23 11.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 126.479 3.038 . . . . 0.0 106.099 177.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.11 147.33 18.52 Favored Glycine 0 N--CA 1.447 -0.585 0 CA-C-O 125.102 2.501 . . . . 0.0 107.527 172.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 5.9 m -68.15 -27.99 66.91 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 118.155 -2.968 . . . . 0.0 114.742 -154.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -128.42 33.99 4.61 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 122.786 1.279 . . . . 0.0 110.956 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 90.7 p -73.72 -177.84 2.92 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 118.16 -2.837 . . . . 0.0 111.686 170.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.6 tt -69.89 -23.88 63.32 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 117.364 -3.335 . . . . 0.0 112.725 -164.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -60.56 -17.46 46.29 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 128.802 2.841 . . . . 0.0 111.265 167.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.09 -35.62 10.75 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.062 -1.923 . . . . 0.0 110.311 175.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 56.96 80.54 0.28 Allowed Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 119.909 3.3 . . . . 0.0 119.909 -175.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 93' ' ' PRO . . . . . 0.559 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.413 67.2 Cg_exo 32.66 27.82 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.114 0 O-C-N 123.223 1.118 . . . . 0.0 114.399 46.197 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 47.9 t -51.17 -8.31 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 117.608 2.448 . . . . 0.0 117.608 174.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 95' ' ' GLU . . . . . 0.559 ' OE2' ' HA ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -117.72 -21.85 8.29 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 113.262 -1.79 . . . . 0.0 110.506 -173.195 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 40.3 tp -63.77 -53.79 45.47 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.761 -2.066 . . . . 0.0 109.657 151.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -46.1 -60.86 2.03 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 120.523 3.527 . . . . 0.0 120.523 171.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -60.41 -18.17 48.97 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 127.358 2.263 . . . . 0.0 115.03 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 59.1 t90 -88.3 -42.43 12.24 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 170.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 42.0 mt -51.62 -46.36 63.61 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 170.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -60.88 -35.08 75.71 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.797 2.839 . . . . 0.0 109.96 -170.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.61 9.31 21.69 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 127.194 2.197 . . . . 0.0 116.544 177.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 103' ' ' VAL . . . . . 0.438 HG11 ' CD1' ' C' ' 25' ' ' LEU . 88.6 t -125.24 -35.06 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 112.338 -2.21 . . . . 0.0 111.243 177.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 82.5 mt -97.7 -23.05 16.11 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.264 1.826 . . . . 0.0 114.376 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 60.0 mt -117.23 12.78 14.49 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 125.32 1.638 . . . . 0.0 107.021 -174.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -70.33 161.8 29.73 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 120.027 -1.67 . . . . 0.0 110.912 -174.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -62.67 -32.3 73.34 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 126.122 1.769 . . . . 0.0 111.928 -177.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 C--O 1.251 1.152 0 C-N-CA 127.823 2.449 . . . . 0.0 109.938 170.306 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.473 0.725 0 CA-C-O 118.425 -0.797 . . . . 0.0 109.843 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.46 -12.47 60.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.933 2.093 . . . . 0.0 113.848 -171.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -77.26 -29.93 54.17 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.429 -1.419 . . . . 0.0 111.183 162.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -83.84 -26.63 29.35 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 117.421 -1.712 . . . . 0.0 107.258 -171.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 53.6 p -84.36 151.17 58.95 Favored Pre-proline 0 N--CA 1.449 -0.508 0 O-C-N 119.908 -1.745 . . . . 0.0 112.588 -171.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . 0.304 77.0 Cg_exo -35.96 -52.16 1.02 Allowed 'Trans proline' 0 N--CA 1.448 -1.171 0 O-C-N 126.354 2.765 . . . . 0.0 115.691 -176.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -115.06 171.34 7.73 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 129.455 3.102 . . . . 0.0 111.803 174.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.5 t -130.01 108.38 10.05 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 128.951 2.9 . . . . 0.0 108.876 165.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.62 -19.83 61.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 126.091 2.12 . . . . 0.0 111.615 172.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.59 -33.43 69.03 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 131.409 3.883 . . . . 0.0 116.947 167.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 53.9 ttp -82.56 -23.25 34.56 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 120.524 -1.36 . . . . 0.0 110.453 169.23 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -38.2 90.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 126.786 2.554 . . . . 0.0 113.754 172.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -59.59 -48.42 81.73 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 115.127 -2.368 . . . . 0.0 109.112 170.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -67.48 -42.4 83.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 126.407 2.317 . . . . 0.0 110.981 -169.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 86.8 mmt-85 -66.01 -25.38 67.05 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 126.54 2.4 . . . . 0.0 114.504 175.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -82.1 -30.04 31.44 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.574 -0.704 . . . . 0.0 110.762 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -73.43 -27.97 61.72 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.813 -3.054 . . . . 0.0 112.039 169.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -63.18 -35.0 78.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 116.556 -3.84 . . . . 0.0 115.334 170.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -62.07 -53.61 53.1 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 128.151 3.834 . . . . 0.0 115.863 168.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.1 mt -67.59 -26.53 66.32 Favored 'General case' 0 N--CA 1.447 -0.609 1 O-C-N 112.933 -6.104 . . . . 0.0 116.977 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.445 HH12 ' CD ' ' B' ' 59' ' ' GLU . 67.0 ttt180 -49.33 -43.26 43.56 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 116.35 -1.786 . . . . 0.0 110.342 162.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -75.01 -23.21 58.18 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 114.954 -2.45 . . . . 0.0 115.764 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.3 t -81.65 -14.71 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 119.987 1.267 . . . . 0.0 113.177 171.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -88.88 -45.97 9.29 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 117.863 -3.023 . . . . 0.0 116.258 161.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.3 tp -54.18 -42.19 69.38 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 118.264 -2.772 . . . . 0.0 111.239 170.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.262 29.9 tp -67.12 -38.8 86.22 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.829 1.252 . . . . 0.0 114.092 175.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -67.47 -48.61 66.69 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 116.932 -1.508 . . . . 0.0 109.957 174.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.7 m-20 -59.06 -20.52 54.03 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 119.422 1.01 . . . . 0.0 113.586 174.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.29 -36.95 29.21 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -63.79 -44.58 92.94 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 119.314 -2.116 . . . . 0.0 112.538 168.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.77 -29.51 70.18 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.327 -1.797 . . . . 0.0 112.581 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -95.97 9.41 40.79 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.386 7.8 m-20 54.98 21.94 4.05 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 118.143 2.646 . . . . 0.0 118.143 -168.098 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.8 mt -89.47 9.15 27.53 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.27 -2.769 . . . . 0.0 107.143 172.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -55.63 -51.8 65.97 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.989 2.177 . . . . 0.0 113.587 -171.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.52 -53.36 52.47 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-O 115.84 -2.029 . . . . 0.0 114.221 177.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_exo -35.0 -53.02 0.69 Allowed 'Trans proline' 0 N--CA 1.448 -1.162 0 C-N-CA 122.563 2.175 . . . . 0.0 113.563 162.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.6 tp -74.87 -32.42 61.88 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.575 -3.203 . . . . 0.0 115.573 -171.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -63.43 -44.95 93.09 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 130.335 3.454 . . . . 0.0 114.782 171.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -60.76 -34.92 75.18 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 127.063 2.145 . . . . 0.0 108.995 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.0 tp -74.56 -42.87 58.03 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 120.517 3.525 . . . . 0.0 120.517 170.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 95.9 mmm -78.73 -21.5 47.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 114.745 -2.55 . . . . 0.0 116.857 177.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 mp -132.93 141.13 48.19 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.126 1.77 . . . . 0.0 108.041 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.3 p -80.39 153.76 74.03 Favored Pre-proline 0 N--CA 1.446 -0.628 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -55.68 -17.16 16.83 Favored 'Trans proline' 0 N--CA 1.452 -0.94 1 C-N-CA 125.594 4.196 . . . . 0.0 116.233 -173.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -76.88 -45.18 29.17 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 167.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . 0.279 42.1 mt-10 -74.7 -31.37 61.85 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 123.509 1.623 . . . . 0.0 109.997 -175.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -67.12 -54.41 21.64 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 119.361 -2.087 . . . . 0.0 115.374 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -47.75 -44.58 28.2 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.274 1.83 . . . . 0.0 112.738 163.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.81 -38.12 89.93 Favored 'General case' 0 N--CA 1.448 -0.561 1 O-C-N 114.787 -4.946 . . . . 0.0 114.962 174.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -62.77 -37.29 86.05 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 116.402 -1.761 . . . . 0.0 113.366 165.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.51 -36.83 48.27 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 119.999 2.76 . . . . 0.0 119.999 159.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.1 m -74.38 -40.62 61.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 120.996 2.398 . . . . 0.0 110.901 173.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.267 97.6 mtt180 -53.16 -36.11 60.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 67.3 t -63.18 -38.94 83.43 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 167.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.6 mtp180 -74.71 -25.74 59.35 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 114.726 -2.559 . . . . 0.0 110.759 175.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.251 63.2 mt -68.84 -51.09 48.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 115.514 -2.184 . . . . 0.0 108.857 167.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 53.9 t -62.38 -31.26 51.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 115.041 -2.409 . . . . 0.0 115.036 177.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -59.34 -55.46 34.44 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 127.454 2.971 . . . . 0.0 108.274 169.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -73.26 -14.86 61.41 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 122.658 2.481 . . . . 0.0 115.85 -178.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.9 mt -84.25 -27.38 27.95 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.318 1.847 . . . . 0.0 113.148 173.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.51 -18.37 41.78 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 117.934 -2.979 . . . . 0.0 118.336 165.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.6 ttm105 -82.22 -53.48 6.03 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 170.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.3 37.29 90.66 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 129.589 3.471 . . . . 0.0 107.727 170.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -86.32 -49.76 7.43 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 120.199 -1.765 . . . . 0.0 109.684 170.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 44.2 mtt -63.58 135.1 56.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 123.65 1.691 . . . . 0.0 109.527 165.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.2 p -99.37 -174.87 2.84 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 110.042 -3.254 . . . . 0.0 111.738 161.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -75.93 -33.49 59.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 117.359 -3.338 . . . . 0.0 109.132 -170.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.0 tpt85 -58.87 -26.97 64.74 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 131.067 3.747 . . . . 0.0 114.021 172.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -87.49 -42.93 12.42 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 120.283 -1.511 . . . . 0.0 111.971 173.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.31 -23.98 67.66 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -174.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.8 tptp -66.2 -40.1 90.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 113.958 -1.474 . . . . 0.0 110.864 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -83.64 -34.48 25.03 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 124.578 2.132 . . . . 0.0 112.456 179.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -85.25 -55.62 3.94 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.355 -2.716 . . . . 0.0 108.099 -170.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.0 mt -112.17 6.05 18.84 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 128.504 2.722 . . . . 0.0 114.343 -165.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.82 10.95 73.15 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-O 115.624 -2.765 . . . . 0.0 110.417 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.32 119.63 27.78 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 122.116 2.958 . . . . 0.0 118.312 -174.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.91 162.23 9.55 Favored Glycine 0 C--N 1.342 0.892 0 O-C-N 126.658 2.474 . . . . 0.0 118.396 159.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 52.1 mt -59.34 -45.84 92.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 131.535 3.934 . . . . 0.0 111.791 -172.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.33 -39.2 63.0 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -178.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.6 p -63.77 -41.35 97.99 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 114.785 -2.531 . . . . 0.0 117.364 169.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 31.0 mm -62.05 -37.34 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 125.931 3.968 . . . . 0.0 112.795 163.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . 0.369 54.3 m -64.67 -49.62 70.26 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.189 -2.194 . . . . 0.0 113.386 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -62.58 -53.47 54.23 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.248 -2.158 . . . . 0.0 107.653 173.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -41.75 -38.57 2.36 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 126.368 1.937 . . . . 0.0 115.609 175.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.4 m -77.03 -36.12 56.42 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 117.863 0.832 . . . . 0.0 110.274 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -68.44 -35.52 77.72 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 121.597 -0.69 . . . . 0.0 112.718 170.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 7.8 m -62.68 -38.26 89.64 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 173.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . 0.259 35.7 tp -68.28 -31.16 70.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.986 2.114 . . . . 0.0 113.926 174.376 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -84.35 -33.61 23.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 119.75 1.159 . . . . 0.0 112.434 171.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . 0.261 . . -71.48 -18.4 62.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 117.485 2.402 . . . . 0.0 117.485 166.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.56 136.76 92.47 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 158.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.5 153.03 79.29 Favored 'Trans proline' 0 N--CA 1.446 -1.288 0 CA-C-O 126.836 2.765 . . . . 0.0 113.831 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.5 m -61.8 -26.17 39.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-O 115.344 -2.265 . . . . 0.0 111.461 -169.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.266 22.9 pm0 -69.47 -32.45 71.37 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 123.414 2.824 . . . . 0.0 110.108 175.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 4.6 tp -76.13 -38.24 57.06 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 124.288 3.222 . . . . 0.0 113.162 173.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 56.1 mtm-85 -56.7 -37.06 70.39 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.57 1.948 . . . . 0.0 115.126 161.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -72.41 -31.19 65.32 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 121.748 2.067 . . . . 0.0 112.304 170.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -72.59 -50.07 27.92 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 115.586 -2.15 . . . . 0.0 116.24 172.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.27 -21.25 59.84 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 122.326 2.33 . . . . 0.0 110.912 -170.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -77.96 -15.39 59.02 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.691 1.996 . . . . 0.0 112.695 176.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -92.89 -33.27 14.28 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 121.854 2.116 . . . . 0.0 110.542 166.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . 0.411 47.0 t -84.16 -26.06 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-O 115.289 -2.291 . . . . 0.0 116.546 -168.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.7 mt -107.56 -3.99 18.8 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 123.692 1.71 . . . . 0.0 113.537 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 75.4 mt -133.45 8.64 3.95 Favored 'General case' 0 N--CA 1.447 -0.584 1 O-C-N 113.324 -5.86 . . . . 0.0 111.478 -156.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.6 mtpt -116.63 14.08 15.36 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 122.257 2.298 . . . . 0.0 115.668 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 67.1 m -110.24 -26.86 9.39 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 119.683 -1.886 . . . . 0.0 114.068 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 . . . . . 0 C--O 1.252 1.227 0 N-CA-C 121.721 3.971 . . . . 0.0 121.721 -165.876 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 47.3 ttp . . . . . 0 N--CA 1.474 0.759 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -52.83 -10.47 0.17 Allowed 'General case' 0 N--CA 1.45 -0.449 1 N-CA-C 122.763 4.357 . . . . 0.0 122.763 -177.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -106.86 -20.05 13.45 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 170.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -85.09 -37.99 19.64 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 116.527 -1.701 . . . . 0.0 109.272 174.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 29.4 m -78.36 140.13 60.34 Favored Pre-proline 0 N--CA 1.448 -0.535 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 177.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -63.12 -20.86 72.12 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 122.667 2.245 . . . . 0.0 114.094 178.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -131.73 130.81 42.42 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 120.906 1.685 . . . . 0.0 115.045 171.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.2 t -133.69 130.88 38.8 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 127.877 3.703 . . . . 0.0 107.386 166.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -86.71 -27.78 23.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 119.209 -2.182 . . . . 0.0 115.325 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.76 -34.51 73.07 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 122.651 1.215 . . . . 0.0 108.713 168.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . 0.295 42.6 mtt -65.13 -51.22 62.52 Favored 'General case' 0 N--CA 1.444 -0.751 0 O-C-N 121.523 -0.735 . . . . 0.0 111.226 176.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.59 -40.94 69.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.392 1.077 . . . . 0.0 113.834 177.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -70.74 -32.4 69.56 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 126.912 2.085 . . . . 0.0 110.68 177.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -73.93 -41.18 62.43 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 118.396 -2.69 . . . . 0.0 109.488 178.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -65.55 -42.51 91.78 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 169.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -63.8 -36.7 84.77 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 167.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -63.36 -40.74 98.09 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 117.307 -1.757 . . . . 0.0 113.476 170.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -53.17 -49.2 67.14 Favored 'General case' 0 N--CA 1.452 -0.36 1 O-C-N 115.79 -4.319 . . . . 0.0 111.617 172.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -52.64 -49.08 65.87 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 127.677 2.391 . . . . 0.0 110.631 171.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 79.4 mt -69.42 -30.32 68.23 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 116.175 -4.078 . . . . 0.0 109.677 -178.487 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -63.07 -26.43 68.83 Favored 'General case' 0 N--CA 1.453 -0.319 1 CA-C-N 126.057 4.026 . . . . 0.0 113.427 171.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -76.09 -46.12 30.56 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.186 1.794 . . . . 0.0 111.958 174.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 18.7 t -64.91 -37.81 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 119.941 -1.725 . . . . 0.0 106.417 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -64.36 -50.24 68.49 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.504 -1.998 . . . . 0.0 108.635 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 39.0 tp -60.67 -39.3 87.91 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 120.073 -1.642 . . . . 0.0 111.627 -174.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 23.8 tp -75.97 -35.94 59.45 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 119.449 -2.032 . . . . 0.0 112.375 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -48.36 -39.72 23.14 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 124.465 2.078 . . . . 0.0 112.988 168.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -89.06 -23.48 22.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 118.93 -2.357 . . . . 0.0 109.987 -176.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.55 -26.61 66.39 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-O 116.092 -1.909 . . . . 0.0 109.213 174.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -76.38 -30.32 57.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 127.15 2.18 . . . . 0.0 112.509 175.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -70.71 -26.25 63.32 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 165.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -105.76 -4.86 20.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 124.678 2.18 . . . . 0.0 110.897 -175.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.278 7.4 m-20 57.21 42.34 25.55 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 116.522 -3.861 . . . . 0.0 111.797 -175.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 22.9 mt -120.31 13.46 11.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.842 2.457 . . . . 0.0 112.619 174.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -65.07 -39.91 93.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 112.78 -3.486 . . . . 0.0 114.375 174.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 11.3 mt -55.04 -48.28 96.43 Favored Pre-proline 0 N--CA 1.452 -0.346 0 CA-C-N 121.899 2.136 . . . . 0.0 112.857 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.302 58.4 Cg_endo -66.77 -40.76 12.08 Favored 'Trans proline' 0 N--CA 1.445 -1.352 0 O-C-N 117.581 -1.852 . . . . 0.0 114.787 172.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' B' ' 38' ' ' LEU . 24.0 tp -52.66 -40.71 63.12 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 125.581 1.801 . . . . 0.0 109.722 174.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 68.8 mt -80.65 -36.64 32.23 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.133 -2.854 . . . . 0.0 110.335 -171.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -60.88 -42.0 97.1 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 173.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 46.4 tp -67.41 -45.11 77.11 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.866 1.266 . . . . 0.0 111.095 -175.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 14.9 mmt -75.1 -34.4 61.72 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.778 2.031 . . . . 0.0 115.415 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 33.7 mt -128.1 122.69 32.67 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 125.235 1.414 . . . . 0.0 109.218 -170.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 35.7 p -75.32 162.6 72.23 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 126.331 1.852 . . . . 0.0 114.978 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . 0.274 9.7 Cg_endo -67.8 -21.28 44.78 Favored 'Trans proline' 0 N--CA 1.446 -1.31 0 CA-C-N 125.136 2.87 . . . . 0.0 116.244 -164.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.61 -37.63 73.88 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.552 1.941 . . . . 0.0 111.543 169.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -72.62 -35.24 67.78 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 173.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 45.9 mtm-85 -66.61 -37.3 84.58 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 116.209 -1.853 . . . . 0.0 112.715 169.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.46 -46.75 87.87 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 126.3 2.25 . . . . 0.0 115.662 165.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.2 -30.11 66.0 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 116.734 -1.603 . . . . 0.0 109.307 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 17.7 mt -75.42 -28.43 59.4 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 121.238 1.836 . . . . 0.0 113.989 174.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.41 -41.47 77.47 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 125.504 1.526 . . . . 0.0 111.971 172.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 27.2 m -76.44 -37.65 56.69 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.011 -0.995 . . . . 0.0 112.119 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -58.92 -31.14 68.39 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 124.874 1.359 . . . . 0.0 108.797 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 91.9 t -59.16 -49.22 84.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 O-C-N 116.895 -3.628 . . . . 0.0 115.279 167.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -56.51 -32.92 65.53 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 116.94 -3.6 . . . . 0.0 109.432 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 62.9 mt -72.04 -44.59 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-O 115.912 -1.994 . . . . 0.0 114.746 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 54.7 t -66.88 -41.69 87.99 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 119.638 1.108 . . . . 0.0 110.439 176.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' GLU . . . . . 0.445 ' CD ' HH12 ' A' ' 21' ' ' ARG . 36.5 tt0 -52.47 -41.07 63.02 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 169.204 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -82.78 -25.19 33.0 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 117.579 2.437 . . . . 0.0 117.579 173.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' LEU . . . . . 0.446 HD23 ' HA ' ' B' ' 61' ' ' LEU . 14.0 mt -48.79 -44.74 39.31 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 120.332 1.424 . . . . 0.0 113.657 154.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 44.3 mt -85.73 -2.61 58.39 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 115.158 -2.353 . . . . 0.0 114.426 -178.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 ttm105 -93.34 -71.7 0.64 Allowed 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 125.634 1.834 . . . . 0.0 114.701 176.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.16 55.75 1.92 Allowed Glycine 0 CA--C 1.525 0.702 0 CA-C-N 114.3 -1.318 . . . . 0.0 113.338 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -137.83 -8.3 1.62 Allowed 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 127.656 2.382 . . . . 0.0 115.441 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 40.4 mtt -89.82 133.37 34.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 167.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -62.27 160.41 13.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 127.883 2.473 . . . . 0.0 116.287 156.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -50.52 -43.29 55.87 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.576 -1.202 . . . . 0.0 111.237 172.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -58.88 -45.4 90.31 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 126.885 2.616 . . . . 0.0 114.281 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -67.12 -46.22 74.79 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.092 2.957 . . . . 0.0 109.998 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' B' ' 71' ' ' LEU . 34.3 mt -48.77 -56.11 9.58 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.927 1.691 . . . . 0.0 109.014 171.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 34.7 tptt -66.9 -31.74 72.53 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 115.477 1.658 . . . . 0.0 115.477 -174.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -126.21 0.73 7.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 120.919 1.69 . . . . 0.0 112.914 -167.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -124.1 -6.4 7.79 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.77 1.228 . . . . 0.0 114.143 171.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 33.1 mt -127.88 -10.98 5.46 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 129.395 3.078 . . . . 0.0 117.051 165.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 79.45 11.87 84.4 Favored Glycine 0 CA--C 1.524 0.63 0 C-N-CA 126.453 1.978 . . . . 0.0 117.383 178.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.92 114.32 28.32 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 129.956 3.302 . . . . 0.0 115.038 -164.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.54 171.56 36.57 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 127.205 2.336 . . . . 0.0 111.736 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 mt -48.98 -47.2 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 131.603 3.961 . . . . 0.0 111.856 172.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.1 -55.77 16.86 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.997 -2.314 . . . . 0.0 114.211 176.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 27.2 m -46.18 -45.44 16.79 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 118.178 2.658 . . . . 0.0 118.178 165.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 18.4 mm -67.34 -45.42 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 O-C-N 116.909 -3.62 . . . . 0.0 113.896 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 5.7 m -47.75 -40.27 20.14 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 169.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -74.39 -37.74 63.33 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.853 2.461 . . . . 0.0 113.703 -176.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -72.73 -37.31 57.57 Favored Glycine 0 N--CA 1.447 -0.587 0 O-C-N 119.01 -2.306 . . . . 0.0 116.67 165.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 37.9 m -64.4 -42.06 96.32 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 119.097 -2.413 . . . . 0.0 113.834 176.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -61.8 -37.47 84.49 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 120.757 -1.214 . . . . 0.0 112.328 168.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 37.2 m -75.69 -30.2 59.27 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.913 0.863 . . . . 0.0 113.025 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.83 -44.02 94.28 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 114.917 -2.468 . . . . 0.0 113.182 164.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 61.1 mttt -51.36 -45.62 62.46 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 127.109 2.755 . . . . 0.0 111.725 169.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.81 -30.55 65.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -176.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.76 155.06 92.39 Favored Pre-proline 0 N--CA 1.45 -0.44 0 C-N-CA 128.055 2.542 . . . . 0.0 113.221 -171.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . 0.271 23.9 Cg_exo -63.38 156.28 57.1 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 O-C-N 117.184 -2.061 . . . . 0.0 116.424 176.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -61.89 -40.83 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 O-C-N 118.41 -2.682 . . . . 0.0 113.791 170.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.325 23.0 pm0 -61.02 -26.07 67.35 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 114.08 -2.867 . . . . 0.0 114.984 170.161 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.3 tp -84.89 -44.58 13.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 122.311 2.323 . . . . 0.0 105.597 178.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 23.2 mtm-85 -64.5 -27.13 68.76 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 116.347 -3.971 . . . . 0.0 116.696 -177.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -75.2 -33.31 61.4 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.24 0.543 . . . . 0.0 111.657 178.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -69.74 -52.56 24.29 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.976 2.11 . . . . 0.0 105.886 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.3 mt -65.07 -43.68 91.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.697 0.799 . . . . 0.0 112.043 -172.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -59.86 -36.29 76.56 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.838 0.455 . . . . 0.0 110.245 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -68.83 -46.22 69.11 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 116.226 1.936 . . . . 0.0 116.226 171.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.7 t -71.16 -57.57 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 113.905 -2.95 . . . . 0.0 112.362 174.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.84 -18.81 63.46 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 126.544 2.402 . . . . 0.0 113.616 -163.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 31.4 mt -97.09 -36.27 10.54 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 116.941 -3.599 . . . . 0.0 109.236 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -88.3 19.79 3.59 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 116.37 -3.956 . . . . 0.0 109.508 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . 0.363 69.0 m -87.94 -25.62 23.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 131.289 3.836 . . . . 0.0 114.26 160.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 . . . . . 0 C--O 1.25 1.088 0 O-C-N 116.511 -3.868 . . . . 0.0 112.132 166.991 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ttt . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.12 128.22 33.01 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 126.006 2.066 . . . . 0.0 110.668 -176.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -122.76 135.73 54.65 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 126.392 2.307 . . . . 0.0 113.277 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -120.58 156.38 31.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.078 0.951 . . . . 0.0 111.466 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -129.85 165.68 31.63 Favored Pre-proline 0 N--CA 1.45 -0.438 1 C-N-CA 132.367 4.267 . . . . 0.0 113.214 169.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -81.6 -20.57 6.73 Favored 'Trans proline' 0 N--CA 1.449 -1.107 0 N-CA-C 116.175 1.567 . . . . 0.0 116.175 -179.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -138.96 160.61 39.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.891 1.994 . . . . 0.0 108.951 170.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 28.0 t -151.58 124.45 8.58 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 129.46 3.104 . . . . 0.0 110.405 176.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.68 -26.5 61.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 124.183 1.944 . . . . 0.0 113.188 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.87 -37.42 14.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 117.424 -3.298 . . . . 0.0 117.036 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 64.3 mtt -61.2 -33.85 74.14 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 126.27 2.232 . . . . 0.0 111.167 163.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.9 -42.65 99.86 Favored 'General case' 0 N--CA 1.446 -0.664 1 O-C-N 115.61 -4.431 . . . . 0.0 115.279 168.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -75.23 -25.73 58.36 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 120.283 -1.511 . . . . 0.0 113.945 175.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -62.03 -37.17 83.92 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 120.765 -1.209 . . . . 0.0 109.48 160.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -36.6 84.64 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 119.732 -1.855 . . . . 0.0 112.92 174.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -68.61 -33.31 73.83 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 124.302 2.001 . . . . 0.0 116.327 174.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -77.35 -24.12 50.77 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 129.918 3.287 . . . . 0.0 117.038 173.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -70.52 -36.56 73.81 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 125.092 2.377 . . . . 0.0 112.611 161.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 9.4 t-105 -63.45 -58.3 7.48 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 118.555 -2.59 . . . . 0.0 112.628 167.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 20.9 mt -56.63 -29.21 61.96 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 124.573 3.351 . . . . 0.0 109.772 -176.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -82.94 -23.92 33.26 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 122.007 2.185 . . . . 0.0 113.238 -177.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -62.6 -40.31 96.52 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 114.482 -2.675 . . . . 0.0 110.294 162.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.37 -49.94 67.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 116.002 -1.951 . . . . 0.0 110.202 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -60.52 -39.65 88.6 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 122.411 2.368 . . . . 0.0 115.902 176.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 63.7 tp -65.1 -41.63 94.78 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 127.291 2.236 . . . . 0.0 107.556 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 12.0 tp -74.1 -43.77 56.4 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 122.545 1.164 . . . . 0.0 111.682 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -57.09 -28.93 63.07 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 164.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . 0.277 91.7 m-20 -79.02 -24.1 43.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 129.364 3.066 . . . . 0.0 113.812 176.002 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.24 -6.21 54.25 Favored 'General case' 0 N--CA 1.448 -0.555 1 O-C-N 115.607 -4.433 . . . . 0.0 112.018 176.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -76.09 -21.93 56.16 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.533 171.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -65.08 -23.92 67.3 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 120.287 -1.508 . . . . 0.0 111.342 177.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -138.43 7.73 2.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 119.817 -1.802 . . . . 0.0 113.107 -163.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 50.8 28.16 3.49 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.684 2.476 . . . . 0.0 117.684 -168.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 50.1 mt -88.86 19.12 4.25 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 118.873 0.76 . . . . 0.0 110.302 164.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -64.94 -46.33 82.04 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 119.243 -2.161 . . . . 0.0 115.43 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.333 71.6 mt -68.86 -41.93 22.01 Favored Pre-proline 0 N--CA 1.452 -0.358 0 C-N-CA 127.685 2.394 . . . . 0.0 113.936 169.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_exo -58.93 -48.83 13.0 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 C-N-CA 121.668 1.579 . . . . 0.0 115.569 170.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 66.3 tp -53.86 -45.56 71.02 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 118.132 -2.855 . . . . 0.0 115.05 167.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 20.5 mt -68.24 -26.42 65.68 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 118.938 -1.105 . . . . 0.0 112.986 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -77.85 -39.13 44.48 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 127.782 2.433 . . . . 0.0 108.159 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 38.7 tp -56.71 -48.03 78.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 125.217 2.437 . . . . 0.0 111.835 167.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 7.8 mmt -84.03 -15.48 47.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 112.194 -3.765 . . . . 0.0 113.721 -167.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mp -135.34 157.53 46.66 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 126.724 2.515 . . . . 0.0 114.662 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 34.7 p -76.44 151.78 83.28 Favored Pre-proline 0 N--CA 1.448 -0.555 0 CA-C-O 114.023 -2.894 . . . . 0.0 111.32 161.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -63.46 -27.23 70.45 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 CA-C-N 123.797 2.392 . . . . 0.0 112.177 179.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.05 -44.0 74.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 115.713 -2.089 . . . . 0.0 110.922 170.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -71.13 -28.57 64.39 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 116.465 -1.731 . . . . 0.0 110.754 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 48' ' ' ARG . . . . . 0.401 ' HD2' ' CZ2' ' D' ' 19' ' ' TRP . 88.1 mtm-85 -71.61 -46.49 59.02 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 121.722 2.056 . . . . 0.0 109.267 176.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.15 -30.71 71.81 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.851 -1.78 . . . . 0.0 114.237 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.31 -50.4 63.75 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.786 2.434 . . . . 0.0 110.095 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 51' ' ' LEU . . . . . 0.493 HD13 ' CE1' ' D' ' 22' ' ' PHE . 9.2 mt -65.81 -40.28 91.72 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 122.147 2.249 . . . . 0.0 108.676 -179.376 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.9 -38.57 94.29 Favored Glycine 0 C--N 1.337 0.605 0 O-C-N 117.186 -3.446 . . . . 0.0 115.706 171.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 20.8 m -66.65 -38.69 87.39 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 114.341 -2.742 . . . . 0.0 110.59 169.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -61.71 -29.91 70.42 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 121.109 1.777 . . . . 0.0 112.642 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 91.2 t -69.5 -43.07 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 123.113 2.688 . . . . 0.0 108.812 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -70.15 -28.8 65.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 113.144 -3.312 . . . . 0.0 113.065 174.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 9.4 mt -56.31 -57.61 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 124.852 3.478 . . . . 0.0 112.168 157.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 57.5 t -57.11 -40.48 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 CA-C-O 117.17 -1.395 . . . . 0.0 111.429 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -61.4 -45.82 92.72 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.719 2.008 . . . . 0.0 106.166 178.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -68.28 -32.96 73.5 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 120.309 1.413 . . . . 0.0 111.453 -176.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 22.4 mt -76.58 -22.89 53.64 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 124.564 1.146 . . . . 0.0 109.359 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 80.7 mt -80.17 -44.18 20.28 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 117.509 -3.244 . . . . 0.0 113.713 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttm105 -57.0 -39.26 74.35 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.492 2.317 . . . . 0.0 115.664 170.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 57.77 26.83 58.26 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 126.81 2.148 . . . . 0.0 117.269 171.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -97.07 -7.37 32.96 Favored 'General case' 0 N--CA 1.449 -0.495 1 CA-C-O 111.474 -4.108 . . . . 0.0 108.569 170.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 50.6 mtt -69.55 147.68 50.45 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 125.864 3.938 . . . . 0.0 116.621 167.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 88.6 p -106.8 168.2 9.35 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.352 1.461 . . . . 0.0 107.706 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -46.53 -30.15 2.1 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 176.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 29.9 ttp-105 -59.01 -55.01 40.62 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 126.22 2.2 . . . . 0.0 113.686 176.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . 0.319 1.7 mt-10 -70.27 -40.66 74.24 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 -174.216 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 22.5 mt -53.43 -35.63 60.65 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 119.073 -2.267 . . . . 0.0 112.469 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -91.32 -30.68 16.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.895 2.078 . . . . 0.0 112.747 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -97.83 -59.17 1.82 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 119.514 1.052 . . . . 0.0 111.22 -171.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -70.31 -42.18 72.32 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 116.559 -2.056 . . . . 0.0 113.804 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mp -90.0 -15.42 31.93 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 127.629 2.371 . . . . 0.0 112.427 -172.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 60.93 -105.47 0.86 Allowed Glycine 0 N--CA 1.448 -0.535 0 CA-C-O 116.711 -2.161 . . . . 0.0 116.753 168.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.24 -17.44 2.68 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 129.887 3.275 . . . . 0.0 112.839 -169.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.54 -13.82 71.62 Favored Glycine 0 N--CA 1.45 -0.399 0 O-C-N 118.177 -2.827 . . . . 0.0 114.236 172.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 3.9 tt -56.48 -39.86 64.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 CA-C-N 114.765 -0.718 . . . . 0.0 109.949 174.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.1 -12.77 59.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 126.916 3.246 . . . . 0.0 112.585 -170.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 11.0 m -69.69 -46.45 66.0 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 116.927 -3.608 . . . . 0.0 107.191 166.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 46.4 mm -66.96 -40.18 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 N-CA-C 116.781 2.141 . . . . 0.0 116.781 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 40.5 p -100.69 -17.77 16.83 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -167.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 60.4 mtp85 -103.62 161.51 13.84 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 114.819 -2.515 . . . . 0.0 115.288 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.33 158.51 30.0 Favored Glycine 0 CA--C 1.524 0.618 0 O-C-N 126.053 2.095 . . . . 0.0 117.838 -177.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 88.9 p -63.85 4.83 0.26 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 118.135 2.642 . . . . 0.0 118.135 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -115.78 -5.25 12.09 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 3.2 p -68.21 177.12 2.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.287 1.835 . . . . 0.0 113.233 -154.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 15.3 tp -58.05 -26.49 62.55 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 116.272 -1.823 . . . . 0.0 111.703 -167.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -106.14 7.63 31.75 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 113.933 -2.937 . . . . 0.0 111.73 176.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -111.91 -5.74 14.32 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 129.976 3.31 . . . . 0.0 113.353 167.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.79 151.09 89.78 Favored Pre-proline 0 N--CA 1.452 -0.334 0 C-N-CA 127.076 2.15 . . . . 0.0 115.449 171.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -55.69 139.02 82.82 Favored 'Trans proline' 0 N--CA 1.448 -1.193 0 CA-C-N 120.324 1.151 . . . . 0.0 112.238 174.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 99.0 t -72.22 -30.94 37.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 124.714 1.206 . . . . 0.0 108.266 -166.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -60.75 -19.7 59.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.956 2.947 . . . . 0.0 118.956 161.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 43.8 tp -84.02 -47.25 11.15 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.322 -0.861 . . . . 0.0 109.53 168.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 76.8 mtp180 -56.85 -49.9 74.06 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 115.894 -2.003 . . . . 0.0 109.812 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -53.09 -50.61 64.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.026 1.73 . . . . 0.0 109.294 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 61.0 t90 -75.1 -33.21 61.6 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.817 1.247 . . . . 0.0 112.271 -165.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 82.3 mt -63.49 -26.07 68.55 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 116.635 -3.791 . . . . 0.0 114.657 166.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -72.97 -27.39 61.79 Favored 'General case' 0 N--CA 1.45 -0.436 1 O-C-N 114.549 -5.094 . . . . 0.0 108.041 169.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -80.3 -24.17 40.18 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . 0.317 99.5 t -97.95 -28.18 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 124.73 3.423 . . . . 0.0 116.382 177.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 18.6 mt -110.52 -29.05 8.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.268 1.827 . . . . 0.0 112.973 -172.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 71.3 mt -121.0 30.54 6.81 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -75.49 147.52 39.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.578 1.951 . . . . 0.0 113.168 162.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 14.7 m -101.39 53.22 0.83 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 129.219 3.008 . . . . 0.0 110.306 177.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 21.8 t70 . . . . . 0 C--O 1.252 1.198 0 O-C-N 118.164 -2.835 . . . . 0.0 113.293 -171.814 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 28.2 ttp . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.11 145.93 40.53 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.606 1.963 . . . . 0.0 116.237 -177.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -142.97 146.61 34.09 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.088 1.355 . . . . 0.0 112.39 176.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -151.48 155.77 39.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.244 1.417 . . . . 0.0 111.397 -178.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 5' ' ' SER . . . . . 0.448 ' HB2' ' HD2' ' D' ' 6' ' ' PRO . 90.9 p -77.85 171.26 12.93 Favored Pre-proline 0 N--CA 1.45 -0.439 0 C-N-CA 126.028 1.731 . . . . 0.0 110.17 164.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 6' ' ' PRO . . . . . 0.448 ' HD2' ' HB2' ' D' ' 5' ' ' SER . 37.5 Cg_endo -79.92 -44.03 0.12 Allowed 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 124.652 3.568 . . . . 0.0 112.112 155.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -152.66 140.24 19.79 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 155.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 36.0 t -67.13 121.22 15.14 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 109.805 -3.361 . . . . 0.0 110.849 -173.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . 0.263 . . -56.97 -21.26 28.98 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 117.711 -1.138 . . . . 0.0 110.659 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.5 -29.18 17.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.889 2.476 . . . . 0.0 113.556 -172.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.3 21.7 mmt -64.95 -37.48 87.79 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.888 -0.577 . . . . 0.0 112.189 158.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.81 -35.14 80.15 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 117.147 2.277 . . . . 0.0 117.147 173.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -60.73 -58.25 9.25 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.957 -2.965 . . . . 0.0 108.233 159.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -47.3 -38.38 12.52 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 117.907 -2.995 . . . . 0.0 118.815 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.39 5.8 49.23 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 131.408 3.883 . . . . 0.0 115.074 -173.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -104.93 -22.62 13.11 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 117.046 -1.454 . . . . 0.0 107.949 146.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -77.29 -34.08 55.61 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 123.23 2.741 . . . . 0.0 112.294 -176.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -66.5 -15.3 63.27 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 171.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 19' ' ' TRP . . . . . 0.401 ' CZ2' ' HD2' ' C' ' 48' ' ' ARG . 28.6 t-105 -82.96 -37.18 24.45 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 167.156 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.17 -15.34 62.93 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 114.501 -2.666 . . . . 0.0 111.095 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -65.15 -49.58 69.32 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 114.012 -2.899 . . . . 0.0 105.714 164.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 22' ' ' PHE . . . . . 0.493 ' CE1' HD13 ' C' ' 51' ' ' LEU . 74.4 t80 -70.05 -38.76 75.89 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 122.177 2.262 . . . . 0.0 111.207 -172.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 20.7 t -66.19 -34.84 72.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 C-N-CA 128.317 2.647 . . . . 0.0 111.032 171.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -75.31 -37.83 60.6 Favored 'General case' 0 N--CA 1.448 -0.539 1 O-C-N 115.302 -4.624 . . . . 0.0 115.46 167.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 tp -69.09 -33.07 72.94 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 24.8 tp -73.85 -46.07 47.24 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 121.426 -0.796 . . . . 0.0 110.066 -177.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -58.03 -46.05 85.94 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 126.222 1.809 . . . . 0.0 112.097 172.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -52.35 -30.44 28.63 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 166.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 -29.24 30.87 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.436 1.094 . . . . 0.0 113.369 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -50.54 -40.57 52.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 125.264 2.459 . . . . 0.0 111.246 167.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -75.44 -30.18 59.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 118.834 -2.416 . . . . 0.0 113.744 -158.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 53.3 p-10 -111.18 14.17 21.79 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 128.922 3.889 . . . . 0.0 118.448 168.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 52.89 54.82 9.88 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 14.9 mt -121.33 5.42 10.22 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 129.305 3.042 . . . . 0.0 110.749 171.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -61.89 2.26 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 116.428 -1.748 . . . . 0.0 112.071 174.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 4.2 mt -52.15 -45.74 93.8 Favored Pre-proline 0 N--CA 1.45 -0.445 0 CA-C-O 115.183 -2.342 . . . . 0.0 115.22 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.24 -20.55 14.39 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 114.714 -3.057 . . . . 0.0 114.159 172.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 12.0 tp -68.01 -35.73 78.78 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 124.126 3.148 . . . . 0.0 113.18 169.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 24.3 mt -71.05 -36.37 72.29 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 123.227 1.489 . . . . 0.0 107.15 -175.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 35.3 m-20 -78.58 -26.99 45.6 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.863 1.792 . . . . 0.0 112.688 -175.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -68.02 -48.45 65.65 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.143 166.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 65.1 mmm -65.47 -34.63 78.74 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 114.892 -2.48 . . . . 0.0 114.858 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -115.16 144.76 43.18 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 122.231 2.287 . . . . 0.0 116.798 -172.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 70.1 p -67.62 148.78 98.54 Favored Pre-proline 0 N--CA 1.452 -0.37 0 O-C-N 117.161 -3.462 . . . . 0.0 110.035 167.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -35.79 -54.15 0.81 Allowed 'Trans proline' 0 N--CA 1.451 -1.009 1 C-N-CA 127.072 5.181 . . . . 0.0 113.438 171.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -71.37 -9.63 58.47 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 -178.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . 0.251 38.8 mt-10 -86.43 -41.63 14.28 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 120.398 -1.439 . . . . 0.0 112.321 163.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -59.88 -36.5 77.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 125.216 2.436 . . . . 0.0 114.455 172.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -74.43 -40.19 62.12 Favored 'General case' 0 N--CA 1.451 -0.412 1 C-N-CA 134.76 5.224 . . . . 0.0 108.404 -175.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.28 -41.4 63.65 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 116.605 -3.809 . . . . 0.0 112.736 171.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 50.8 mt -59.65 -44.87 93.38 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 119.833 -1.792 . . . . 0.0 107.904 178.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.22 -33.38 85.77 Favored Glycine 0 CA--C 1.523 0.576 0 C-N-CA 118.563 -1.78 . . . . 0.0 114.884 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 97.6 m -78.96 -24.03 44.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 119.577 -2.131 . . . . 0.0 111.156 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 27.0 mtt180 -75.26 -20.67 59.05 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 117.579 -1.649 . . . . 0.0 113.105 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 99.3 t -49.56 -61.02 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 114.731 -2.556 . . . . 0.0 115.763 159.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -65.27 -26.07 67.92 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 126.187 2.179 . . . . 0.0 113.515 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 57' ' ' ILE . . . . . 0.404 HG12 ' HB3' ' D' ' 75' ' ' LEU . 36.5 mt -67.51 -52.09 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 129.711 3.204 . . . . 0.0 107.831 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 55.0 t -54.49 -39.62 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 125.984 1.714 . . . . 0.0 115.618 165.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -58.1 -60.73 3.28 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 122.98 1.371 . . . . 0.0 114.005 176.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -57.24 -37.86 72.93 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 128.725 2.81 . . . . 0.0 110.525 176.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 7.2 mt -61.06 -41.34 96.44 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 115.857 -2.337 . . . . 0.0 114.262 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 31.5 mt -67.84 -40.62 83.68 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.521 2.328 . . . . 0.0 110.91 170.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -63.9 -42.6 97.39 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 115.214 1.561 . . . . 0.0 115.214 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 52.0 61.2 6.73 Favored Glycine 0 CA--C 1.521 0.443 0 O-C-N 116.841 -3.662 . . . . 0.0 116.019 -173.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -139.31 -37.63 0.5 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 121.005 2.402 . . . . 0.0 106.972 -174.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 49.1 mtt -93.08 52.68 1.84 Allowed 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 118.9 -2.375 . . . . 0.0 113.724 159.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 31.1 p -95.01 -174.85 3.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 121.405 3.854 . . . . 0.0 121.405 -172.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.25 4.4 tp-100 56.3 -76.24 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 129.101 2.96 . . . . 0.0 115.431 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 49.8 ttt85 -88.25 -34.95 17.56 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 121.565 1.984 . . . . 0.0 114.137 169.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -74.67 -51.84 13.27 Favored 'General case' 0 N--CA 1.446 -0.674 0 O-C-N 118.829 -2.419 . . . . 0.0 116.504 -157.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -35.66 -47.97 0.5 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.517 1.127 . . . . 0.0 112.757 161.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -68.91 -27.24 65.59 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 116.948 2.203 . . . . 0.0 116.948 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -105.32 -31.73 8.93 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 124.796 2.236 . . . . 0.0 112.823 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -87.67 -36.45 17.43 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.537 2.051 . . . . 0.0 116.537 -172.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 75' ' ' LEU . . . . . 0.404 ' HB3' HG12 ' D' ' 57' ' ' ILE . 0.8 OUTLIER -110.19 -36.31 5.86 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.714 2.006 . . . . 0.0 108.638 175.977 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 59.61 -113.01 4.81 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 118.885 2.314 . . . . 0.0 118.885 167.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.57 2.91 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 120.94 3.681 . . . . 0.0 120.94 -159.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -110.94 -7.2 25.56 Favored Glycine 0 CA--C 1.526 0.774 0 O-C-N 119.736 -1.852 . . . . 0.0 111.512 170.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 4.9 tt -73.91 -19.43 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 118.839 -2.566 . . . . 0.0 114.3 -166.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -97.34 -11.85 23.53 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 119.589 1.086 . . . . 0.0 109.466 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.2 m -79.54 -55.43 5.05 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 106.376 -1.712 . . . . 0.0 106.376 161.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.327 20.4 mm -58.18 -26.98 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 118.141 -2.849 . . . . 0.0 114.599 176.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 30.9 p -111.08 8.55 21.85 Favored 'General case' 0 N--CA 1.451 -0.401 1 N-CA-C 123.34 4.57 . . . . 0.0 123.34 177.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -112.03 -144.58 0.39 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 114.915 -2.469 . . . . 0.0 106.519 164.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 75.77 155.3 5.38 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-N 122.959 2.618 . . . . 0.0 109.757 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 94.1 p -71.66 -30.8 66.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 176.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -138.9 43.16 2.09 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 -167.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 96.6 p -84.14 -179.32 7.2 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 124.074 1.892 . . . . 0.0 112.053 173.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.267 1.6 mp -69.46 -9.0 51.81 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 112.665 -2.061 . . . . 0.0 114.676 175.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 22.6 tttt -71.81 -16.44 62.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 115.618 1.711 . . . . 0.0 115.618 155.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -101.08 -41.88 6.59 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 120.057 -1.652 . . . . 0.0 109.515 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 92' ' ' ALA . . . . . 0.493 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 59.62 91.66 0.07 OUTLIER Pre-proline 0 N--CA 1.452 -0.345 0 CA-C-N 120.695 1.589 . . . . 0.0 109.997 -174.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 93' ' ' PRO . . . . . 0.493 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.285 97.9 Cg_exo 37.4 35.72 0.0 OUTLIER 'Cis proline' 0 N--CA 1.448 -1.161 0 N-CA-C 116.756 1.791 . . . . 0.0 116.756 29.823 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 94' ' ' VAL . . . . . 0.481 HG22 ' HB1' ' D' ' 92' ' ' ALA . 61.1 t -66.76 -18.22 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 C-N-CA 128.327 2.651 . . . . 0.0 111.324 -172.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.55 -28.11 9.06 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -166.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 36.9 tp -57.69 -46.06 84.81 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 120.531 -1.356 . . . . 0.0 110.884 151.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -67.5 -49.24 64.34 Favored 'General case' 0 N--CA 1.451 -0.408 1 O-C-N 116.135 -4.103 . . . . 0.0 112.184 -175.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -61.0 -2.61 0.61 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 114.383 -2.722 . . . . 0.0 111.811 172.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -103.87 -54.18 2.61 Favored 'General case' 0 N--CA 1.45 -0.438 1 CA-C-N 127.74 4.791 . . . . 0.0 110.888 171.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 92.1 mt -48.81 -42.56 36.46 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.8 1.24 . . . . 0.0 107.657 174.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -66.99 -35.54 80.17 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.574 -0.704 . . . . 0.0 112.372 -173.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -80.51 -24.35 39.46 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 120.612 1.551 . . . . 0.0 109.136 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 78.1 t -100.88 -15.2 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 123.908 3.049 . . . . 0.0 107.626 -168.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 83.9 mt -112.9 -16.22 12.74 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 121.487 1.949 . . . . 0.0 112.463 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.353 25.1 mt -98.4 16.34 21.96 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 171.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 15.6 pttp -77.77 161.52 27.62 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.741 2.016 . . . . 0.0 114.131 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 5.4 m -80.74 -9.66 59.79 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 117.893 -3.005 . . . . 0.0 117.797 -164.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-N 121.851 2.114 . . . . 0.0 112.913 -176.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.468 0.443 0 N-CA-C 111.536 0.198 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.63 -11.6 59.88 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 118.503 2.779 . . . . 0.0 118.503 -168.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -84.2 -31.13 25.25 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 118.804 -2.435 . . . . 0.0 116.435 166.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -79.46 -17.48 54.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 126.75 2.531 . . . . 0.0 113.177 178.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 59.0 p -73.75 139.75 77.51 Favored Pre-proline 0 N--CA 1.446 -0.634 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -175.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -53.18 -26.57 34.07 Favored 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 122.162 1.908 . . . . 0.0 114.558 175.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -143.78 152.42 41.21 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.587 0.708 . . . . 0.0 111.059 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.25 8.6 t -119.31 93.95 4.26 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.307 3.043 . . . . 0.0 110.831 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.51 -20.82 64.6 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 116.834 -1.555 . . . . 0.0 110.379 168.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.29 -44.47 87.87 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 129.199 3.0 . . . . 0.0 112.18 167.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 56.6 ttp -76.55 -29.84 56.85 Favored 'General case' 0 N--CA 1.448 -0.549 1 O-C-N 114.317 -5.239 . . . . 0.0 109.863 174.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.97 -49.81 76.46 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 117.08 -3.513 . . . . 0.0 114.959 168.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -54.31 -43.13 70.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 122.711 1.243 . . . . 0.0 112.452 173.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -55.42 -53.11 60.33 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 122.78 1.276 . . . . 0.0 112.313 174.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -69.94 -40.57 75.42 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 116.576 -1.678 . . . . 0.0 109.372 -175.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -47.8 -33.35 7.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 125.768 2.699 . . . . 0.0 116.067 171.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . 0.309 2.6 mp0 -73.55 -31.7 63.79 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 117.772 -3.08 . . . . 0.0 113.008 173.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -76.08 -19.8 58.26 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 119.401 -2.062 . . . . 0.0 110.014 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.47 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG 0.34 38.7 t-105 -71.18 -50.06 37.22 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.184 2.994 . . . . 0.0 114.981 166.304 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.54 -27.38 68.58 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.027 1.731 . . . . 0.0 114.514 173.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -75.05 -35.06 61.91 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 116.566 2.061 . . . . 0.0 116.566 165.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.38 -50.27 70.15 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 119.883 1.219 . . . . 0.0 112.806 161.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.4 t -76.96 -25.58 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 CA-C-O 115.414 -2.232 . . . . 0.0 113.811 -173.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -61.02 -55.74 29.21 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 115.405 -2.236 . . . . 0.0 114.893 155.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 48.9 tp -56.18 -37.43 69.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 121.011 1.732 . . . . 0.0 113.154 -173.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 23.4 tp -68.23 -46.84 69.43 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 110.082 -3.235 . . . . 0.0 114.411 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -60.88 -42.47 97.99 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 118.569 -2.582 . . . . 0.0 112.023 174.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.89 -32.23 71.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 126.221 2.201 . . . . 0.0 111.996 173.133 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.505 ' HB2' HD22 ' A' ' 38' ' ' LEU . . . -66.88 -36.68 82.84 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 111.883 -3.913 . . . . 0.0 108.971 171.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -62.64 -34.05 76.26 Favored 'General case' 0 N--CA 1.448 -0.547 1 CA-C-N 130.116 5.871 . . . . 0.0 115.328 168.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.328 77.1 mt-30 -64.6 -21.2 66.65 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 116.972 2.212 . . . . 0.0 116.972 170.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -109.02 10.57 26.17 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 124.701 1.25 . . . . 0.0 108.623 173.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 52.66 27.21 5.0 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 116.737 -3.727 . . . . 0.0 118.265 -168.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.2 mt -102.54 6.69 40.03 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 117.491 -3.255 . . . . 0.0 112.004 -172.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -72.22 -30.59 65.07 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.561 1.544 . . . . 0.0 110.755 -158.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 56.4 mt -63.6 -59.23 12.28 Favored Pre-proline 0 N--CA 1.451 -0.396 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 167.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -49.96 -33.91 35.67 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 CA-C-N 124.994 2.819 . . . . 0.0 113.454 170.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.505 HD22 ' HB2' ' A' ' 29' ' ' ALA . 13.3 tp -64.44 -52.08 59.87 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 122.281 2.31 . . . . 0.0 116.097 174.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.3 mt -60.68 -35.09 75.41 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.13 1.772 . . . . 0.0 114.78 168.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 -73.87 -30.75 62.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 121.801 2.091 . . . . 0.0 108.02 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.275 19.6 tp -78.36 -36.93 45.41 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 116.78 -3.7 . . . . 0.0 111.272 176.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 62.1 mmm -70.68 -20.28 62.7 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 118.279 2.696 . . . . 0.0 118.279 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.426 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 10.5 mt -137.32 125.15 22.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 130.342 3.457 . . . . 0.0 114.278 178.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 66.8 p -67.16 152.19 96.35 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-O 114.715 -2.564 . . . . 0.0 108.855 175.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -59.32 -26.83 83.24 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 N-CA-C 119.163 2.717 . . . . 0.0 119.163 -159.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -63.59 -44.55 93.67 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 125.645 1.84 . . . . 0.0 108.143 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 21.9 mt-10 -59.13 -44.9 92.06 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 131.673 3.989 . . . . 0.0 114.353 177.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.6 mtm180 -65.48 -54.67 25.02 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.889 3.276 . . . . 0.0 113.266 172.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -47.42 -36.32 9.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 165.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.12 -38.74 79.05 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 118.595 -2.565 . . . . 0.0 114.057 169.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.9 mt -66.7 -32.49 73.84 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 116.672 -1.632 . . . . 0.0 107.076 178.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.93 -50.74 62.67 Favored Glycine 0 CA--C 1.523 0.57 0 CA-C-N 120.287 1.403 . . . . 0.0 110.986 166.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.5 m -60.74 -33.85 73.53 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 120.723 2.261 . . . . 0.0 110.804 -175.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -73.18 -25.95 60.99 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 120.926 1.694 . . . . 0.0 109.092 -170.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 85.8 t -58.49 -43.4 86.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 C-N-CA 124.695 1.198 . . . . 0.0 112.44 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 -67.16 -43.21 82.83 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 129.271 3.028 . . . . 0.0 112.227 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 81.8 mt -54.11 -54.64 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 125.114 1.509 . . . . 0.0 111.09 165.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.7 t -66.1 -26.2 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 120.729 1.604 . . . . 0.0 112.263 176.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . 0.25 11.0 tt0 -63.67 -53.39 52.07 Favored 'General case' 0 N--CA 1.446 -0.652 1 O-C-N 116.066 -4.146 . . . . 0.0 111.396 170.095 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -75.63 -23.05 56.33 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 117.17 -3.456 . . . . 0.0 113.02 -175.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 80.3 mt -76.31 -34.88 59.04 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 119.011 -2.306 . . . . 0.0 112.224 165.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 63.2 mt -73.55 -50.12 22.95 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 116.792 -3.693 . . . . 0.0 113.105 173.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.7 ttm180 -43.05 -41.54 3.54 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 116.532 -3.855 . . . . 0.0 115.424 161.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 59.11 29.71 65.91 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 120.278 2.871 . . . . 0.0 120.278 172.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -95.75 -43.13 8.02 Favored 'General case' 0 N--CA 1.444 -0.725 1 C-N-CA 131.746 4.019 . . . . 0.0 114.505 175.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 40.8 mtt -69.48 130.54 42.78 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 168.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.7 p -78.73 172.19 14.08 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.933 2.093 . . . . 0.0 113.074 158.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -50.54 -44.4 56.44 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 128.106 2.562 . . . . 0.0 113.995 171.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -61.9 -27.1 68.57 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 118.935 -2.353 . . . . 0.0 115.517 177.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -84.26 -54.64 4.66 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 126.994 2.118 . . . . 0.0 111.788 -178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.5 mt -46.74 -29.71 2.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 119.127 3.01 . . . . 0.0 119.127 164.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -72.86 -18.4 61.44 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.795 2.038 . . . . 0.0 114.53 173.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -91.99 -74.27 0.52 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.106 2.162 . . . . 0.0 110.628 160.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -66.22 -21.78 66.32 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 127.105 2.753 . . . . 0.0 112.238 -151.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 13.0 mt -120.07 -26.79 5.46 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 120.254 -1.529 . . . . 0.0 108.425 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.51 15.47 27.24 Favored Glycine 0 CA--C 1.526 0.774 0 C-N-CA 126.137 1.827 . . . . 0.0 115.993 170.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.52 126.79 35.12 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 126.248 1.793 . . . . 0.0 113.784 -164.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.21 157.16 49.63 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-O 122.079 0.821 . . . . 0.0 113.927 175.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.4 mt -57.09 -48.79 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.52 -33.42 66.04 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 117.561 -1.209 . . . . 0.0 113.562 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.6 p -67.64 -44.35 78.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 122.005 0.907 . . . . 0.0 111.091 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.3 mm -70.94 -33.79 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.276 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 15.0 m -56.14 -61.79 2.15 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 118.487 -2.633 . . . . 0.0 113.661 165.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -58.02 -36.49 72.78 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 130.673 3.589 . . . . 0.0 114.013 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.59 -36.76 32.56 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-O 115.008 -3.107 . . . . 0.0 108.172 -177.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 68.8 m -63.56 -52.97 58.76 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 119.368 1.584 . . . . 0.0 113.373 168.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -57.11 -31.52 65.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.754 -1.593 . . . . 0.0 110.285 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.7 m -77.06 -25.8 52.83 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 124.865 3.484 . . . . 0.0 113.479 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 29.3 tp -82.62 -42.43 18.24 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 119.222 3.045 . . . . 0.0 119.222 174.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -59.38 -39.88 84.73 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 125.179 1.391 . . . . 0.0 111.335 162.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.11 -35.77 78.67 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 117.283 -1.767 . . . . 0.0 113.762 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -50.47 142.59 15.04 Favored Pre-proline 0 N--CA 1.448 -0.532 0 CA-C-O 116.597 -1.668 . . . . 0.0 113.573 175.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.7 145.32 36.7 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 CA-C-N 121.472 1.561 . . . . 0.0 111.624 -168.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 m -57.26 -32.25 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -168.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -55.42 -36.03 66.03 Favored 'General case' 0 N--CA 1.445 -0.723 1 O-C-N 113.409 -5.807 . . . . 0.0 114.79 174.059 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 33.5 tp -67.31 -39.31 85.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 114.268 -2.777 . . . . 0.0 115.373 169.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 87.1 mtm-85 -66.82 -43.12 84.62 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 125.375 1.672 . . . . 0.0 110.467 168.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -61.63 -28.3 69.27 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 125.171 1.544 . . . . 0.0 108.7 -176.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 22.1 t90 -75.14 -61.74 1.79 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 170.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 92.1 mt -51.35 -38.47 53.35 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -58.25 -31.0 66.99 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 120.94 -1.1 . . . . 0.0 112.764 172.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -83.54 -19.28 35.95 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 120.144 -1.597 . . . . 0.0 114.743 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 21.2 t -95.81 -55.39 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 1 C-N-CA 133.105 4.562 . . . . 0.0 111.1 -176.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.6 mt -89.32 -15.56 33.15 Favored 'General case' 0 N--CA 1.448 -0.533 1 O-C-N 115.35 -4.594 . . . . 0.0 110.433 -171.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 59.4 mt -116.5 4.58 13.29 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 122.829 2.559 . . . . 0.0 113.634 -172.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mttp -115.74 11.04 15.56 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 123.874 0.734 . . . . 0.0 112.886 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.0 m -87.0 -40.55 14.64 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 127.524 2.33 . . . . 0.0 113.267 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 116.15 -1.881 . . . . 0.0 115.532 -171.138 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.2 ttt . . . . . 0 N--CA 1.47 0.528 0 CA-C-O 117.079 -1.439 . . . . 0.0 114.208 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.292 . . -65.0 -39.2 93.11 Favored 'General case' 0 N--CA 1.448 -0.543 1 N-CA-C 122.632 4.308 . . . . 0.0 122.632 -171.8 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -62.63 -33.85 75.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 121.315 1.871 . . . . 0.0 112.375 -177.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -85.83 -23.06 27.3 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 118.13 -2.856 . . . . 0.0 116.205 171.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 39.5 m -58.77 139.75 86.22 Favored Pre-proline 0 N--CA 1.449 -0.49 0 C-N-CA 130.686 3.594 . . . . 0.0 113.14 174.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.75 -27.38 18.21 Favored 'Trans proline' 0 N--CA 1.448 -1.186 0 C-N-CA 123.112 2.541 . . . . 0.0 110.138 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -124.78 150.46 46.27 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.62 2.768 . . . . 0.0 112.997 171.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 39.2 t -145.7 114.25 6.77 Favored 'General case' 0 N--CA 1.45 -0.472 1 O-C-N 114.203 -5.311 . . . . 0.0 116.271 166.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.2 -17.07 60.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 117.331 -1.319 . . . . 0.0 112.176 172.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.22 -40.63 74.4 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 125.548 1.78 . . . . 0.0 114.505 174.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 51.7 mtt -69.39 -38.52 78.02 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 116.319 -1.801 . . . . 0.0 108.776 168.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.11 -41.38 98.17 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 124.126 3.148 . . . . 0.0 109.787 -173.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -71.98 -26.18 62.15 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 119.867 -1.771 . . . . 0.0 113.96 173.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -73.94 -36.27 64.62 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 117.974 -2.954 . . . . 0.0 112.135 169.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -72.43 -34.33 67.73 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 116.433 -1.746 . . . . 0.0 112.775 177.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 69.1 t60 -62.15 -46.14 90.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 127.862 3.226 . . . . 0.0 109.512 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -64.58 -35.19 80.2 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 117.374 -3.329 . . . . 0.0 115.805 168.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -70.06 -22.54 63.06 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 119.706 -1.872 . . . . 0.0 111.887 176.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -85.16 -47.69 9.88 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 128.361 2.664 . . . . 0.0 106.936 174.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . 0.253 45.5 mt -49.98 -24.57 2.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 118.12 2.637 . . . . 0.0 118.12 174.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 50.9 ttt180 -68.19 -33.63 74.8 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.938 -2.351 . . . . 0.0 112.196 173.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -66.28 -43.47 86.3 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 127.142 2.177 . . . . 0.0 110.971 176.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 38.6 t -58.97 -38.69 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 129.988 3.315 . . . . 0.0 115.545 173.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -71.44 -41.9 68.89 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 113.249 -1.796 . . . . 0.0 113.696 166.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 48.5 tp -60.38 -36.31 77.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 173.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.328 55.2 tp -80.77 -37.15 30.86 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 115.537 -2.173 . . . . 0.0 111.229 178.638 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -56.91 -44.41 82.37 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 116.491 -2.084 . . . . 0.0 114.398 167.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 50.6 m-20 -73.45 -26.49 60.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 120.19 1.359 . . . . 0.0 111.929 -172.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.86 -36.21 62.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.494 1.918 . . . . 0.0 114.939 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -60.79 -33.75 73.46 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 116.21 -1.853 . . . . 0.0 114.813 159.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -67.55 -29.22 68.54 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 122.529 2.422 . . . . 0.0 112.221 171.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -96.8 -0.1 48.53 Favored 'General case' 0 N--CA 1.447 -0.599 1 CA-C-O 111.465 -4.112 . . . . 0.0 110.174 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.46 0.4 OUTLIER 57.92 14.09 2.43 Favored 'General case' 0 N--CA 1.445 -0.683 1 C-N-CA 131.94 4.096 . . . . 0.0 117.163 -178.438 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' B' ' 34' ' ' LEU . 20.5 mt -88.96 22.08 2.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 129.115 2.966 . . . . 0.0 109.722 -177.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -88.39 -20.61 25.04 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 117.456 2.391 . . . . 0.0 117.456 -157.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 23.5 mt -73.2 -56.62 3.2 Favored Pre-proline 0 N--CA 1.449 -0.497 0 CA-C-N 112.089 -2.323 . . . . 0.0 111.747 170.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -62.62 -27.96 76.68 Favored 'Trans proline' 0 N--CA 1.448 -1.15 1 C-N-CA 125.698 4.265 . . . . 0.0 112.814 178.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 41.9 tp -73.35 -37.66 65.99 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.849 1.968 . . . . 0.0 106.903 -178.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 80.7 mt -70.84 -38.69 73.2 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 125.522 2.582 . . . . 0.0 112.189 175.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -57.39 -29.31 63.97 Favored 'General case' 0 N--CA 1.449 -0.5 1 O-C-N 114.531 -5.105 . . . . 0.0 113.578 165.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 45.0 tp -78.5 -48.02 16.16 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 117.283 -3.386 . . . . 0.0 111.904 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 11.4 mmt -82.89 -11.23 58.37 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -167.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 1.1 mp -140.61 128.32 21.65 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.287 1.835 . . . . 0.0 112.354 -169.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 66.8 p -80.19 160.63 67.72 Favored Pre-proline 0 N--CA 1.449 -0.48 0 CA-C-O 115.385 -2.245 . . . . 0.0 110.334 -178.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -55.16 -36.36 92.96 Favored 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 124.895 3.73 . . . . 0.0 113.784 -169.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.32 -26.28 38.87 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 124.468 1.105 . . . . 0.0 110.155 -172.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -67.49 -47.27 70.52 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 119.084 -2.26 . . . . 0.0 110.91 167.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' ARG . . . . . 0.47 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 62.7 mtm-85 -63.58 -41.35 98.38 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 125.163 1.539 . . . . 0.0 115.064 178.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.57 -39.31 93.51 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 118.891 -2.38 . . . . 0.0 114.876 169.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.62 -46.96 65.03 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 18.8 mt -53.09 -34.93 58.83 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 117.04 -3.537 . . . . 0.0 116.492 169.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.96 -24.17 71.47 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 110.688 -2.96 . . . . 0.0 115.967 172.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.5 m -101.88 -22.35 14.35 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 114.926 -2.464 . . . . 0.0 110.969 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -63.32 -21.62 66.37 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 121.311 1.869 . . . . 0.0 112.643 166.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 10.5 t -54.16 -49.37 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 O-C-N 116.599 -3.813 . . . . 0.0 114.424 163.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 -74.07 -31.84 63.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 96.3 mt -70.73 -46.97 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 3.3 t -63.23 -36.2 75.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 O-C-N 116.975 -3.578 . . . . 0.0 111.634 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.16 -41.94 76.24 Favored 'General case' 0 N--CA 1.452 -0.35 1 O-C-N 115.861 -4.274 . . . . 0.0 116.396 169.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -80.08 -17.33 52.95 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 129.951 3.3 . . . . 0.0 112.468 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 54.6 mt -82.73 -9.78 59.2 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 117.183 -3.448 . . . . 0.0 111.027 168.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 89.3 mt -107.38 -31.33 8.22 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 128.413 2.685 . . . . 0.0 112.079 169.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 16.5 ttm105 -70.66 -54.46 11.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.692 1.738 . . . . 0.0 115.692 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.68 54.61 30.22 Favored Glycine 0 C--N 1.337 0.622 0 CA-C-O 115.301 -2.944 . . . . 0.0 117.111 -170.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -126.95 -17.01 4.99 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 117.152 2.278 . . . . 0.0 117.152 175.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 81.4 mtp -102.93 146.44 28.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.208 -2.183 . . . . 0.0 111.731 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -93.54 172.55 8.2 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 118.471 -2.643 . . . . 0.0 107.845 172.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -58.4 -37.41 75.25 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 175.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -55.25 -36.51 66.14 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 126.298 2.951 . . . . 0.0 118.208 172.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -85.08 -38.92 18.57 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 128.284 2.634 . . . . 0.0 106.681 -174.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 73.3 mt -58.56 -42.49 88.06 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 117.056 -3.527 . . . . 0.0 111.491 170.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 tptt -59.26 -65.92 0.59 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 127.757 2.423 . . . . 0.0 111.02 173.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -74.16 -29.75 61.93 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 114.687 -2.805 . . . . 0.0 114.147 -168.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . 0.31 39.6 mt-10 -115.91 -23.62 8.5 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 114.867 -2.492 . . . . 0.0 114.422 -162.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mt -104.85 -6.1 20.53 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 126.092 2.12 . . . . 0.0 114.389 162.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.94 16.8 70.91 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 119.672 -1.251 . . . . 0.0 113.496 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.55 134.72 34.18 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 122.833 3.316 . . . . 0.0 117.808 -179.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.17 -173.24 7.43 Favored Glycine 0 C--N 1.334 0.456 0 CA-C-O 124.527 2.181 . . . . 0.0 111.848 158.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 97.3 mt -83.13 -44.98 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 O-C-N 117.255 -3.497 . . . . 0.0 113.146 -177.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.97 -23.26 52.34 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 -169.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 17.2 m -66.04 -44.31 85.0 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.315 1.446 . . . . 0.0 113.841 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 21.1 mm -76.74 -30.14 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 C-N-CA 125.916 1.686 . . . . 0.0 107.663 173.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 6.7 m -59.4 -50.72 72.86 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 120.245 -1.534 . . . . 0.0 111.003 169.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -61.72 -42.18 98.61 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -48.55 -44.54 29.31 Favored Glycine 0 N--CA 1.446 -0.657 1 C-N-CA 131.038 4.161 . . . . 0.0 109.7 176.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 3.6 p -74.02 -35.83 64.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.361 1.465 . . . . 0.0 114.055 -178.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -69.59 -41.19 76.11 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 127.514 2.326 . . . . 0.0 107.702 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 6.0 m -72.51 -31.99 65.79 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 119.33 -2.107 . . . . 0.0 115.057 -176.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.09 -25.86 20.53 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 115.913 -1.994 . . . . 0.0 106.682 -177.416 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 58.1 tttm -64.4 -48.67 74.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 121.993 2.179 . . . . 0.0 105.234 172.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.18 3.94 25.29 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 117.368 -3.332 . . . . 0.0 116.671 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.7 141.71 64.91 Favored Pre-proline 0 N--CA 1.45 -0.425 0 O-C-N 117.49 -3.256 . . . . 0.0 113.157 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -49.03 124.99 12.35 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 123.192 2.595 . . . . 0.0 116.891 172.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.31 -23.56 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 1 O-C-N 115.887 -4.258 . . . . 0.0 115.571 -172.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -60.36 -30.25 69.43 Favored 'General case' 0 N--CA 1.453 -0.308 1 O-C-N 114.865 -4.897 . . . . 0.0 111.877 171.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 14.7 tp -79.35 -36.79 38.86 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 117.39 -1.291 . . . . 0.0 110.655 171.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 32.0 mtm-85 -65.78 -39.77 91.33 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.832 2.16 . . . . 0.0 116.832 171.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -58.23 -39.37 78.92 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 130.296 3.438 . . . . 0.0 112.013 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -61.44 -59.2 5.61 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 128.188 2.595 . . . . 0.0 114.347 163.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 50.5 mt -75.11 -25.4 58.45 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 122.036 2.198 . . . . 0.0 114.529 -165.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -52.53 -35.79 54.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 129.71 3.204 . . . . 0.0 110.814 170.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -95.47 -47.71 6.15 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.156 2.183 . . . . 0.0 114.021 175.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.9 t -68.16 -20.78 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 O-C-N 119.749 -1.844 . . . . 0.0 112.928 -170.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 50.9 mt -107.14 -42.99 4.72 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -176.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 11.5 mt -77.35 -5.76 50.8 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.007 -1.451 . . . . 0.0 114.066 -174.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -104.29 -2.56 25.41 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 117.268 2.322 . . . . 0.0 117.268 169.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 31.6 m -79.68 -1.13 36.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 114.338 -2.744 . . . . 0.0 114.051 164.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 . . . . . 0 C--O 1.25 1.107 0 CA-C-N 124.905 3.502 . . . . 0.0 109.523 -178.689 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 11.5 ttt . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 116.941 -1.504 . . . . 0.0 111.581 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.263 . . -57.39 141.96 45.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 129.049 2.94 . . . . 0.0 104.646 178.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -120.11 149.66 41.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 123.921 0.763 . . . . 0.0 111.301 -176.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -141.2 148.37 39.83 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 174.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 60.4 p -159.67 158.47 27.38 Favored Pre-proline 0 N--CA 1.446 -0.646 1 C-N-CA 132.77 4.428 . . . . 0.0 111.025 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -52.91 -47.82 25.45 Favored 'Trans proline' 0 N--CA 1.45 -1.076 0 C-N-CA 122.376 2.051 . . . . 0.0 113.58 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -139.88 141.52 36.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 117.308 -3.37 . . . . 0.0 110.951 -171.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 11.9 t -141.95 137.38 31.22 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 112.684 -2.053 . . . . 0.0 106.341 168.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.89 -42.76 94.51 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 117.546 2.424 . . . . 0.0 117.546 174.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.85 -33.38 23.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 168.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 47.6 mtt -83.44 -37.83 22.69 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 115.189 -2.338 . . . . 0.0 113.43 175.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.85 -37.31 71.11 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 123.224 2.738 . . . . 0.0 112.802 166.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -67.52 -38.36 84.12 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 119.389 -2.069 . . . . 0.0 114.661 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -72.22 -25.97 61.85 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.074 -1.641 . . . . 0.0 111.626 176.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -39.59 86.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 125.888 2.756 . . . . 0.0 113.237 169.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -69.54 -48.83 59.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 119.439 -2.038 . . . . 0.0 108.856 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -70.34 -24.85 63.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 115.265 -2.302 . . . . 0.0 110.552 -175.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -56.8 -48.9 76.89 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.482 2.313 . . . . 0.0 113.138 161.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 -56.29 -64.74 0.76 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 170.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 20' ' ' LEU . . . . . 0.477 HD13 ' HA ' ' C' ' 20' ' ' LEU . 4.4 mm? -57.7 -33.08 68.01 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.901 2.08 . . . . 0.0 106.342 -175.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -66.74 -36.12 81.71 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 112.721 -3.514 . . . . 0.0 115.995 167.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -64.78 -37.57 88.05 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 122.747 2.521 . . . . 0.0 107.329 169.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.57 -23.38 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 O-C-N 116.647 -3.783 . . . . 0.0 111.521 176.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -83.6 -40.94 18.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 172.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 32.0 tp -56.13 -41.77 75.85 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 119.268 0.94 . . . . 0.0 111.674 171.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 37.3 tp -72.67 -31.58 65.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 123.962 1.839 . . . . 0.0 113.101 -177.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -83.81 -18.71 36.73 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 119.265 -2.147 . . . . 0.0 114.285 176.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -74.27 -38.87 63.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 116.665 -1.636 . . . . 0.0 112.714 160.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.3 -21.68 62.91 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.13 -5.76 37.81 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 120.34 1.427 . . . . 0.0 108.435 173.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -80.1 -38.55 31.42 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 121.936 2.153 . . . . 0.0 111.473 -176.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . 0.277 25.2 p-10 -120.5 33.11 5.71 Favored 'General case' 0 N--CA 1.451 -0.406 1 O-C-N 115.528 -4.483 . . . . 0.0 116.034 169.89 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 61.48 33.6 18.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 131.097 3.759 . . . . 0.0 117.499 171.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 42.0 mt -103.32 10.22 37.61 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.759 1.623 . . . . 0.0 109.593 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -74.04 -32.62 63.41 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 118.384 -2.698 . . . . 0.0 114.601 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 11.3 mt -78.04 -42.57 2.18 Favored Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-O 116.278 -1.82 . . . . 0.0 108.839 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -59.45 -34.64 97.23 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 CA-C-O 115.306 -2.039 . . . . 0.0 113.578 166.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 14.3 tp -61.66 -43.77 98.23 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.768 1.918 . . . . 0.0 113.654 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -67.01 -25.51 66.33 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 173.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -75.14 -19.08 60.07 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 169.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 38.2 tp -84.2 -55.17 4.33 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 126.027 2.079 . . . . 0.0 113.672 168.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 9.1 mmt -73.93 -24.41 59.66 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 119.13 -2.232 . . . . 0.0 110.973 -162.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 11.1 mp -127.25 132.6 50.33 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 129.743 3.217 . . . . 0.0 111.623 -171.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -73.06 157.23 88.81 Favored Pre-proline 0 N--CA 1.448 -0.532 0 C-N-CA 125.787 1.635 . . . . 0.0 108.622 172.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -45.94 -32.44 9.54 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 121.393 1.396 . . . . 0.0 113.451 168.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -39.88 87.35 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 122.097 0.951 . . . . 0.0 113.368 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -72.76 -47.12 49.47 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 129.797 3.239 . . . . 0.0 109.919 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 48' ' ' ARG . . . . . 0.465 ' HD2' ' CZ2' ' D' ' 19' ' ' TRP . 58.0 mtm-85 -56.95 -41.54 78.47 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 175.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -70.69 -33.08 70.52 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 172.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.16 -39.58 82.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 171.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 20.9 mt -61.84 -33.2 73.74 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 122.238 2.29 . . . . 0.0 113.612 167.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.42 -27.32 73.84 Favored Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.834 171.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 93.8 m -82.18 -43.61 17.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.034 -2.45 . . . . 0.0 112.131 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -57.25 -36.61 71.18 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 114.214 -2.803 . . . . 0.0 115.298 169.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 22.1 t -51.05 -44.53 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-O 113.585 -3.102 . . . . 0.0 113.926 162.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 16.0 mtp180 -62.14 -28.51 69.69 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 124.698 3.408 . . . . 0.0 112.846 171.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 67.7 mt -80.93 -32.88 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 C-N-CA 119.297 -0.961 . . . . 0.0 111.577 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 92.4 t -66.98 -48.97 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 117.593 -1.194 . . . . 0.0 110.801 165.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -58.47 -50.77 72.55 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -177.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -66.81 -37.01 83.69 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 115.385 -2.245 . . . . 0.0 111.107 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 94.1 mt -70.0 -21.46 63.21 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 116.844 2.164 . . . . 0.0 116.844 173.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 19.7 mt -78.49 -23.69 46.27 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 169.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -71.48 -44.6 64.42 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.874 -2.391 . . . . 0.0 110.868 168.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 65.76 22.78 70.35 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-O 125.235 2.575 . . . . 0.0 116.87 174.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -99.03 -21.52 16.17 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 117.964 -3.08 . . . . 0.0 111.077 -176.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 12.0 mtt -71.89 127.19 31.76 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 120.529 -1.357 . . . . 0.0 112.223 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 60.4 p -74.64 163.01 28.2 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 126.146 2.154 . . . . 0.0 111.382 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -37.89 -41.9 0.57 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 116.191 1.923 . . . . 0.0 116.191 171.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 31.8 ttp-105 -60.75 -48.41 81.9 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 121.912 0.863 . . . . 0.0 111.687 176.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -67.47 -34.17 76.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.97 2.108 . . . . 0.0 106.565 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 68.5 mt -68.72 -30.94 69.68 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 119.069 -2.269 . . . . 0.0 111.82 172.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 39.7 tttp -73.99 -42.34 60.57 Favored 'General case' 0 N--CA 1.453 -0.283 1 O-C-N 115.093 -4.754 . . . . 0.0 116.341 170.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -76.13 -21.6 56.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.84 1.256 . . . . 0.0 109.535 -170.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -124.69 -39.71 2.27 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 117.422 -1.275 . . . . 0.0 114.238 -170.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.326 5.6 mp -102.01 -15.56 16.75 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 115.869 -2.015 . . . . 0.0 109.588 -168.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 76' ' ' GLY . . . . . 0.425 ' O ' HG22 ' C' ' 79' ' ' ILE . . . 48.2 -131.11 19.58 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 128.433 2.921 . . . . 0.0 117.328 158.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.25 -22.28 33.1 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.575 -2.133 . . . . 0.0 111.926 -174.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.23 -15.13 81.85 Favored Glycine 0 CA--C 1.523 0.588 0 C-N-CA 127.065 2.269 . . . . 0.0 112.032 -169.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 79' ' ' ILE . . . . . 0.425 HG22 ' O ' ' C' ' 76' ' ' GLY . 17.5 tt -58.64 -33.84 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 125.535 1.534 . . . . 0.0 110.155 -178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.6 -32.7 74.19 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 120.897 -1.127 . . . . 0.0 113.505 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 2.9 m -62.79 -44.03 97.23 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 117.462 -3.274 . . . . 0.0 109.454 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 39.0 mm -88.36 -18.26 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 129.385 3.074 . . . . 0.0 112.054 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 71.7 p -110.93 -11.05 14.37 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 120.701 3.593 . . . . 0.0 120.701 174.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 43.3 mtp85 -115.29 156.1 26.07 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.426 -3.296 . . . . 0.0 113.335 174.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.86 172.22 45.61 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 128.034 2.73 . . . . 0.0 112.783 -177.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 97.2 p -89.86 10.08 25.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 116.976 -3.661 . . . . 0.0 117.776 -176.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -104.55 0.85 29.13 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 118.002 -2.936 . . . . 0.0 114.215 161.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 99.9 p -59.23 172.83 0.55 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 126.459 3.028 . . . . 0.0 115.753 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 26.5 tp -70.72 -12.44 61.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 111.015 -2.811 . . . . 0.0 111.3 -170.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -124.02 0.98 8.58 Favored 'General case' 0 N--CA 1.451 -0.376 1 O-C-N 116.262 -4.024 . . . . 0.0 110.328 177.279 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -113.36 -21.33 10.96 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 121.535 3.902 . . . . 0.0 121.535 173.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.42 157.78 4.62 Favored Pre-proline 0 N--CA 1.452 -0.352 0 C-N-CA 129.499 3.12 . . . . 0.0 112.994 170.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -56.98 129.05 32.47 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 N-CA-C 114.389 0.88 . . . . 0.0 114.389 173.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 61.8 t -59.78 -30.84 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 C-N-CA 128.907 2.883 . . . . 0.0 112.0 -162.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -62.59 -24.42 67.55 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 176.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 4.6 tp -68.35 -55.77 10.87 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 115.594 -2.146 . . . . 0.0 110.136 168.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 59.6 mtp180 -48.49 -40.79 27.83 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 128.593 2.757 . . . . 0.0 108.589 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -70.89 -52.84 17.71 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.613 1.965 . . . . 0.0 112.46 -179.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 32.8 t90 -46.7 -40.71 13.79 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 116.833 -3.667 . . . . 0.0 117.829 168.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 27.9 mt -75.46 -22.02 57.64 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.237 -175.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -78.64 -34.34 46.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 117.696 -1.145 . . . . 0.0 108.658 172.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -68.94 -18.57 64.11 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 125.245 1.418 . . . . 0.0 110.869 -178.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 96.9 t -105.58 -40.77 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 C-N-CA 127.819 2.448 . . . . 0.0 115.808 -177.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -103.51 -16.37 15.58 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 128.743 2.817 . . . . 0.0 111.728 -167.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 23.9 mt -120.44 -3.47 9.91 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 121.317 1.871 . . . . 0.0 112.427 -177.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -60.6 153.59 23.31 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 118.242 -2.786 . . . . 0.0 117.754 -171.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 72.4 m -121.7 76.15 1.25 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 124.565 2.126 . . . . 0.0 106.796 178.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 27.8 t70 . . . . . 0 C--O 1.247 0.959 0 C-N-CA 129.228 3.011 . . . . 0.0 109.734 -177.506 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 64.6 ttp . . . . . 0 N--CA 1.467 0.383 0 N-CA-C 112.953 0.724 . . . . 0.0 112.953 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.62 156.97 38.76 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 119.056 2.984 . . . . 0.0 119.056 -166.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -138.08 142.24 40.25 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 130.366 3.466 . . . . 0.0 110.968 -172.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -133.0 121.13 22.3 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 123.86 1.79 . . . . 0.0 107.999 -168.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 66.9 p -72.14 150.4 92.25 Favored Pre-proline 0 N--CA 1.446 -0.625 0 CA-C-O 114.699 -2.572 . . . . 0.0 115.084 172.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -61.96 -19.55 66.39 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 CA-C-N 122.709 2.003 . . . . 0.0 117.239 172.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . 0.354 49.5 t80 -173.78 148.1 1.43 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.386 2.274 . . . . 0.0 106.804 171.088 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 11.9 t -62.19 128.64 37.07 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 103.236 -2.875 . . . . 0.0 103.236 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.42 -25.26 61.41 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 112.826 -1.988 . . . . 0.0 111.205 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.93 -36.4 83.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 119.072 -2.267 . . . . 0.0 114.457 165.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -66.63 -33.91 76.71 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 177.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . 0.28 . . -60.86 -35.41 76.51 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 118.257 -2.777 . . . . 0.0 109.602 175.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -70.85 -50.88 30.49 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.292 -2.13 . . . . 0.0 106.726 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -54.77 -46.23 74.37 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.28 2.232 . . . . 0.0 108.15 -170.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -31.36 71.32 Favored 'General case' 0 N--CA 1.45 -0.459 1 O-C-N 115.872 -4.268 . . . . 0.0 110.647 -168.594 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.6 t60 -76.56 -27.67 55.98 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 164.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -67.67 -33.21 74.47 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 118.017 -2.927 . . . . 0.0 116.139 169.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -74.99 -26.55 59.65 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 128.833 2.853 . . . . 0.0 115.196 167.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 19' ' ' TRP . . . . . 0.465 ' CZ2' ' HD2' ' C' ' 48' ' ' ARG . 5.1 t-105 -70.58 -48.26 56.13 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 116.939 -3.6 . . . . 0.0 110.371 165.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 93.6 mt -68.56 -25.22 64.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 120.52 -1.363 . . . . 0.0 110.14 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 17.4 ttt180 -62.37 -33.97 75.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 118.047 -0.978 . . . . 0.0 112.039 168.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . 0.451 88.1 t80 -70.68 -36.56 73.38 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 171.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.99 -45.47 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 O-C-N 119.144 -2.223 . . . . 0.0 110.396 172.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -74.91 -33.48 62.02 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 118.033 2.605 . . . . 0.0 118.033 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 17.3 tp -60.62 -43.05 97.92 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 124.353 2.025 . . . . 0.0 111.099 167.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 42.3 tp -60.91 -44.0 97.77 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 118.272 -2.767 . . . . 0.0 109.546 175.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -59.36 -55.62 32.46 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 120.092 1.315 . . . . 0.0 107.89 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -58.14 -30.56 66.43 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 126.483 2.364 . . . . 0.0 115.858 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.34 -24.95 62.2 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.899 0.88 . . . . 0.0 112.048 175.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -76.81 -26.16 54.1 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 119.516 1.053 . . . . 0.0 110.428 168.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -84.54 -19.06 33.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 118.185 -2.822 . . . . 0.0 113.421 -176.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 53.7 p30 -114.97 10.38 16.27 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 114.889 1.441 . . . . 0.0 114.889 172.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 49.63 42.42 23.19 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.601 1.188 . . . . 0.0 112.024 -176.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 47.1 mt -102.03 11.99 37.56 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 121.476 1.944 . . . . 0.0 112.824 167.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . 0.366 0.0 OUTLIER -49.71 -67.16 0.28 Allowed 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 119.876 3.287 . . . . 0.0 119.876 177.296 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 6.2 mt -58.2 -48.63 96.69 Favored Pre-proline 0 N--CA 1.449 -0.505 0 CA-C-O 114.745 -2.55 . . . . 0.0 110.554 -177.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.33 -25.49 71.45 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 CA-C-N 125.36 2.95 . . . . 0.0 112.912 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 14.8 tp -79.48 -40.23 30.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 125.535 3.789 . . . . 0.0 116.575 177.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 89.0 mt -68.34 -42.56 79.11 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 11.8 m-20 -71.5 -28.21 63.75 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 113.844 -2.979 . . . . 0.0 117.009 177.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 28.1 tp -57.6 -52.1 66.8 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 114.063 -2.875 . . . . 0.0 114.149 156.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 19.4 mmt -75.88 -25.66 56.32 Favored 'General case' 0 N--CA 1.448 -0.529 1 C-N-CA 131.823 4.049 . . . . 0.0 117.704 -173.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 14.6 mt -132.95 129.63 38.52 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 126.012 2.07 . . . . 0.0 110.476 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 71.6 p -77.25 167.23 38.21 Favored Pre-proline 0 N--CA 1.451 -0.412 0 CA-C-O 114.927 -2.463 . . . . 0.0 109.369 -167.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -45.23 -42.18 16.88 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 O-C-N 125.938 2.546 . . . . 0.0 116.15 -173.359 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -92.01 -7.65 48.28 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.765 1.626 . . . . 0.0 111.387 -169.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -88.5 -36.17 16.58 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 168.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -66.48 -38.64 87.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 127.199 2.2 . . . . 0.0 111.864 169.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -79.35 -37.39 37.55 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 119.747 -1.846 . . . . 0.0 108.955 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -49.44 -58.71 4.65 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 121.812 2.097 . . . . 0.0 108.93 163.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 49.0 mt -64.13 -44.09 93.25 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 117.786 -3.071 . . . . 0.0 111.406 -165.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -33.64 -50.3 0.57 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-O 114.48 -3.4 . . . . 0.0 121.551 149.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 28.7 m -73.57 -29.71 62.58 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 120.944 2.372 . . . . 0.0 109.262 177.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 54' ' ' ARG . . . . . 0.555 ' HA ' HD12 ' D' ' 57' ' ' ILE 0.262 96.9 mtt180 -64.42 -28.66 69.83 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 120.509 -1.369 . . . . 0.0 113.573 -176.676 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 10.8 t -56.62 -51.86 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 120.6 1.545 . . . . 0.0 112.037 162.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -77.08 -11.06 59.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 117.227 -1.789 . . . . 0.0 113.905 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 57' ' ' ILE . . . . . 0.555 HD12 ' HA ' ' D' ' 54' ' ' ARG . 36.9 mt -74.91 -47.73 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 122.223 2.283 . . . . 0.0 105.804 175.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 58' ' ' VAL . . . . . 0.408 HG22 HG23 ' D' ' 82' ' ' ILE . 91.3 t -65.03 -41.61 92.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 173.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -56.26 -31.18 63.34 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.684 -2.51 . . . . 0.0 115.204 173.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -84.56 -29.69 25.67 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 120.34 1.427 . . . . 0.0 114.543 -176.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 25.0 mt -67.06 -20.46 65.83 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.999 1.719 . . . . 0.0 113.628 161.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 27.6 mt -94.64 -21.22 18.94 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 120.118 -1.614 . . . . 0.0 111.559 171.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . 0.256 32.0 ttm180 -79.95 -40.46 28.03 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.898 0.856 . . . . 0.0 111.295 176.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 73.24 6.63 69.84 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 127.652 2.548 . . . . 0.0 117.98 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -93.48 -32.8 14.05 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 124.872 0.983 . . . . 0.0 113.304 -170.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 39.0 mtt -80.28 42.54 0.58 Allowed 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 127.383 3.468 . . . . 0.0 114.03 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 89.0 p -67.86 163.0 22.89 Favored 'General case' 0 N--CA 1.446 -0.669 1 O-C-N 115.664 -4.398 . . . . 0.0 113.966 -176.051 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 67.83 -55.21 0.49 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 114.564 -2.636 . . . . 0.0 115.917 163.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 ttt85 -125.05 -29.27 3.34 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 122.327 2.33 . . . . 0.0 116.49 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -77.16 -37.32 54.09 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 118.346 -2.721 . . . . 0.0 111.081 -173.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 11.7 mt -53.71 -30.34 43.43 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.0 1.857 . . . . 0.0 115.405 168.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -91.73 -7.24 50.3 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -136.18 -17.43 1.59 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 114.926 -2.464 . . . . 0.0 117.65 -175.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 74' ' ' GLU . . . . . 0.436 ' HB3' HD22 ' D' ' 75' ' ' LEU . 5.4 tp10 -90.59 -35.43 15.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 126.549 2.405 . . . . 0.0 112.015 163.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 75' ' ' LEU . . . . . 0.51 HD22 ' N ' ' D' ' 75' ' ' LEU 0.307 1.4 mm? -94.61 -57.2 2.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 127.352 2.261 . . . . 0.0 116.215 172.382 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.65 -162.83 44.43 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 116.249 -2.417 . . . . 0.0 114.612 174.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -33.3 -32.93 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 130.159 4.094 . . . . 0.0 118.084 -157.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.01 -19.43 56.7 Favored Glycine 0 C--N 1.337 0.632 1 C-N-CA 131.316 4.294 . . . . 0.0 110.491 174.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . 0.256 0.9 OUTLIER -58.65 -29.94 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 121.655 2.728 . . . . 0.0 114.778 175.508 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.62 -12.86 60.04 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 116.591 -1.671 . . . . 0.0 111.731 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 14.4 m -71.76 -37.16 70.54 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 118.322 2.712 . . . . 0.0 118.322 158.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 82' ' ' ILE . . . . . 0.408 HG23 HG22 ' D' ' 58' ' ' VAL . 25.8 mm -82.93 -27.06 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 CA-C-N 113.645 -1.616 . . . . 0.0 111.573 -173.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 71.5 p -102.31 -19.03 15.17 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 127.261 2.224 . . . . 0.0 110.625 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.322 16.3 mtp180 -119.79 154.25 34.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.297 -2.752 . . . . 0.0 113.531 178.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 109.38 146.41 11.49 Favored Glycine 0 C--N 1.338 0.692 0 C-N-CA 119.922 -1.132 . . . . 0.0 111.355 -159.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 84.5 p -72.68 -21.62 61.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 129.606 3.163 . . . . 0.0 112.907 -160.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -130.09 38.78 3.75 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 128.344 3.527 . . . . 0.0 113.397 175.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 29.1 p -57.46 169.59 0.63 Allowed 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 127.365 2.916 . . . . 0.0 117.374 173.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.373 0.7 OUTLIER -65.77 -3.48 5.0 Favored 'General case' 0 C--O 1.223 -0.297 1 O-C-N 115.59 -4.444 . . . . 0.0 119.443 159.122 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 66.2 tttt -76.68 -22.83 53.45 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 126.957 2.661 . . . . 0.0 114.625 162.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -105.21 -39.89 6.04 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 131.638 3.975 . . . . 0.0 115.448 -152.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 92' ' ' ALA . . . . . 0.628 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 55.33 85.49 0.19 Allowed Pre-proline 0 N--CA 1.448 -0.569 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 167.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 93' ' ' PRO . . . . . 0.628 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.357 0.0 OUTLIER 33.95 33.11 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.21 0 C-N-CA 119.468 -3.138 . . . . 0.0 118.857 40.047 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 91.8 t -65.32 -28.81 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 O-C-N 125.837 1.961 . . . . 0.0 107.215 -170.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 95' ' ' GLU . . . . . 0.519 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.263 0.1 OUTLIER -81.82 -42.78 19.18 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 130.066 3.346 . . . . 0.0 109.979 -170.131 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 9.0 tp -63.26 -40.99 98.97 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 118.501 0.591 . . . . 0.0 111.95 165.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 -55.53 -53.59 54.46 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 116.823 -1.56 . . . . 0.0 115.193 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -57.65 -34.63 69.56 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 126.192 2.183 . . . . 0.0 114.41 177.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 59.5 t90 -75.74 -45.51 36.09 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 117.932 -2.98 . . . . 0.0 111.74 175.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 94.1 mt -55.99 -37.13 68.7 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 118.597 -2.564 . . . . 0.0 114.541 174.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -70.8 -21.24 62.5 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 -174.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -89.37 -48.99 6.97 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 123.674 1.702 . . . . 0.0 111.398 171.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 89.7 t -63.17 -38.78 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 O-C-N 118.261 -2.774 . . . . 0.0 113.136 178.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 75.6 mt -84.94 -20.74 30.19 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 115.716 -2.394 . . . . 0.0 114.561 -174.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 55.0 mt -93.86 5.38 51.84 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 124.943 2.306 . . . . 0.0 116.078 177.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 19.1 pttp -60.93 147.28 43.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.657 1.983 . . . . 0.0 107.481 -172.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 34.3 m -65.88 -29.0 69.37 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 119.505 3.15 . . . . 0.0 119.505 -171.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 . . . . . 0 C--O 1.252 1.226 0 O-C-N 118.701 -2.5 . . . . 0.0 113.838 166.541 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.24 -14.32 60.91 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -172.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -84.52 4.35 32.31 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 172.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -125.63 -39.26 2.17 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 124.877 1.271 . . . . 0.0 111.872 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.425 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 54.2 p -46.96 140.54 6.22 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 127.939 2.496 . . . . 0.0 112.143 175.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 5' ' ' SER . 57.4 Cg_endo -73.93 -15.77 23.44 Favored 'Trans proline' 0 N--CA 1.448 -1.163 1 C-N-CA 125.438 4.092 . . . . 0.0 106.738 175.085 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -121.81 151.39 40.66 Favored 'General case' 0 N--CA 1.446 -0.655 1 O-C-N 115.777 -4.327 . . . . 0.0 107.857 176.272 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.6 t -117.51 118.45 32.21 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 115.912 1.819 . . . . 0.0 115.912 166.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.19 -36.33 81.58 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 125.445 1.716 . . . . 0.0 111.887 178.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.3 -41.1 96.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 111.574 -2.557 . . . . 0.0 110.488 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.8 ttp -78.74 -36.79 42.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 117.31 2.337 . . . . 0.0 117.31 176.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.04 -40.52 73.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 173.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -77.67 -39.8 43.73 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -42.23 -40.72 2.5 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 128.313 2.645 . . . . 0.0 113.048 168.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 67.0 mmt-85 -79.87 -25.71 40.58 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 125.401 1.688 . . . . 0.0 114.716 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 29.8 t60 -70.58 -39.16 74.04 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 121.63 2.014 . . . . 0.0 111.295 171.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -55.41 -43.13 74.99 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.108 1.363 . . . . 0.0 110.119 172.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -65.1 -37.47 87.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 118.362 2.727 . . . . 0.0 118.362 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 41.9 t-105 -65.94 -47.88 73.21 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.606 169.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 69.6 mt -57.68 -38.33 74.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 120.56 1.527 . . . . 0.0 109.693 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 43.5 ttt180 -62.75 -36.46 83.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 121.221 1.828 . . . . 0.0 114.658 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -61.76 -41.79 98.14 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 121.195 1.816 . . . . 0.0 108.8 173.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.5 t -67.42 -49.77 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 121.477 1.944 . . . . 0.0 105.912 -173.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -71.15 -32.27 68.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 118.997 -2.314 . . . . 0.0 113.899 -177.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 19.4 tp -55.68 -49.49 72.81 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.524 -2.61 . . . . 0.0 109.169 167.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.09 -31.3 72.44 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 118.649 -2.532 . . . . 0.0 114.331 176.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -57.96 -51.82 68.06 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.801 1.778 . . . . 0.0 115.801 169.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -60.8 -39.43 88.91 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 126.156 1.782 . . . . 0.0 112.93 173.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.72 -48.85 76.84 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 115.054 -2.403 . . . . 0.0 114.845 163.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -55.89 -43.42 77.23 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 124.338 3.244 . . . . 0.0 113.85 172.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -70.55 -21.23 62.73 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 125.071 1.482 . . . . 0.0 114.613 -177.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -95.7 5.87 50.32 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 118.95 2.945 . . . . 0.0 118.95 165.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.398 6.0 m-20 71.59 35.59 1.42 Allowed 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 118.467 -2.646 . . . . 0.0 113.769 -172.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.268 49.1 mt -125.61 14.26 8.13 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 119.975 -1.703 . . . . 0.0 112.86 -167.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -73.97 -41.73 61.53 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 118.715 -2.49 . . . . 0.0 114.81 -172.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.5 mt -64.58 -52.77 49.82 Favored Pre-proline 0 N--CA 1.448 -0.554 0 O-C-N 125.571 1.794 . . . . 0.0 110.386 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -71.67 -20.28 26.81 Favored 'Trans proline' 0 N--CA 1.448 -1.19 0 CA-C-N 121.132 1.44 . . . . 0.0 111.287 -170.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.6 tp -71.22 -56.62 5.68 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 129.132 2.973 . . . . 0.0 109.278 173.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.3 mt -61.3 -30.68 70.63 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 120.074 -1.641 . . . . 0.0 110.04 176.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -67.32 -10.87 55.19 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 117.055 -3.528 . . . . 0.0 113.977 176.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.4 tt -102.96 -36.94 8.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.448 1.499 . . . . 0.0 113.442 173.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 79.9 mmm -78.87 -33.16 46.04 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 127.733 2.413 . . . . 0.0 117.293 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.8 mt -119.03 143.05 47.3 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.948 2.899 . . . . 0.0 112.148 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.7 p -82.91 167.13 31.63 Favored Pre-proline 0 N--CA 1.45 -0.444 0 CA-C-O 115.748 -2.073 . . . . 0.0 114.44 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . 0.443 65.4 Cg_exo -47.24 -60.58 0.83 Allowed 'Trans proline' 0 N--CA 1.45 -1.083 0 N-CA-C 119.935 3.014 . . . . 0.0 119.935 -172.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -67.55 -6.15 18.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 119.585 3.18 . . . . 0.0 119.585 168.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -84.21 -49.28 8.96 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.061 2.209 . . . . 0.0 108.017 170.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.4 mtm-85 -46.34 -45.86 17.85 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.022 2.129 . . . . 0.0 112.861 163.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.24 -46.18 78.04 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.953 1.408 . . . . 0.0 112.279 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.88 -41.43 87.1 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 130.321 3.448 . . . . 0.0 109.071 170.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.1 mt -54.76 -34.42 62.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 124.552 3.342 . . . . 0.0 112.88 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.05 -49.26 76.85 Favored Glycine 0 N--CA 1.446 -0.66 1 C-N-CA 131.72 4.486 . . . . 0.0 113.282 168.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.9 m -70.87 -34.37 71.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.692 1.197 . . . . 0.0 109.551 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -61.38 -37.18 82.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 117.178 2.288 . . . . 0.0 117.178 177.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.5 t -59.29 -38.9 77.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 125.33 1.452 . . . . 0.0 109.188 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.2 mtp180 -66.34 -31.91 72.98 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 128.389 2.675 . . . . 0.0 111.921 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 85.8 mt -77.29 -35.67 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 125.865 1.666 . . . . 0.0 110.49 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.48 HG21 ' CE ' ' B' ' 42' ' ' MET . 71.8 t -67.02 -46.16 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-O 117.144 -1.408 . . . . 0.0 107.768 170.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -64.9 -36.53 84.68 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 121.219 1.827 . . . . 0.0 108.422 -170.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -84.59 -29.82 25.51 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.862 -2.399 . . . . 0.0 111.843 -175.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.277 50.0 mt -69.56 -31.53 69.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 118.432 -2.667 . . . . 0.0 113.046 164.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tt -77.54 -37.27 51.19 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 117.033 -1.867 . . . . 0.0 112.152 172.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -69.06 -31.16 69.72 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 128.261 2.624 . . . . 0.0 115.733 176.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.63 -23.73 8.42 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 121.203 3.241 . . . . 0.0 121.203 164.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -64.89 -51.29 62.77 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 176.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 37.8 ttm -90.94 135.9 33.43 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 -155.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 83.8 p -107.94 170.53 7.94 Favored 'General case' 0 CA--C 1.52 -0.191 0 O-C-N 119.499 -2.001 . . . . 0.0 113.627 -166.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -35.17 -61.55 0.42 Allowed 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 124.879 2.276 . . . . 0.0 110.582 -176.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.0 tpt85 -67.14 -14.98 63.43 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.57 3.148 . . . . 0.0 115.455 -174.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -97.93 -46.89 5.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 128.003 3.314 . . . . 0.0 109.608 175.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.2 mt -50.25 -40.17 47.05 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.3 tptp -46.68 -50.61 17.55 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 111.901 -2.409 . . . . 0.0 114.686 164.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -78.95 -24.89 43.64 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.839 2.056 . . . . 0.0 111.646 -177.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -103.01 -26.71 12.98 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 -171.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 37.1 mt -130.35 0.21 4.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.305 -2.747 . . . . 0.0 113.859 -173.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.57 4.2 17.6 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-N 111.936 -2.393 . . . . 0.0 113.868 -164.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.13 123.16 26.55 Favored 'General case' 0 N--CA 1.449 -0.517 1 O-C-N 115.895 -4.297 . . . . 0.0 110.487 -168.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.78 166.79 45.41 Favored Glycine 0 CA--C 1.524 0.595 1 CA-C-O 128.388 4.327 . . . . 0.0 113.392 173.124 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 60.3 mt -65.48 -27.44 41.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 110.73 -2.735 . . . . 0.0 109.805 -172.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.73 -37.59 73.5 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 120.414 1.461 . . . . 0.0 111.744 -175.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.6 p -86.94 -16.56 35.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.267 40.8 mm -71.07 -56.5 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 C-N-CA 129.939 3.296 . . . . 0.0 108.978 162.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.4 m -53.71 -44.47 69.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 121.573 1.988 . . . . 0.0 116.219 175.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.5 ttt180 -70.85 -54.59 10.98 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 123.142 1.449 . . . . 0.0 108.928 174.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -51.75 -25.74 15.87 Favored Glycine 0 C--N 1.337 0.608 0 O-C-N 118.647 -2.533 . . . . 0.0 116.797 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.3 m -75.59 -48.28 22.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.805 2.842 . . . . 0.0 110.717 171.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -76.73 -25.04 53.08 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 124.142 0.901 . . . . 0.0 112.079 -176.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 74.8 m -70.19 -35.76 74.16 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 126.22 1.808 . . . . 0.0 115.201 163.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 tp -68.49 -33.38 74.04 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 116.277 -4.014 . . . . 0.0 113.839 167.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -70.37 -43.01 71.03 Favored 'General case' 0 N--CA 1.45 -0.463 1 O-C-N 115.944 -4.223 . . . . 0.0 111.388 175.129 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.01 -11.22 27.03 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 174.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.421 ' HB1' HD23 ' A' ' 96' ' ' LEU . . . -60.86 157.12 42.16 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -61.2 153.23 66.43 Favored 'Trans proline' 0 N--CA 1.449 -1.09 1 C-N-CA 128.6 6.2 . . . . 0.0 115.27 160.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 31.2 m -78.7 -29.92 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 117.399 -1.72 . . . . 0.0 115.63 -165.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -61.38 -28.02 68.94 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.975 3.31 . . . . 0.0 112.651 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.421 HD23 ' HB1' ' A' ' 92' ' ' ALA . 30.0 tp -65.61 -48.72 71.31 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.921 2.088 . . . . 0.0 111.106 178.427 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 80.0 mtm-85 -74.98 -35.98 62.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.117 -2.864 . . . . 0.0 113.946 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -70.04 -17.8 63.27 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 119.079 -2.263 . . . . 0.0 110.519 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 43.8 t90 -91.09 -44.86 9.02 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 85.2 mt -57.88 -38.16 75.27 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -41.55 -41.46 2.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 119.297 3.073 . . . . 0.0 119.297 159.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -96.84 -26.71 15.01 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 123.018 1.39 . . . . 0.0 109.85 -162.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.5 t -86.35 -44.07 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 128.902 2.881 . . . . 0.0 111.531 174.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.6 mt -89.37 -45.1 9.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.766 -1.834 . . . . 0.0 114.611 -171.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.1 mt -103.2 -26.4 13.0 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -167.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -73.78 -6.31 46.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.688 -1.883 . . . . 0.0 111.911 177.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 38.9 m -69.32 -39.94 77.93 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 118.494 -2.629 . . . . 0.0 112.745 164.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 C--O 1.254 1.303 0 O-C-N 118.674 -2.516 . . . . 0.0 115.102 -171.771 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.433 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -51.17 -43.22 61.25 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 119.823 3.268 . . . . 0.0 119.823 -157.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -53.88 -24.82 17.22 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 119.644 3.202 . . . . 0.0 119.644 167.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 23.8 tp60 -85.56 -33.84 21.62 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 124.429 1.091 . . . . 0.0 109.497 -172.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . 0.282 65.9 m -76.74 146.72 76.85 Favored Pre-proline 0 N--CA 1.45 -0.46 1 O-C-N 114.899 -4.876 . . . . 0.0 109.367 -178.038 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -60.54 -45.21 22.73 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 125.206 3.938 . . . . 0.0 110.681 169.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' TYR . . . . . 0.417 ' CG ' ' N ' ' B' ' 8' ' ' SER . 63.5 t80 -110.51 154.75 23.24 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 122.147 2.249 . . . . 0.0 112.663 176.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' SER . . . . . 0.417 ' N ' ' CG ' ' B' ' 7' ' ' TYR . 43.6 t -153.91 128.91 9.56 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 118.78 0.718 . . . . 0.0 112.752 166.288 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.47 -34.86 47.31 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 127.191 2.196 . . . . 0.0 111.545 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.05 -38.45 90.86 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 115.068 -2.396 . . . . 0.0 113.649 174.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 19.4 mtt -69.07 -35.24 76.31 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 126.983 2.677 . . . . 0.0 111.79 168.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.9 -32.25 69.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 122.565 2.438 . . . . 0.0 109.174 -175.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -73.51 -30.84 63.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 116.056 -1.926 . . . . 0.0 108.09 174.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -76.92 -31.47 56.69 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.794 1.179 . . . . 0.0 109.007 -175.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -71.0 -31.05 67.47 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 127.71 2.404 . . . . 0.0 113.517 173.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 45.3 t60 -66.61 -36.09 81.76 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.933 1.693 . . . . 0.0 112.186 164.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -83.63 -10.54 58.15 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 118.8 -2.437 . . . . 0.0 113.678 174.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -90.36 -23.31 21.13 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 118.3 -2.75 . . . . 0.0 110.12 171.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 1.8 t-105 -76.52 -34.96 58.55 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 120.097 1.317 . . . . 0.0 112.378 167.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 19.5 mt -70.11 -9.98 57.28 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 119.06 -1.056 . . . . 0.0 112.631 175.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -79.38 -32.28 43.07 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 129.024 2.93 . . . . 0.0 115.944 162.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -68.16 -29.84 68.81 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 115.066 -2.654 . . . . 0.0 112.939 163.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 98.1 t -73.37 -43.75 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 120.897 -1.127 . . . . 0.0 113.812 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -60.31 -52.72 64.05 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 171.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 14.4 tp -58.24 -34.87 70.92 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 114.737 -2.554 . . . . 0.0 110.994 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 55.5 tp -64.2 -57.07 10.57 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 128.762 2.825 . . . . 0.0 108.396 176.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.417 ' HE3' HE22 ' B' ' 31' ' ' GLN . 33.7 ttpt -47.04 -53.24 13.04 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 119.102 -2.249 . . . . 0.0 115.396 167.254 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -56.09 -40.82 74.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 117.7 -1.6 . . . . 0.0 110.507 177.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.28 -35.05 76.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.368 1.08 . . . . 0.0 113.471 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -60.61 -47.27 86.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 127.249 2.219 . . . . 0.0 111.963 173.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.417 HE22 ' HE3' ' B' ' 27' ' ' LYS . 40.8 mt-30 -56.87 -24.5 52.14 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 170.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -108.73 -3.45 17.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 131.264 3.825 . . . . 0.0 112.933 -171.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 61.17 35.67 18.4 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 126.463 2.352 . . . . 0.0 117.29 -174.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.8 mt -123.35 12.82 9.48 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 127.645 2.378 . . . . 0.0 116.219 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -59.9 -38.2 81.59 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 119.39 3.107 . . . . 0.0 119.39 175.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 2.0 mt -71.96 -48.15 11.11 Favored Pre-proline 0 N--CA 1.451 -0.414 0 O-C-N 124.728 1.268 . . . . 0.0 114.421 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -63.21 -27.83 72.73 Favored 'Trans proline' 0 N--CA 1.447 -1.218 0 C-N-CA 123.971 3.114 . . . . 0.0 112.528 172.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.6 tp -67.26 -47.26 71.25 Favored 'General case' 0 N--CA 1.449 -0.522 1 O-C-N 115.007 -4.808 . . . . 0.0 112.883 167.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 89.2 mt -65.43 -16.9 64.11 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.505 1.522 . . . . 0.0 115.066 170.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -81.92 -28.97 32.53 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 130.458 3.503 . . . . 0.0 110.332 166.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 60.5 tp -89.52 -26.24 20.99 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 118.776 -1.17 . . . . 0.0 112.956 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' MET . . . . . 0.48 ' CE ' HG21 ' A' ' 58' ' ' VAL 0.259 15.4 mmt -95.97 -16.37 21.74 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 119.408 3.114 . . . . 0.0 119.408 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 31.9 mt -123.68 143.94 49.95 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.232 2.613 . . . . 0.0 109.797 174.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' THR . . . . . 0.602 ' HB ' ' CD ' ' B' ' 45' ' ' PRO . 40.0 p -93.95 174.88 3.39 Favored Pre-proline 0 N--CA 1.452 -0.353 0 O-C-N 126.754 2.534 . . . . 0.0 112.134 177.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 45' ' ' PRO . . . . . 0.602 ' CD ' ' HB ' ' B' ' 44' ' ' THR . 37.4 Cg_exo -62.61 -46.42 11.6 Favored 'Trans proline' 0 N--CA 1.449 -1.1 0 CA-C-O 123.9 1.542 . . . . 0.0 112.714 -170.051 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -53.46 -40.6 65.4 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 116.108 -1.901 . . . . 0.0 115.329 172.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -75.36 -35.37 61.13 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 127.503 3.002 . . . . 0.0 117.305 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 43.9 mtm-85 -65.73 -47.93 73.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.245 2.218 . . . . 0.0 109.444 173.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -63.95 -35.86 82.08 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 176.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.98 -50.9 71.94 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.011 1.724 . . . . 0.0 113.629 160.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 30.6 mt -56.62 -45.59 81.43 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 116.396 -1.764 . . . . 0.0 107.531 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.51 -39.8 75.49 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-O 126.104 3.058 . . . . 0.0 119.717 174.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.5 m -74.61 -35.48 62.94 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 110.565 -2.817 . . . . 0.0 111.749 173.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . 0.305 96.6 mtt180 -56.58 -32.08 64.87 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 123.611 2.914 . . . . 0.0 112.971 170.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . 0.415 13.6 t -51.2 -51.46 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 120.619 1.554 . . . . 0.0 109.712 166.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -76.1 -33.09 59.49 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 117.308 2.336 . . . . 0.0 117.308 -174.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.43 ' HA ' HD13 ' B' ' 75' ' ' LEU . 42.1 mt -68.26 -39.62 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 CA-C-O 114.376 -2.726 . . . . 0.0 104.82 173.308 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.279 53.4 t -77.5 -35.44 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 1 CA-C-N 127.647 4.748 . . . . 0.0 112.08 -179.66 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -60.44 -34.0 73.35 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 125.736 2.684 . . . . 0.0 117.946 165.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -83.73 -33.73 25.02 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 114.185 -2.816 . . . . 0.0 107.84 -176.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 27.2 mt -43.15 -46.44 5.91 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 124.424 3.283 . . . . 0.0 114.43 157.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 17.1 mt -83.01 -21.09 33.97 Favored 'General case' 0 N--CA 1.451 -0.424 1 N-CA-C 122.756 4.354 . . . . 0.0 122.756 172.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 32.2 ttm105 -69.23 -49.22 58.4 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.83 47.36 8.68 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 118.417 2.127 . . . . 0.0 118.417 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . 0.284 66.4 mm-40 -117.66 -37.1 3.52 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 116.937 -1.506 . . . . 0.0 108.485 -171.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 90.8 mtp -100.12 123.3 44.2 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 123.623 2.92 . . . . 0.0 113.736 -162.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 97.4 p -64.18 162.66 14.07 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 125.077 1.486 . . . . 0.0 113.669 173.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -45.08 -33.66 2.25 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.659 1.984 . . . . 0.0 115.147 165.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -67.73 -52.01 42.55 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 127.062 3.315 . . . . 0.0 108.884 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -53.5 -48.12 69.25 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 118.073 -2.892 . . . . 0.0 116.237 173.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 59.8 mt -57.18 -39.22 74.91 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 123.316 1.532 . . . . 0.0 111.548 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 32.3 tptt -77.25 -51.79 10.32 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 112.036 -2.347 . . . . 0.0 109.724 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -82.54 -4.03 56.92 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 117.002 2.223 . . . . 0.0 117.002 -169.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -137.03 -12.02 1.69 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 113.241 -1.8 . . . . 0.0 111.442 -169.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' B' ' 57' ' ' ILE . 26.8 mt -134.53 7.73 3.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 113.388 -3.196 . . . . 0.0 111.74 177.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 60.65 16.66 46.07 Favored Glycine 0 CA--C 1.522 0.488 0 C-N-CA 129.742 3.544 . . . . 0.0 112.013 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.07 108.92 18.38 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 121.731 3.975 . . . . 0.0 121.731 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.0 175.54 53.07 Favored Glycine 0 CA--C 1.523 0.577 0 O-C-N 119.317 -2.114 . . . . 0.0 113.857 -174.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 6.4 mt -50.34 -43.16 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 O-C-N 120.061 -1.847 . . . . 0.0 115.361 176.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.76 -38.87 90.24 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.467 -2.645 . . . . 0.0 111.955 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 37.8 m -67.69 -52.04 42.56 Favored 'General case' 0 N--CA 1.444 -0.744 0 O-C-N 126.268 2.23 . . . . 0.0 109.223 -176.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 37.5 mm -65.91 -41.52 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-O 115.472 -2.204 . . . . 0.0 110.51 176.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 98.3 m -54.71 -65.63 0.54 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 124.034 3.107 . . . . 0.0 109.344 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -49.85 -42.03 46.57 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 117.215 2.302 . . . . 0.0 117.215 167.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -39.09 -60.86 1.51 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 118.634 2.214 . . . . 0.0 118.634 162.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 91.6 p -75.46 -21.06 58.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 128.902 2.881 . . . . 0.0 110.806 -175.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -71.54 -33.86 69.51 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 117.206 2.298 . . . . 0.0 117.206 163.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 2.4 m -72.7 -30.82 64.53 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 116.519 -1.705 . . . . 0.0 109.998 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 11.6 mt -59.59 -52.64 64.69 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 124.391 3.269 . . . . 0.0 116.473 166.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 50.5 tttm -63.81 -19.81 65.3 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -176.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.46 -22.1 32.68 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 114.842 -2.504 . . . . 0.0 116.892 167.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.99 151.01 97.58 Favored Pre-proline 0 N--CA 1.451 -0.394 0 CA-C-N 121.868 2.122 . . . . 0.0 114.629 -169.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . 0.274 52.4 Cg_exo -49.85 133.98 34.33 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 124.844 3.696 . . . . 0.0 114.154 163.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.418 HG12 ' NH1' ' B' ' 97' ' ' ARG . 22.4 m -73.41 -25.61 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -158.36 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 12.9 pm0 -62.09 -31.48 71.93 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 118.018 -0.992 . . . . 0.0 109.55 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 33.7 tp -74.27 -46.31 42.14 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 120.09 1.314 . . . . 0.0 107.472 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' ARG . . . . . 0.418 ' NH1' HG12 ' B' ' 94' ' ' VAL . 19.3 mtm-85 -59.26 -34.06 71.8 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -71.41 -27.28 63.19 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 30.3 t90 -81.78 -50.1 9.63 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 131.454 3.902 . . . . 0.0 111.978 173.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 40.0 mt -69.29 -19.71 63.9 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 116.518 -1.706 . . . . 0.0 115.55 -170.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -60.29 -36.6 78.25 Favored 'General case' 0 N--CA 1.452 -0.355 1 CA-C-O 111.663 -4.018 . . . . 0.0 114.91 174.062 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -86.17 -36.88 19.24 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 123.574 2.897 . . . . 0.0 112.422 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 37.5 t -49.97 -61.74 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 126.292 1.837 . . . . 0.0 108.566 169.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 80.4 mt -78.16 -48.62 15.52 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 118.168 -1.413 . . . . 0.0 111.13 -165.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 57.4 mt -88.86 27.86 1.26 Allowed 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.886 -2.384 . . . . 0.0 110.642 -164.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -130.01 7.42 5.1 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 128.244 2.618 . . . . 0.0 111.983 171.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 71.2 m -87.73 -9.4 54.14 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.347 2.659 . . . . 0.0 115.098 163.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.683 2.793 . . . . 0.0 109.596 168.636 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 44.4 ttm . . . . . 0 N--CA 1.474 0.732 0 CA-C-O 117.787 -1.102 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.38 136.77 57.44 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.421 1.488 . . . . 0.0 110.296 175.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -104.27 163.15 12.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.969 2.508 . . . . 0.0 112.951 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -158.72 146.08 17.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 116.914 -3.616 . . . . 0.0 108.896 -169.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 59.0 p -154.66 173.81 4.44 Favored Pre-proline 0 N--CA 1.452 -0.326 0 C-N-CA 127.796 2.439 . . . . 0.0 117.512 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -69.62 -29.6 24.27 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 120.926 1.084 . . . . 0.0 113.412 171.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -150.1 145.99 26.66 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.696 2.398 . . . . 0.0 111.763 -171.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t -153.44 129.25 10.16 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 170.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.41 -24.98 67.7 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 114.783 -2.532 . . . . 0.0 112.138 176.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.27 -21.72 66.29 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 116.521 -1.704 . . . . 0.0 114.867 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 58.9 mtt -85.77 -34.35 21.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 127.179 2.799 . . . . 0.0 109.386 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.09 -33.06 75.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 123.347 1.546 . . . . 0.0 110.565 173.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -78.22 -23.75 47.32 Favored 'General case' 0 N--CA 1.449 -0.495 1 O-C-N 115.375 -4.578 . . . . 0.0 114.294 178.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -84.2 -38.11 20.99 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.685 -1.15 . . . . 0.0 111.797 175.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -37.78 82.42 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 118.603 0.638 . . . . 0.0 112.174 169.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -59.58 -35.68 74.76 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 116.637 -2.025 . . . . 0.0 113.762 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -75.04 -35.93 61.88 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 130.002 3.321 . . . . 0.0 110.056 -176.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -67.9 -50.53 55.68 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.559 1.144 . . . . 0.0 111.796 173.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 17.5 t-105 -58.39 -46.09 87.05 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 117.673 2.471 . . . . 0.0 117.673 167.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -66.11 -21.94 66.38 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 113.607 -3.092 . . . . 0.0 114.279 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -60.67 -44.76 96.1 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 122.148 2.249 . . . . 0.0 112.947 165.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -57.0 -44.03 82.33 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 128.108 2.563 . . . . 0.0 105.321 -176.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 34.2 t -67.2 -34.24 68.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 116.828 -1.558 . . . . 0.0 113.682 -177.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -84.19 -43.53 14.85 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 125.859 1.974 . . . . 0.0 109.139 -172.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 21.1 tp -56.97 -37.47 71.62 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 117.159 -1.4 . . . . 0.0 109.779 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 17.1 tp -76.83 -31.84 57.16 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 120.014 1.279 . . . . 0.0 109.529 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -59.2 -46.14 89.2 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 126.725 2.01 . . . . 0.0 114.989 169.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -60.96 -36.86 80.51 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 129.768 3.227 . . . . 0.0 113.644 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.28 -25.42 62.44 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 128.253 2.621 . . . . 0.0 114.271 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -61.52 -25.65 67.42 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.896 2.078 . . . . 0.0 112.754 169.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -93.44 -0.92 56.28 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 118.44 -2.663 . . . . 0.0 113.097 -174.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -134.97 18.42 3.47 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 120.759 1.618 . . . . 0.0 114.139 165.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 67.02 20.12 10.46 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.865 1.266 . . . . 0.0 113.885 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 94.2 mt -85.35 10.5 12.49 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 174.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -74.68 -40.11 61.59 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 118.243 -2.785 . . . . 0.0 112.872 -171.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.285 26.0 mt -62.61 -52.94 61.35 Favored Pre-proline 0 N--CA 1.446 -0.644 0 C-N-CA 129.405 3.082 . . . . 0.0 113.692 167.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -55.28 -41.93 73.51 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 N-CA-C 117.563 2.101 . . . . 0.0 117.563 170.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 64.0 tp -56.48 -37.85 70.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.132 1.373 . . . . 0.0 112.935 171.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 32.7 mt -92.08 -5.87 51.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -84.03 -21.51 31.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.463 1.905 . . . . 0.0 110.017 163.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 27.4 tp -83.26 -45.02 14.31 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 126.696 3.141 . . . . 0.0 116.524 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 42' ' ' MET . . . . . 0.412 ' C ' HD12 ' C' ' 43' ' ' LEU . 3.9 mmt -87.2 -7.52 57.85 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 111.616 -2.538 . . . . 0.0 114.899 -162.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 43' ' ' LEU . . . . . 0.412 HD12 ' C ' ' C' ' 42' ' ' MET . 10.0 mp -137.28 161.09 37.18 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 127.247 2.219 . . . . 0.0 109.28 -175.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 44' ' ' THR . . . . . 0.441 ' HB ' ' HD2' ' C' ' 45' ' ' PRO . 23.3 p -100.38 164.97 15.29 Favored Pre-proline 0 N--CA 1.449 -0.495 0 O-C-N 119.231 -2.168 . . . . 0.0 110.465 172.297 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 45' ' ' PRO . . . . . 0.441 ' HD2' ' HB ' ' C' ' 44' ' ' THR . 4.6 Cg_exo -41.28 -46.55 5.57 Favored 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 123.352 2.701 . . . . 0.0 115.036 171.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.75 -13.54 58.89 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 127.162 2.789 . . . . 0.0 115.286 -174.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -87.78 -30.22 20.42 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 131.229 3.812 . . . . 0.0 112.132 174.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 87.5 mtm-85 -71.33 -43.03 67.79 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 116.762 -1.589 . . . . 0.0 113.738 163.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -64.21 -23.69 67.4 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 125.083 1.489 . . . . 0.0 111.759 172.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.45 -50.36 70.07 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 127.652 2.381 . . . . 0.0 109.838 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 17.0 mt -77.57 -32.44 53.78 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 118.174 -2.828 . . . . 0.0 114.364 176.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.58 -44.73 85.93 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 118.677 -1.725 . . . . 0.0 115.157 164.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 26.9 m -73.15 -30.73 63.79 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 113.932 -2.937 . . . . 0.0 114.421 169.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 23.0 mtt180 -68.71 -36.14 78.06 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 125.891 3.95 . . . . 0.0 115.288 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 14.3 t -57.24 -36.54 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 129.253 3.021 . . . . 0.0 108.786 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 24.1 mtp180 -78.7 -24.07 45.22 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 121.49 0.662 . . . . 0.0 110.545 -176.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 61.8 mt -65.95 -49.4 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 O-C-N 117.691 -3.13 . . . . 0.0 108.174 174.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 96.6 t -53.57 -53.25 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 C-N-CA 128.512 2.725 . . . . 0.0 112.637 173.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -58.56 -39.3 79.9 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.433 1.493 . . . . 0.0 112.333 174.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -80.11 -37.33 33.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 120.927 1.694 . . . . 0.0 111.918 -177.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 80.8 mt -59.43 -36.8 76.58 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 169.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 70.8 mt -84.47 -36.2 22.46 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 125.05 1.469 . . . . 0.0 111.378 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 63' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' C' ' 63' ' ' ARG . 34.1 ttm180 -52.69 -60.76 2.87 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 117.579 -3.201 . . . . 0.0 110.357 173.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.7 49.29 6.19 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 130.65 3.976 . . . . 0.0 114.594 174.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -123.95 18.85 9.3 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 126.132 2.873 . . . . 0.0 113.372 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 14.5 mtt -116.45 131.91 56.82 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 117.07 -3.519 . . . . 0.0 110.015 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 54.2 p -95.37 162.78 13.52 Favored 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 132.424 4.29 . . . . 0.0 110.935 175.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -50.03 -33.28 17.63 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 116.65 2.093 . . . . 0.0 116.65 -169.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -72.59 -40.03 66.89 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.032 0.933 . . . . 0.0 111.336 177.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -68.08 -36.95 80.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 172.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 48.3 mt -55.67 -37.73 68.68 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.072 1.749 . . . . 0.0 112.066 164.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . 0.363 83.7 tttt -66.75 -63.33 1.09 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.114 0.566 . . . . 0.0 112.45 170.124 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -70.14 -42.56 72.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 115.284 -2.293 . . . . 0.0 111.154 -169.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -86.41 -48.81 8.11 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 122.391 2.359 . . . . 0.0 116.025 176.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.413 5.3 mp -74.28 -46.4 41.53 Favored 'General case' 0 N--CA 1.451 -0.377 1 CA-C-N 126.611 4.278 . . . . 0.0 113.62 -173.09 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.23 -160.74 52.55 Favored Glycine 0 C--N 1.338 0.639 0 C-N-CA 129.574 3.464 . . . . 0.0 113.12 -175.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -52.77 -27.77 19.42 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 116.352 1.982 . . . . 0.0 116.352 171.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.58 -19.19 26.21 Favored Glycine 0 C--N 1.338 0.661 1 CA-C-O 110.691 -5.505 . . . . 0.0 115.127 175.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 6.3 tt -55.36 -33.66 32.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 1 O-C-N 130.606 4.357 . . . . 0.0 110.683 176.082 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.54 -40.62 61.59 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.901 -2.999 . . . . 0.0 113.195 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 22.0 m -47.52 -30.53 3.58 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 116.907 2.188 . . . . 0.0 116.907 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 30.8 mm -109.32 -6.63 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 128.318 2.647 . . . . 0.0 115.481 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.9 p -118.94 -17.58 9.03 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 118.483 2.771 . . . . 0.0 118.483 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -105.4 134.51 48.4 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.441 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 108.08 171.55 21.63 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 125.895 1.712 . . . . 0.0 114.584 168.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 89.3 p -65.94 -21.76 66.45 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.163 2.481 . . . . 0.0 116.868 -171.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 57.1 m-80 -95.45 13.44 25.92 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 127.136 2.772 . . . . 0.0 115.754 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 48.7 p -77.73 172.22 13.75 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 128.459 3.981 . . . . 0.0 113.607 -173.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 40.9 tp -59.91 -28.94 68.02 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 117.621 -3.174 . . . . 0.0 113.737 -165.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -108.2 13.04 26.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.214 -2.179 . . . . 0.0 111.4 -177.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -132.09 -33.86 1.3 Allowed 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -27.92 149.14 0.03 OUTLIER Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 127.514 2.326 . . . . 0.0 115.199 147.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -62.27 153.81 67.58 Favored 'Trans proline' 0 N--CA 1.45 -1.077 0 CA-C-O 125.577 2.241 . . . . 0.0 110.722 -175.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 47.8 t -69.08 -50.53 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 C-N-CA 129.91 3.284 . . . . 0.0 106.762 -172.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -46.19 -36.96 6.49 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 123.301 1.524 . . . . 0.0 113.277 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 23.1 tp -76.07 -43.26 44.49 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 117.443 -3.286 . . . . 0.0 108.474 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -66.1 -37.85 86.79 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 115.042 -2.409 . . . . 0.0 106.428 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -66.05 -55.81 14.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 128.707 2.803 . . . . 0.0 110.003 178.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -52.64 -47.36 67.11 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 128.193 3.433 . . . . 0.0 112.362 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 45.3 mt -61.31 -35.76 78.23 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 129.212 3.005 . . . . 0.0 111.913 173.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -72.21 -42.52 65.67 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 116.781 -3.699 . . . . 0.0 112.64 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -56.48 -47.23 79.69 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 129.52 3.128 . . . . 0.0 106.368 176.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 96.4 t -82.2 -62.12 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 124.631 2.158 . . . . 0.0 113.602 -173.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 69.0 mt -71.42 -14.64 62.22 Favored 'General case' 0 N--CA 1.443 -0.775 0 O-C-N 117.318 -3.364 . . . . 0.0 118.214 -172.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 70.6 mt -129.73 39.83 3.66 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 115.375 1.621 . . . . 0.0 115.375 -177.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 46.6 pttt -84.85 170.14 13.44 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 120.966 -1.084 . . . . 0.0 113.766 -173.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 59.4 m -134.3 62.83 1.64 Allowed 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 129.164 2.986 . . . . 0.0 112.682 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 57.6 t0 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 113.483 -3.151 . . . . 0.0 109.371 -176.981 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 48.0 ttp . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 101.184 -3.636 . . . . 0.0 101.184 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.4 159.05 44.62 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 123.691 0.796 . . . . 0.0 112.225 -143.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -142.08 132.81 25.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 125.355 1.659 . . . . 0.0 110.269 -176.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.97 132.96 35.65 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 111.532 -2.576 . . . . 0.0 113.085 175.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 61.2 p -77.8 128.99 77.77 Favored Pre-proline 0 N--CA 1.447 -0.624 0 CA-C-O 114.026 -2.892 . . . . 0.0 110.019 169.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -74.67 -54.97 0.08 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.039 0 CA-C-N 124.473 2.633 . . . . 0.0 108.127 -172.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -125.33 146.56 49.52 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-O 116.674 -1.632 . . . . 0.0 111.403 147.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 38.4 t -76.49 133.45 39.79 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 115.778 -2.058 . . . . 0.0 109.778 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.24 -15.3 0.89 Allowed 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 117.904 2.557 . . . . 0.0 117.904 162.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . 0.262 . . -81.95 -35.81 28.65 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 128.257 3.885 . . . . 0.0 113.727 177.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 2.0 mmm -79.59 -31.07 41.74 Favored 'General case' 0 N--CA 1.452 -0.34 1 O-C-N 116.177 -4.077 . . . . 0.0 113.182 167.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.45 94.94 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 118.205 -2.809 . . . . 0.0 112.793 173.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -46.3 -54.66 8.51 Favored 'General case' 0 N--CA 1.45 -0.425 1 CA-C-O 130.069 4.747 . . . . 0.0 115.953 165.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -64.67 -39.94 94.56 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 109.563 -3.471 . . . . 0.0 113.362 -169.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -16.23 63.08 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 176.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -85.0 -35.86 21.68 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -94.43 -29.36 15.01 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.603 1.961 . . . . 0.0 113.517 -166.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -69.02 -10.15 56.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 113.91 -2.948 . . . . 0.0 110.442 156.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . 0.35 2.7 t-105 -82.8 -38.04 23.67 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 124.4 3.273 . . . . 0.0 110.501 173.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 20' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' D' ' 20' ' ' LEU . 41.7 mt -71.14 -20.01 62.36 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 113.306 -1.77 . . . . 0.0 111.379 174.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 36.2 ttt180 -64.11 -35.34 80.45 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 121.356 1.889 . . . . 0.0 112.855 167.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -72.85 -47.2 48.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.591 1.957 . . . . 0.0 111.455 168.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . 0.439 18.4 t -58.25 -41.48 81.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 O-C-N 117.447 -3.283 . . . . 0.0 107.782 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -71.7 -31.66 66.99 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 176.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 22.6 tp -70.94 -36.59 72.66 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 123.587 1.661 . . . . 0.0 113.553 171.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 25.1 tp -68.51 -38.72 81.18 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 119.535 -1.978 . . . . 0.0 112.302 172.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 ttpp -58.75 -50.89 72.23 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.749 -3.095 . . . . 0.0 111.009 174.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -60.17 -21.08 61.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.181 -2.199 . . . . 0.0 115.677 175.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 29' ' ' ALA . . . . . 0.609 ' HB1' ' HA ' ' D' ' 35' ' ' HIS . . . -79.64 -46.47 17.13 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 127.004 2.122 . . . . 0.0 110.012 174.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -58.29 -21.8 50.29 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 121.706 2.048 . . . . 0.0 112.943 173.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -85.46 -14.68 45.35 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.156 1.382 . . . . 0.0 114.587 -171.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -128.3 10.12 6.23 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 120.163 -1.585 . . . . 0.0 113.915 173.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 52.45 38.14 24.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 -172.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 21.1 mt -99.2 16.9 21.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 119.175 3.028 . . . . 0.0 119.175 159.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 35' ' ' HIS . . . . . 0.609 ' HA ' ' HB1' ' D' ' 29' ' ' ALA . 18.1 p-80 -67.58 -60.88 2.2 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.319 3.448 . . . . 0.0 108.839 -171.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.98 -29.6 3.17 Favored Pre-proline 0 N--CA 1.449 -0.511 0 CA-C-O 116.372 -1.775 . . . . 0.0 114.104 -174.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.286 53.9 Cg_exo -68.13 -29.89 32.48 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 N-CA-C 116.044 1.517 . . . . 0.0 116.044 164.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 18.7 tp -71.77 -46.87 57.0 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 115.445 -2.217 . . . . 0.0 112.49 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 20.4 mt -55.28 -44.03 75.28 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 126.144 2.153 . . . . 0.0 116.577 170.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -77.32 -27.65 52.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.833 3.208 . . . . 0.0 112.153 -176.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 23.9 tp -54.39 -50.3 67.86 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 117.209 -3.432 . . . . 0.0 111.76 162.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 16.9 mmt -73.19 -39.42 65.61 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 119.604 3.187 . . . . 0.0 119.604 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 21.5 mt -114.52 129.73 56.69 Favored 'General case' 0 N--CA 1.447 -0.587 1 O-C-N 116.056 -4.153 . . . . 0.0 109.695 -167.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 44' ' ' THR . . . . . 0.414 ' HB ' ' HD2' ' D' ' 45' ' ' PRO . 70.8 p -77.38 159.44 77.5 Favored Pre-proline 0 N--CA 1.449 -0.518 0 C-N-CA 126.526 1.93 . . . . 0.0 109.545 176.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 45' ' ' PRO . . . . . 0.414 ' HD2' ' HB ' ' D' ' 44' ' ' THR . 72.2 Cg_exo -46.37 -38.38 20.56 Favored 'Trans proline' 0 N--CA 1.449 -1.11 1 C-N-CA 125.982 4.455 . . . . 0.0 116.557 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -76.2 -29.09 57.49 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 117.58 -3.2 . . . . 0.0 110.953 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -70.94 -43.85 67.32 Favored 'General case' 0 N--CA 1.446 -0.665 1 O-C-N 116.091 -4.13 . . . . 0.0 104.376 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 13.4 mtm-85 -61.69 -37.64 84.86 Favored 'General case' 0 N--CA 1.448 -0.54 1 O-C-N 114.985 -4.822 . . . . 0.0 114.012 169.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -69.88 -38.35 76.35 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.11 -28.32 66.37 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 116.604 -1.665 . . . . 0.0 111.019 165.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . 0.271 21.3 mt -74.26 -39.46 62.99 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 123.921 3.055 . . . . 0.0 113.699 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -56.0 -39.51 79.51 Favored Glycine 0 C--N 1.333 0.385 0 CA-C-O 122.445 1.025 . . . . 0.0 113.885 167.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 73.7 m -80.17 -28.02 38.86 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.574 -0.813 . . . . 0.0 110.813 -174.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -71.04 -20.87 62.33 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 116.99 -3.569 . . . . 0.0 112.074 175.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.95 -45.52 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 166.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.579 2.7 ptm180 -68.74 -37.34 79.35 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 128.05 2.54 . . . . 0.0 115.698 173.134 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 27.8 mt -60.1 -46.21 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 119.945 -1.722 . . . . 0.0 108.3 172.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 47.0 t -66.0 -38.54 82.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 CA-C-N 122.669 2.486 . . . . 0.0 113.387 178.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -62.65 -40.9 98.49 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.343 -1.313 . . . . 0.0 109.179 -177.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -82.31 -22.92 35.41 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 115.189 -2.339 . . . . 0.0 108.32 -176.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 25.9 mt -62.65 -37.6 87.03 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 120.774 1.624 . . . . 0.0 111.219 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 32.1 mt -70.3 -43.63 69.99 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 125.653 1.846 . . . . 0.0 114.3 172.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . 0.37 32.0 ttm180 -74.1 -37.9 64.01 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 128.437 2.695 . . . . 0.0 111.744 -172.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 48.31 46.04 28.32 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 122.593 3.797 . . . . 0.0 122.593 170.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -126.94 -35.99 2.23 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 127.485 2.314 . . . . 0.0 110.032 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 20.5 mtt -74.7 51.1 0.46 Allowed 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 147.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 49.6 p -76.13 -172.88 2.18 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -173.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.333 35.5 tp60 68.23 -78.33 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 115.545 -2.169 . . . . 0.0 114.73 159.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 20.1 ttt85 -106.09 -35.76 7.14 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 128.918 2.887 . . . . 0.0 111.668 176.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -76.64 -18.4 58.61 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -168.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -38.61 65.34 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 124.591 1.182 . . . . 0.0 109.217 176.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -78.25 -21.79 49.35 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 118.181 -2.824 . . . . 0.0 115.941 172.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -121.8 -7.31 9.03 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 126.905 2.628 . . . . 0.0 113.503 -156.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -119.0 -41.02 2.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 128.489 2.716 . . . . 0.0 109.607 168.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.08 -29.1 27.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 119.246 0.93 . . . . 0.0 109.344 177.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 76.76 179.53 48.04 Favored Glycine 0 CA--C 1.523 0.545 0 O-C-N 118.899 -2.376 . . . . 0.0 114.296 157.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.06 -8.49 30.78 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.546 -2.738 . . . . 0.0 116.229 -148.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.75 -19.19 73.02 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-O 117.22 -1.878 . . . . 0.0 108.793 173.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 11.5 tt -47.95 -18.44 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 121.15 2.475 . . . . 0.0 114.715 167.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.2 -25.19 12.56 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 118.777 -2.452 . . . . 0.0 109.061 -168.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 7.6 m -64.6 -35.9 82.49 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 116.995 -3.566 . . . . 0.0 113.767 150.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 19.0 mm -82.64 -14.63 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 118.266 -2.771 . . . . 0.0 112.867 -171.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 77.6 p -120.68 -16.86 8.16 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.621 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -99.46 173.53 6.71 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 123.241 2.746 . . . . 0.0 106.811 169.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.01 151.67 26.9 Favored Glycine 0 C--N 1.337 0.612 0 O-C-N 119.979 -1.701 . . . . 0.0 113.566 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 5.7 p -69.46 -11.37 60.77 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 118.976 -2.485 . . . . 0.0 115.437 -151.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -150.27 42.46 0.84 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 127.164 3.364 . . . . 0.0 112.427 -176.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 1.4 p -64.2 168.82 5.07 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 127.42 2.288 . . . . 0.0 115.057 166.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.316 7.0 tt -64.16 -30.51 71.57 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 120.11 -1.619 . . . . 0.0 112.933 171.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 62.5 tttt -62.32 -38.46 89.54 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 127.581 2.352 . . . . 0.0 108.977 169.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -85.28 -27.27 26.09 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 120.477 -1.389 . . . . 0.0 111.383 -163.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 92' ' ' ALA . . . . . 0.738 ' HB1' HG22 ' D' ' 94' ' ' VAL 0.285 . . 62.67 77.79 0.32 Allowed Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 127.075 2.15 . . . . 0.0 108.453 163.078 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 93' ' ' PRO . . . . . 0.471 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 95.8 Cg_exo 21.62 29.29 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.18 0 N-CA-C 122.223 3.893 . . . . 0.0 122.223 46.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 94' ' ' VAL . . . . . 0.738 HG22 ' HB1' ' D' ' 92' ' ' ALA . 2.9 t -57.09 -36.42 51.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 C-N-CA 130.717 3.607 . . . . 0.0 110.546 -171.103 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.61 -40.28 49.87 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 113.217 -1.81 . . . . 0.0 114.225 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 48.3 tp -52.19 -53.15 46.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 130.667 3.587 . . . . 0.0 106.857 165.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -50.42 -45.63 55.86 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 174.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -63.35 -32.31 73.7 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 128.373 2.669 . . . . 0.0 114.126 -176.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 77.2 t90 -80.85 -44.08 18.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 125.69 2.662 . . . . 0.0 114.47 -178.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 70.1 mt -61.94 -32.19 72.58 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 117.236 -3.415 . . . . 0.0 111.324 165.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -69.59 -19.58 63.66 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 118.902 2.927 . . . . 0.0 118.902 178.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -90.02 -44.93 9.51 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 119.164 -2.21 . . . . 0.0 108.856 171.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 37.6 t -84.42 -34.33 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 O-C-N 119.517 -1.99 . . . . 0.0 110.682 -168.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 64.2 mt -90.34 -34.41 15.7 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 117.848 -3.033 . . . . 0.0 110.225 -172.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 22.5 mt -91.2 15.58 11.57 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 128.494 2.717 . . . . 0.0 111.328 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 7.4 pttp -55.32 158.88 2.92 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 130.6 3.56 . . . . 0.0 108.294 154.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 75.1 m -116.4 23.26 12.22 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 116.854 -1.546 . . . . 0.0 109.812 -164.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 C--O 1.25 1.097 0 C-N-CA 129.409 3.084 . . . . 0.0 115.232 153.98 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 tmm? . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 116.194 1.924 . . . . 0.0 116.194 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -56.19 -32.11 64.05 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 -171.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -62.46 -28.7 70.0 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 170.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -91.15 -5.53 54.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.599 -2.563 . . . . 0.0 116.27 175.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 p -88.36 166.0 25.6 Favored Pre-proline 0 N--CA 1.448 -0.573 0 CA-C-N 113.881 -1.509 . . . . 0.0 108.881 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -81.36 7.74 4.8 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 CA-C-N 121.502 1.572 . . . . 0.0 114.552 -175.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -142.72 164.1 31.01 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 113.853 -2.975 . . . . 0.0 110.569 -170.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.1 t -153.02 124.22 7.54 Favored 'General case' 0 N--CA 1.453 -0.324 1 O-C-N 129.162 4.039 . . . . 0.0 110.008 169.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.41 -20.05 59.15 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 116.709 2.114 . . . . 0.0 116.709 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.03 -54.67 22.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 129.882 3.273 . . . . 0.0 107.287 168.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 41.2 ttp -71.89 -40.2 69.06 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 113.949 -2.929 . . . . 0.0 111.915 -176.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -50.56 -48.36 57.44 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 121.731 2.06 . . . . 0.0 112.554 169.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -67.86 -39.41 83.79 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 126.157 2.884 . . . . 0.0 113.471 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -62.72 -42.96 99.91 Favored 'General case' 0 N--CA 1.449 -0.491 1 O-C-N 116.196 -4.065 . . . . 0.0 112.239 -178.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.3 22.6 mmt180 -74.38 -38.14 63.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 125.597 1.811 . . . . 0.0 111.723 -171.17 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -53.76 -40.52 66.27 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 161.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -40.98 96.47 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 117.422 -3.299 . . . . 0.0 111.998 177.047 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -60.73 -27.37 67.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.835 1.654 . . . . 0.0 112.395 177.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 8.6 t-105 -83.84 -49.52 8.97 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.777 1.631 . . . . 0.0 111.77 171.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.9 mt -58.17 -24.73 60.0 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.946 -1.721 . . . . 0.0 113.447 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -63.74 -45.16 91.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 114.527 -1.215 . . . . 0.0 112.013 173.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -61.26 -45.04 96.18 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 124.649 1.218 . . . . 0.0 109.52 172.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.5 t -60.55 -32.0 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 125.23 1.581 . . . . 0.0 111.58 -176.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.91 -38.01 69.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 118.841 2.904 . . . . 0.0 118.841 160.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 28.1 tp -57.54 -49.69 75.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.359 1.063 . . . . 0.0 110.263 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 54.0 tp -70.22 -31.45 68.88 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 113.645 -3.074 . . . . 0.0 113.998 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -61.58 -44.43 97.03 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 128.165 3.416 . . . . 0.0 111.527 168.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -71.33 -26.82 62.99 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 114.022 -1.444 . . . . 0.0 113.05 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.1 -40.56 78.31 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 118.887 -2.383 . . . . 0.0 112.215 167.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.429 ' CE1' ' CD2' ' A' ' 35' ' ' HIS . 53.8 m-85 -55.58 -40.53 72.1 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 116.454 -3.904 . . . . 0.0 113.999 159.579 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -64.0 -32.97 74.7 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.71 2.05 . . . . 0.0 112.359 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -109.09 10.68 25.99 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 128.376 2.671 . . . . 0.0 114.64 -172.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 63.65 25.26 14.22 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 124.191 1.948 . . . . 0.0 114.911 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.9 mt -107.14 20.98 18.24 Favored 'General case' 0 N--CA 1.449 -0.488 1 O-C-N 116.13 -4.106 . . . . 0.0 115.866 164.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.429 ' CD2' ' CE1' ' A' ' 30' ' ' TYR . 46.7 p-80 -67.62 -32.63 73.47 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.824 -3.048 . . . . 0.0 113.483 175.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.286 14.4 mt -73.0 -43.63 7.87 Favored Pre-proline 0 N--CA 1.448 -0.553 0 CA-C-O 114.636 -2.602 . . . . 0.0 110.588 176.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -59.19 -37.84 89.46 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 CA-C-N 123.195 2.177 . . . . 0.0 111.993 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.0 tp -64.34 -40.54 96.09 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 116.241 -1.837 . . . . 0.0 112.631 175.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.8 mt -77.5 -17.09 58.31 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 121.573 1.988 . . . . 0.0 114.661 -171.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -74.96 -29.89 61.05 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 169.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tt -88.44 -42.87 11.87 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.933 -2.461 . . . . 0.0 106.747 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.4 mmm -67.55 -25.01 65.6 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 113.474 -3.155 . . . . 0.0 118.433 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.2 mt -129.25 140.62 51.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 126.279 2.237 . . . . 0.0 109.435 177.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.2 p -72.44 157.35 89.24 Favored Pre-proline 0 N--CA 1.452 -0.369 0 C-N-CA 127.103 2.161 . . . . 0.0 111.608 175.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -51.18 -42.85 51.87 Favored 'Trans proline' 0 N--CA 1.447 -1.253 1 C-N-CA 127.51 5.473 . . . . 0.0 117.746 172.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -70.73 -39.81 73.15 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 116.49 -1.719 . . . . 0.0 115.543 169.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . 0.299 71.9 mt-10 -50.52 -54.26 23.72 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 168.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.7 mtm-85 -61.67 -41.91 98.2 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 117.584 -3.197 . . . . 0.0 112.352 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -73.3 -10.12 59.42 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 120.473 1.488 . . . . 0.0 108.607 -176.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.43 -35.15 12.46 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 119.469 -2.02 . . . . 0.0 113.425 170.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.14 -24.63 62.3 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 178.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.03 -40.62 99.16 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 118.133 -1.984 . . . . 0.0 115.862 157.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 74.8 m -74.18 -29.55 61.81 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 118.634 1.217 . . . . 0.0 111.421 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -59.75 -29.18 67.98 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 116.513 -3.867 . . . . 0.0 112.213 171.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.8 t -75.74 -36.93 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-N 119.87 1.214 . . . . 0.0 109.512 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.2 mtp180 -59.1 -40.94 86.88 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 118.886 -2.384 . . . . 0.0 109.752 168.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.271 74.9 mt -65.18 -50.07 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 C-N-CA 126.163 1.785 . . . . 0.0 110.485 -177.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.1 -39.64 86.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 120.399 -1.438 . . . . 0.0 109.747 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -52.93 -55.37 23.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 121.51 1.959 . . . . 0.0 111.209 173.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -67.95 -22.72 65.03 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 117.159 -3.463 . . . . 0.0 110.638 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.8 mt -87.75 -24.4 23.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 177.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.311 29.3 tp -81.25 -22.94 38.35 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.999 2.12 . . . . 0.0 115.062 163.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . 0.292 45.7 ttm180 -77.57 -55.16 5.6 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.687 -2.508 . . . . 0.0 112.615 175.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.92 10.17 84.39 Favored Glycine 0 CA--C 1.521 0.432 1 N-CA-C 123.72 4.248 . . . . 0.0 123.72 -175.125 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.306 74.6 mm-40 -106.48 -24.4 12.22 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -172.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.7 ttm -78.27 126.43 30.78 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 126.418 2.324 . . . . 0.0 111.158 155.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.3 p -81.01 162.66 23.72 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 119.389 -2.069 . . . . 0.0 115.667 177.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -55.21 -35.29 64.71 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 120.67 1.577 . . . . 0.0 111.078 172.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.7 tpt85 -72.99 -21.75 60.79 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 119.122 -2.236 . . . . 0.0 110.318 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -86.79 -33.11 20.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 122.028 2.194 . . . . 0.0 110.428 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.3 mt -63.27 -30.88 71.94 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 118.62 -2.55 . . . . 0.0 109.45 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -62.65 -31.15 71.97 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 128.594 2.758 . . . . 0.0 111.133 176.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -101.22 -37.58 8.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 121.72 2.054 . . . . 0.0 112.563 175.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -98.03 -20.53 17.33 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 119.149 -2.219 . . . . 0.0 110.412 -157.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.6 mt -114.27 -8.92 12.88 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 127.72 2.408 . . . . 0.0 110.018 162.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 86.73 10.56 72.57 Favored Glycine 0 CA--C 1.523 0.539 1 O-C-N 114.822 -4.924 . . . . 0.0 115.676 170.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -96.17 121.32 37.82 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 130.401 3.48 . . . . 0.0 115.894 -162.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.16 153.33 51.87 Favored Glycine 0 C--N 1.339 0.713 0 N-CA-C 118.79 2.276 . . . . 0.0 118.79 -176.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 14.5 mt -58.5 -34.92 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 O-C-N 117.036 -3.626 . . . . 0.0 114.202 -164.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.04 -34.06 50.73 Favored 'General case' 0 N--CA 1.452 -0.363 1 O-C-N 115.944 -4.223 . . . . 0.0 116.085 -168.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 48.3 p -78.14 -30.69 49.43 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 119.713 -1.867 . . . . 0.0 108.548 173.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.286 14.5 mm -65.18 -48.17 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 O-C-N 126.04 2.088 . . . . 0.0 110.224 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 45.7 m -58.51 -43.73 89.21 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.047 -0.977 . . . . 0.0 112.824 170.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -61.14 -50.47 73.05 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 -176.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -59.96 -35.94 88.65 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-N 122.336 2.335 . . . . 0.0 113.097 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 71.0 m -60.93 -45.67 93.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -58.22 -43.4 87.68 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 117.139 -3.475 . . . . 0.0 114.784 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.0 m -63.85 -26.44 68.61 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.888 1.675 . . . . 0.0 111.421 176.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.3 tp -83.28 -35.33 25.38 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 113.114 -3.327 . . . . 0.0 109.015 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -70.34 -29.26 65.91 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 127.894 3.247 . . . . 0.0 112.662 170.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.74 3.01 56.41 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.667 1.187 . . . . 0.0 110.71 173.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.99 145.4 77.39 Favored Pre-proline 0 N--CA 1.447 -0.578 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.65 152.37 78.09 Favored 'Trans proline' 0 N--CA 1.451 -0.99 0 C-N-CA 117.17 -1.42 . . . . 0.0 114.628 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -57.76 -42.04 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-O 115.665 -2.112 . . . . 0.0 114.212 -174.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -48.11 -40.98 25.16 Favored 'General case' 0 N--CA 1.453 -0.289 1 O-C-N 130.585 4.928 . . . . 0.0 115.794 173.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 39.3 tp -75.71 -50.01 16.62 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.974 1.368 . . . . 0.0 111.248 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -57.02 -46.76 82.1 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 117.971 -2.956 . . . . 0.0 111.317 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -66.09 -34.51 78.22 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 120.467 -1.395 . . . . 0.0 111.128 -174.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 60.2 t90 -77.34 -34.69 55.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.425 -2.672 . . . . 0.0 109.336 -178.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.7 mt -78.66 -22.98 46.0 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 117.951 -2.968 . . . . 0.0 104.856 -174.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -63.59 -32.61 74.13 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 128.74 2.816 . . . . 0.0 111.733 170.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -87.78 -19.21 27.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 129.098 2.959 . . . . 0.0 112.431 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.8 t -101.37 -61.83 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 80.3 mt -87.4 -19.93 27.39 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 118.006 -2.934 . . . . 0.0 115.331 -162.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.2 mt -106.67 0.51 24.38 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 118.707 -2.496 . . . . 0.0 114.809 178.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.0 tttp -89.16 -3.27 58.66 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 117.669 2.47 . . . . 0.0 117.669 -176.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 4.8 m -111.33 -19.29 12.68 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 116.956 -3.59 . . . . 0.0 115.873 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 128.096 2.559 . . . . 0.0 112.537 -167.082 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? . . . . . 0 N--CA 1.472 0.656 0 CA-C-O 115.772 -2.061 . . . . 0.0 112.332 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.69 -4.77 50.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 125.6 3.818 . . . . 0.0 117.398 -160.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -81.59 -15.25 55.31 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 118.77 -2.456 . . . . 0.0 113.158 174.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 9.2 tp60 -93.75 -30.43 14.88 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 113.838 -1.528 . . . . 0.0 113.528 174.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.37 146.98 48.83 Favored Pre-proline 0 N--CA 1.447 -0.578 0 C-N-CA 117.933 -1.507 . . . . 0.0 112.617 -169.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.78 -12.51 26.5 Favored 'Trans proline' 0 N--CA 1.448 -1.179 1 C-N-CA 125.375 4.05 . . . . 0.0 113.06 -173.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -140.16 152.93 46.44 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 119.265 -2.147 . . . . 0.0 111.718 160.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 29.8 t -147.86 105.54 3.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 124.535 2.112 . . . . 0.0 111.319 177.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.44 -28.2 68.1 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 125.272 2.463 . . . . 0.0 114.577 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.87 -35.96 72.59 Favored 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 118.483 -2.636 . . . . 0.0 113.913 172.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 38.6 mtt -69.06 -35.32 76.43 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 121.681 2.037 . . . . 0.0 110.245 168.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.22 -35.87 80.23 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.048 0.928 . . . . 0.0 111.681 178.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -64.6 -52.99 54.64 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 115.715 -2.088 . . . . 0.0 112.632 164.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 42.6 tp60 -60.53 -28.09 68.14 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 123.598 2.908 . . . . 0.0 117.192 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -77.22 -38.3 51.59 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 126.333 2.968 . . . . 0.0 117.096 172.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -52.24 -51.72 56.71 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.007 -2.933 . . . . 0.0 107.812 169.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -53.79 -36.14 62.11 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 126.468 2.355 . . . . 0.0 115.301 166.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -76.92 -35.25 57.46 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 117.191 -3.443 . . . . 0.0 114.534 -175.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . 0.253 47.9 t-105 -57.68 -50.74 72.19 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.334 -1.479 . . . . 0.0 113.375 158.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 70.8 mt -68.41 -12.16 60.73 Favored 'General case' 0 N--CA 1.452 -0.375 0 O-C-N 116.841 -3.662 . . . . 0.0 110.219 -176.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -83.12 -26.42 31.03 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 122.477 2.399 . . . . 0.0 111.53 169.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -71.25 -42.17 69.18 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.021 160.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 53.6 t -69.02 -43.24 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 1 O-C-N 115.917 -4.239 . . . . 0.0 113.582 -178.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -63.87 -47.51 80.4 Favored 'General case' 0 N--CA 1.454 -0.265 1 C-N-CA 131.997 4.119 . . . . 0.0 111.643 169.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.76 -40.86 85.16 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 120.606 1.548 . . . . 0.0 111.211 176.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 67.8 tp -72.27 -36.69 69.06 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 119.316 -2.115 . . . . 0.0 105.5 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -58.83 -47.8 83.56 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 116.27 -1.824 . . . . 0.0 108.176 175.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -76.97 -30.35 55.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 122.707 2.503 . . . . 0.0 114.314 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.8 -45.86 88.93 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 170.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . 0.264 41.0 m-85 -47.8 -39.39 18.07 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 119.73 3.233 . . . . 0.0 119.73 166.507 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -66.93 -35.59 80.33 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.724 1.21 . . . . 0.0 109.211 177.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -94.35 -0.7 54.74 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 123.24 1.495 . . . . 0.0 113.127 -173.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.334 8.3 m-20 56.6 36.52 27.75 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 127.726 2.411 . . . . 0.0 116.482 -166.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 61.8 mt -100.26 4.86 44.47 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 29.1 p-80 -61.48 -38.74 88.39 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 128.714 2.806 . . . . 0.0 116.232 -173.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 14.7 mt -70.04 -49.37 19.05 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-O 114.492 -2.671 . . . . 0.0 110.477 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -58.01 -33.32 97.09 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 O-C-N 125.758 2.452 . . . . 0.0 117.228 174.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 37.8 tp -74.62 -45.82 42.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 113.433 -3.175 . . . . 0.0 114.814 173.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 56.8 mt -54.24 -42.3 69.73 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 126.387 2.304 . . . . 0.0 115.927 168.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -62.45 -41.25 98.61 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 31.5 tp -72.47 -36.19 68.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 115.392 -2.242 . . . . 0.0 111.928 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 22.3 mmt -88.78 -19.46 25.99 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 115.656 -2.116 . . . . 0.0 112.52 -170.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 17.1 mt -134.99 146.11 48.75 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 126.761 2.538 . . . . 0.0 111.236 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' THR . . . . . 0.641 ' HB ' ' HD2' ' B' ' 45' ' ' PRO . 30.0 p -88.18 158.1 49.95 Favored Pre-proline 0 N--CA 1.449 -0.482 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -176.056 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 45' ' ' PRO . . . . . 0.641 ' HD2' ' HB ' ' B' ' 44' ' ' THR . 74.6 Cg_exo -36.58 -47.46 1.31 Allowed 'Trans proline' 0 N--CA 1.447 -1.207 1 C-N-CA 127.046 5.164 . . . . 0.0 115.823 173.317 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.89 -29.74 63.4 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 173.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -70.13 -42.49 72.52 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 126.903 3.24 . . . . 0.0 110.911 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -66.13 -51.37 58.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.452 -2.655 . . . . 0.0 112.967 178.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -55.45 -41.2 72.55 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.796 2.438 . . . . 0.0 114.457 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.0 -28.88 60.71 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.5 mt -67.11 -44.14 80.7 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 116.162 1.912 . . . . 0.0 116.162 169.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.86 -46.01 69.12 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.584 166.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 17.9 m -63.6 -51.96 62.98 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 113.834 -2.984 . . . . 0.0 107.627 -175.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -40.9 -33.82 0.34 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.585 2.754 . . . . 0.0 112.424 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 40.7 t -65.1 -42.17 93.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-O 116.27 -1.824 . . . . 0.0 107.302 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 38.4 mtp180 -72.31 -33.06 67.09 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 120.172 1.351 . . . . 0.0 111.334 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 59.5 mt -54.17 -62.62 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 123.449 2.84 . . . . 0.0 112.007 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.338 77.1 t -66.7 -33.07 61.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 C-N-CA 126.212 1.805 . . . . 0.0 110.77 -170.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.93 -28.49 68.97 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 115.223 -2.322 . . . . 0.0 116.928 165.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . 0.291 20.7 tp10 -90.07 -27.36 19.73 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 127.929 3.268 . . . . 0.0 113.157 -179.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 56.9 mt -65.87 -30.41 71.01 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 114.989 -1.005 . . . . 0.0 112.153 166.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 24.0 mt -77.85 -41.74 35.92 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.126 1.371 . . . . 0.0 113.66 170.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 28.5 ttm105 -77.13 -64.07 1.22 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 115.144 -2.36 . . . . 0.0 113.612 -174.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.66 93.25 0.04 OUTLIER Glycine 0 CA--C 1.521 0.45 0 C-N-CA 129.847 3.594 . . . . 0.0 114.172 -165.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -134.48 -60.04 0.8 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 130.762 3.625 . . . . 0.0 114.505 168.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 38.6 mtt -64.08 139.27 58.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 115.875 1.805 . . . . 0.0 115.875 -164.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 82.9 p -72.45 161.5 30.73 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 118.124 2.639 . . . . 0.0 118.124 156.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -54.16 -32.5 55.53 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 117.677 2.473 . . . . 0.0 117.677 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -65.39 -46.77 78.75 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 114.614 -2.612 . . . . 0.0 111.046 173.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -62.48 -43.92 97.65 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 127.063 2.727 . . . . 0.0 116.795 172.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 70.3 mt -56.27 -39.67 73.01 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 117.765 -1.112 . . . . 0.0 112.092 174.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -83.84 -20.91 32.33 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 121.417 1.917 . . . . 0.0 112.648 -171.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -111.67 -34.98 5.89 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 115.57 -2.157 . . . . 0.0 109.113 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -91.29 -24.63 19.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 18.6 mt -112.35 -7.84 13.95 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 130.616 3.566 . . . . 0.0 111.375 169.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.59 18.67 72.19 Favored Glycine 0 C--N 1.336 0.564 0 CA-C-N 121.815 2.098 . . . . 0.0 114.556 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.03 130.1 46.99 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -165.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.85 165.91 44.34 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 128.265 2.84 . . . . 0.0 115.276 169.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 43.1 mt -61.43 -50.7 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-O 118.483 -0.77 . . . . 0.0 112.459 -170.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.13 73.65 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.004 1.483 . . . . 0.0 115.004 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 16.1 m -62.41 -44.37 96.59 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 116.244 -1.836 . . . . 0.0 111.03 174.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 36.2 mm -73.15 -38.97 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 CA-C-N 121.911 2.141 . . . . 0.0 112.449 -178.097 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 30.2 m -62.38 -45.52 92.76 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 125.199 1.4 . . . . 0.0 111.878 178.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -53.77 -26.05 21.79 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 130.502 3.521 . . . . 0.0 109.751 171.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.14 -43.96 62.13 Favored Glycine 0 C--N 1.337 0.617 0 CA-C-O 124.817 2.343 . . . . 0.0 116.392 177.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . 0.381 7.1 p -61.26 -39.88 91.99 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 117.81 2.522 . . . . 0.0 117.81 175.049 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -67.79 -25.89 65.82 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.191 2.182 . . . . 0.0 112.899 168.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 44.9 m -78.64 -41.34 31.68 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 103.792 -2.67 . . . . 0.0 103.792 -174.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 mt -68.84 -27.2 65.62 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 117.123 -3.486 . . . . 0.0 108.901 178.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -65.1 -46.22 81.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 124.334 3.243 . . . . 0.0 115.976 174.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.33 -4.28 50.15 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 108.678 -3.874 . . . . 0.0 114.85 174.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.23 156.39 81.42 Favored Pre-proline 0 N--CA 1.449 -0.479 0 CA-C-N 122.66 2.482 . . . . 0.0 114.512 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -59.99 129.88 32.25 Favored 'Trans proline' 0 N--CA 1.45 -1.045 1 C-N-CA 126.345 4.697 . . . . 0.0 110.353 164.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.253 2.7 m -72.29 -17.09 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 116.174 -1.869 . . . . 0.0 114.314 -171.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 13.8 pm0 -74.15 -21.86 59.68 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 125.445 1.715 . . . . 0.0 113.583 171.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.6 tp -70.32 -42.0 72.52 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 118.276 -1.37 . . . . 0.0 112.624 173.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -52.47 -51.64 58.32 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 128.113 2.565 . . . . 0.0 109.371 177.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -56.27 -41.93 76.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.056 -1.429 . . . . 0.0 112.385 172.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 17.1 t90 -70.59 -42.66 70.73 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 118.32 -2.738 . . . . 0.0 112.933 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 100' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' B' ' 100' ' ' LEU . 17.4 mt -78.03 -25.42 47.86 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -168.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -49.6 -34.93 19.22 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.674 1.99 . . . . 0.0 113.296 158.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -100.4 -32.11 10.98 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 118.853 0.751 . . . . 0.0 112.643 -175.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 56.7 t -91.87 -8.91 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -177.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 40.4 mt -103.58 -43.39 5.39 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 120.293 -1.504 . . . . 0.0 114.302 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 57.5 mt -90.07 -24.7 21.08 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.848 -154.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.46 -11.79 60.58 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 113.574 -3.107 . . . . 0.0 111.356 168.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 51.2 m -76.08 5.58 6.52 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 123.533 2.879 . . . . 0.0 115.027 169.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 . . . . . 0 C--O 1.249 1.05 0 N-CA-C 121.58 3.919 . . . . 0.0 121.58 174.992 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 53.2 ttm . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 125.853 2.74 . . . . 0.0 108.229 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -53.87 139.8 32.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 -159.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -100.95 126.17 47.58 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 116.955 -3.59 . . . . 0.0 116.413 -158.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -130.24 122.27 27.74 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 129.574 3.15 . . . . 0.0 111.589 -168.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 80.7 p -151.5 146.2 18.66 Favored Pre-proline 0 N--CA 1.45 -0.429 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -171.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.45 -30.58 72.11 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 122.751 2.3 . . . . 0.0 112.987 175.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -139.49 156.56 46.85 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 117.797 -3.064 . . . . 0.0 111.316 171.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 10.7 t -148.11 132.19 17.28 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.23 -1.804 . . . . 0.0 110.674 171.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.26 -28.06 59.68 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.846 -1.549 . . . . 0.0 112.164 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.23 -38.86 88.92 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.437 1.926 . . . . 0.0 112.757 172.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 57.3 mtt -70.27 -40.07 74.56 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.158 0.983 . . . . 0.0 108.796 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.45 -24.1 60.18 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 119.998 3.333 . . . . 0.0 119.998 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -71.56 -45.79 61.27 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.131 0.972 . . . . 0.0 110.605 163.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -59.16 -32.68 70.11 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 123.888 1.804 . . . . 0.0 111.817 174.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -38.94 65.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 117.466 -3.271 . . . . 0.0 113.782 169.042 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -54.16 -43.15 70.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 118.44 2.755 . . . . 0.0 118.44 164.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -69.21 -39.12 78.78 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 116.102 -1.904 . . . . 0.0 112.444 172.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -60.39 -43.03 97.02 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.172 -1.871 . . . . 0.0 110.152 174.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 19' ' ' TRP . . . . . 0.498 ' CZ2' ' HD2' ' D' ' 48' ' ' ARG . 19.9 t-105 -69.3 -40.89 77.4 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 122.179 2.263 . . . . 0.0 111.661 176.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.62 -17.01 64.03 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 119.255 -2.153 . . . . 0.0 114.728 173.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -65.7 -34.68 78.76 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 118.552 2.797 . . . . 0.0 118.552 159.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -59.24 -43.72 92.38 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 121.762 2.074 . . . . 0.0 115.583 176.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 11.7 t -56.9 -53.59 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 O-C-N 124.41 1.069 . . . . 0.0 112.606 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -75.1 -30.93 61.04 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 126.894 2.621 . . . . 0.0 110.747 -171.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 43.3 tp -67.94 -36.09 79.52 Favored 'General case' 0 N--CA 1.453 -0.321 1 O-C-N 116.061 -4.149 . . . . 0.0 112.531 170.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . 0.284 53.4 tp -74.62 -28.57 60.94 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 130.573 3.549 . . . . 0.0 108.339 174.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -60.58 -34.33 74.03 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 124.858 3.481 . . . . 0.0 110.844 168.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -73.24 -36.88 66.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 125.787 2.708 . . . . 0.0 112.434 176.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.68 -24.4 58.78 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 112.852 -1.976 . . . . 0.0 113.331 -169.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -65.09 -21.42 66.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 119.442 -2.036 . . . . 0.0 111.797 171.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -71.78 -33.74 68.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 119.955 1.252 . . . . 0.0 113.065 -178.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -123.98 33.45 5.29 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 124.557 2.123 . . . . 0.0 115.379 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.34 0.5 OUTLIER 59.76 13.38 3.47 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 118.704 2.853 . . . . 0.0 118.704 178.01 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 34' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' C' ' 34' ' ' LEU . 18.0 mt -87.59 6.58 33.78 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 123.804 0.69 . . . . 0.0 110.399 -177.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -67.71 -32.17 72.63 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.081 0.952 . . . . 0.0 110.239 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 mt -80.18 -50.44 1.16 Allowed Pre-proline 0 N--CA 1.453 -0.298 0 O-C-N 117.346 -3.346 . . . . 0.0 111.627 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -50.23 -44.32 39.01 Favored 'Trans proline' 0 N--CA 1.446 -1.273 1 C-N-CA 126.6 4.867 . . . . 0.0 112.629 171.421 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 33.2 tp -63.72 -51.31 65.53 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 121.562 -0.711 . . . . 0.0 112.448 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 75.7 mt -49.05 -34.76 14.2 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 121.377 3.843 . . . . 0.0 121.377 160.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -71.22 -25.52 62.53 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 121.036 1.744 . . . . 0.0 114.704 167.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 33.3 tp -76.19 -55.5 5.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 21.1 mmt -68.86 -35.17 76.6 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 123.752 1.739 . . . . 0.0 114.696 -165.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 3.8 mp -113.33 130.53 56.25 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 119.411 -2.055 . . . . 0.0 107.113 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 49.8 p -54.83 155.9 7.42 Favored Pre-proline 0 N--CA 1.448 -0.538 0 O-C-N 128.551 3.657 . . . . 0.0 111.931 164.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . 0.305 2.1 Cg_endo -54.86 -26.92 50.68 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 124.347 3.365 . . . . 0.0 116.466 168.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -61.65 -57.06 13.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 124.321 1.013 . . . . 0.0 111.148 166.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -65.39 -27.44 68.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 -178.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 69.8 mtm-85 -77.08 -47.3 20.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 123.133 1.444 . . . . 0.0 107.188 174.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -55.55 -36.72 67.1 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.586 -3.196 . . . . 0.0 113.61 171.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.16 -45.09 86.35 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 119.852 -1.78 . . . . 0.0 112.679 176.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 51' ' ' LEU . . . . . 0.521 HD13 ' CE1' ' D' ' 22' ' ' PHE . 32.5 mt -65.12 -31.05 72.06 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 121.995 2.179 . . . . 0.0 111.918 175.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.71 -17.31 66.92 Favored Glycine 0 N--CA 1.444 -0.809 0 O-C-N 117.77 -3.081 . . . . 0.0 119.459 163.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 6.6 m -89.54 -43.53 10.74 Favored 'General case' 0 N--CA 1.45 -0.425 0 O-C-N 127.147 2.322 . . . . 0.0 109.069 178.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -67.44 -26.96 66.66 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 115.578 1.695 . . . . 0.0 115.578 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 4.6 t -62.75 -24.39 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 120.415 1.461 . . . . 0.0 111.066 168.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -97.81 -27.83 14.13 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 117.657 -3.152 . . . . 0.0 109.148 -175.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . 0.294 9.9 mt -49.23 -51.04 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 C-N-CA 127.045 2.138 . . . . 0.0 114.419 159.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 82.6 t -59.79 -64.12 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-N 113.482 -1.69 . . . . 0.0 109.839 170.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -43.87 -50.21 8.05 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 114.907 -2.473 . . . . 0.0 117.07 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -73.8 -19.24 60.81 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 112.798 -3.477 . . . . 0.0 115.712 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 16.4 mt -73.88 -36.15 64.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 128.333 2.653 . . . . 0.0 114.269 162.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 94.8 mt -73.02 -39.36 66.06 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.897 2.079 . . . . 0.0 111.318 169.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 38.0 ttm105 -70.31 -44.21 68.76 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 116.082 -1.913 . . . . 0.0 112.477 171.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.44 15.73 68.55 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 126.101 1.81 . . . . 0.0 116.425 171.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -85.26 42.45 0.95 Allowed 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 116.716 -3.814 . . . . 0.0 113.016 -177.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 46.6 mtt -125.36 143.69 50.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 117.509 2.411 . . . . 0.0 117.509 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 7.3 p -72.89 175.54 6.48 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 119.716 -1.865 . . . . 0.0 108.828 171.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -65.3 -34.9 79.44 Favored 'General case' 0 N--CA 1.45 -0.449 1 O-C-N 116.177 -4.077 . . . . 0.0 111.116 172.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 20.6 ttp-105 -55.98 -60.63 3.2 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 130.704 3.602 . . . . 0.0 110.525 172.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -60.25 -35.54 75.72 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 125.726 1.61 . . . . 0.0 115.291 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 48.5 mt -56.09 -51.84 66.46 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 125.705 1.878 . . . . 0.0 112.579 167.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -67.11 -33.12 74.78 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 118.132 -2.855 . . . . 0.0 113.356 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -95.61 14.34 23.26 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.973 -171.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -150.6 -40.06 0.13 Allowed 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 116.39 -3.944 . . . . 0.0 111.688 -165.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mp -84.29 -33.23 24.02 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.909 -1.12 . . . . 0.0 113.105 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 52.97 -159.29 3.54 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 115.34 -2.922 . . . . 0.0 117.832 -173.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.57 -18.61 62.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 120.483 3.512 . . . . 0.0 120.483 -174.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.7 -20.84 62.25 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 129.542 3.448 . . . . 0.0 114.039 172.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 19.3 tt -46.73 -29.88 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 126.656 2.033 . . . . 0.0 116.4 171.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -85.24 -8.47 58.53 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.563 3.145 . . . . 0.0 108.339 -173.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 70.0 m -76.46 -43.64 39.08 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.564 -3.21 . . . . 0.0 112.469 172.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 31.4 mm -81.99 -39.61 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 112.508 -2.133 . . . . 0.0 115.11 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . 0.292 13.9 p -95.72 -11.8 26.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 120.774 3.62 . . . . 0.0 120.774 -175.573 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -114.09 146.26 40.49 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 117.526 -3.234 . . . . 0.0 109.988 175.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 99.48 -175.91 28.42 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 129.724 3.535 . . . . 0.0 117.276 169.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 3.6 m -68.78 -21.21 64.36 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 126.57 1.948 . . . . 0.0 116.243 -168.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -101.81 -3.0 28.76 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 25.5 p -67.39 162.19 23.54 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 124.04 1.876 . . . . 0.0 112.167 -163.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 7.8 tp -52.82 -39.38 62.38 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 120.365 3.468 . . . . 0.0 120.365 -164.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.353 90.5 mttt -69.97 -28.9 65.92 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 118.693 -2.505 . . . . 0.0 116.551 168.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.49 -24.94 17.08 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -166.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.23 163.2 19.12 Favored Pre-proline 0 N--CA 1.447 -0.594 0 C-N-CA 128.148 2.579 . . . . 0.0 113.44 -159.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.62 134.46 46.73 Favored 'Trans proline' 0 N--CA 1.445 -1.377 0 CA-C-N 126.066 3.202 . . . . 0.0 112.069 176.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 18.1 t -53.17 -37.9 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 130.495 3.518 . . . . 0.0 109.384 -177.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pm0 -79.01 -14.09 59.4 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 128.809 2.844 . . . . 0.0 113.353 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 37.2 tp -86.99 -47.51 8.89 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 118.971 -2.33 . . . . 0.0 111.76 166.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 34.4 mtp-105 -56.93 -43.41 81.46 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 113.03 -1.896 . . . . 0.0 114.2 171.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . 0.28 90.4 mt-30 -59.1 -26.56 64.77 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 117.135 -3.478 . . . . 0.0 117.543 168.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -86.17 -47.89 9.07 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 116.3 -4.0 . . . . 0.0 110.936 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 32.4 mt -53.07 -31.93 44.32 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 116.818 -3.676 . . . . 0.0 114.235 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -75.64 -31.25 59.75 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 122.47 2.396 . . . . 0.0 112.349 172.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -75.42 -22.18 57.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 125.178 2.418 . . . . 0.0 115.165 178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 39.2 t -98.34 -49.95 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 O-C-N 117.295 -3.378 . . . . 0.0 114.927 172.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 60.6 mt -82.42 -19.29 39.32 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 116.075 -1.917 . . . . 0.0 113.97 -171.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 88.0 mt -127.97 18.32 6.65 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 125.639 1.837 . . . . 0.0 109.456 -174.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 106' ' ' LYS . . . . . 0.401 ' HE3' ' OXT' ' C' ' 108' ' ' ASP . 47.5 pttt -47.23 155.4 0.31 Allowed 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 119.712 3.227 . . . . 0.0 119.712 178.053 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 15.0 m -109.46 22.91 15.17 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 119.661 1.118 . . . . 0.0 111.1 161.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 108' ' ' ASP . . . . . 0.401 ' OXT' ' HE3' ' C' ' 106' ' ' LYS . 3.3 t0 . . . . . 0 C--O 1.248 1.003 0 O-C-N 117.192 -3.442 . . . . 0.0 109.84 174.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ttt . . . . . 0 N--CA 1.47 0.538 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -132.23 146.07 51.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 118.397 0.544 . . . . 0.0 112.158 -173.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -100.97 148.27 25.21 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.518 1.527 . . . . 0.0 110.191 170.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 41.7 tt0 -109.28 156.44 19.94 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.088 -177.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 54.0 p -148.12 168.91 10.14 Favored Pre-proline 0 N--CA 1.453 -0.283 0 CA-C-O 115.213 -2.327 . . . . 0.0 113.602 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -82.07 -37.74 0.23 Allowed 'Trans proline' 0 N--CA 1.448 -1.185 0 C-N-CA 124.326 3.351 . . . . 0.0 114.42 -177.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -143.68 139.37 29.51 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 114.656 -2.592 . . . . 0.0 114.192 -172.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 14.5 t -59.24 123.95 18.38 Favored 'General case' 0 N--CA 1.451 -0.396 1 CA-C-N 126.513 4.233 . . . . 0.0 114.359 171.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.32 -28.85 69.6 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 128.313 2.645 . . . . 0.0 109.749 173.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.8 -50.33 51.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 130.889 3.676 . . . . 0.0 105.587 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 11.1 mmt -61.45 -37.4 83.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.7 -42.43 83.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 117.999 -1.0 . . . . 0.0 113.468 174.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -65.24 -62.47 1.52 Allowed 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 168.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -44.71 -30.83 1.01 Allowed 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 120.511 1.505 . . . . 0.0 114.841 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.385 0.0 OUTLIER -83.72 -14.74 50.93 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 118.789 -2.444 . . . . 0.0 116.569 -174.401 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -82.76 -32.8 27.63 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 127.249 2.22 . . . . 0.0 111.869 157.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -74.82 -40.46 61.07 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 126.044 2.09 . . . . 0.0 111.023 -175.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -69.9 -6.99 36.65 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 125.92 2.013 . . . . 0.0 115.678 169.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -85.27 -52.7 5.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 128.735 2.814 . . . . 0.0 110.715 170.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 65.6 mt -57.07 -18.5 14.65 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 118.996 2.962 . . . . 0.0 118.996 168.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 59.5 ttt180 -66.94 -31.2 71.63 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 127.531 2.332 . . . . 0.0 109.197 169.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 22' ' ' PHE . . . . . 0.521 ' CE1' HD13 ' C' ' 51' ' ' LEU . 86.5 t80 -87.59 -30.03 20.8 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 126.715 2.51 . . . . 0.0 108.89 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 81.5 t -65.78 -33.72 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 118.144 -2.848 . . . . 0.0 110.948 169.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -73.16 -46.07 52.95 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 127.918 2.487 . . . . 0.0 112.343 169.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 15.5 tp -56.74 -40.77 76.35 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 120.653 1.57 . . . . 0.0 113.626 175.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 tp -77.95 -39.54 42.29 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 115.744 -2.074 . . . . 0.0 114.849 175.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp -53.12 -57.24 11.12 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 122.362 2.346 . . . . 0.0 117.249 165.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -57.95 -32.81 68.19 Favored 'General case' 0 N--CA 1.446 -0.634 1 O-C-N 129.913 4.508 . . . . 0.0 111.456 173.315 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.48 -23.8 50.3 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 121.285 1.857 . . . . 0.0 113.525 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -64.34 -34.15 77.49 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 124.08 3.127 . . . . 0.0 110.72 162.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -89.23 3.5 51.79 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 129.677 3.191 . . . . 0.0 114.279 -173.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 57.3 p30 -135.28 13.68 3.53 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 119.331 0.968 . . . . 0.0 112.945 155.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.262 0.6 OUTLIER 54.24 38.6 29.62 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 117.114 -1.422 . . . . 0.0 111.471 -178.704 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 92.6 mt -86.0 13.68 7.27 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.404 2.366 . . . . 0.0 116.778 155.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.21 -47.7 55.86 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 125.395 1.478 . . . . 0.0 112.086 -164.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 3.6 mt -64.14 -52.32 56.12 Favored Pre-proline 0 N--CA 1.448 -0.53 0 CA-C-O 114.733 -2.556 . . . . 0.0 111.283 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.61 -34.21 14.74 Favored 'Trans proline' 0 N--CA 1.447 -1.233 0 C-N-CA 124.487 3.458 . . . . 0.0 116.642 166.247 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 51.9 tp -85.8 -34.04 21.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.863 2.172 . . . . 0.0 116.863 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 19.9 mt -71.34 -34.31 70.41 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 126.436 3.017 . . . . 0.0 111.676 169.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 19.5 m-20 -72.68 -35.31 67.64 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 117.626 -3.171 . . . . 0.0 111.913 174.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 14.6 tp -68.2 -38.72 82.27 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 123.746 1.736 . . . . 0.0 109.584 169.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.2 mmt -79.03 -38.15 37.26 Favored 'General case' 0 N--CA 1.452 -0.371 1 O-C-N 116.171 -4.081 . . . . 0.0 115.198 -176.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 17.2 mt -109.94 140.22 44.17 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.251 1.42 . . . . 0.0 112.839 -179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 64.0 p -68.51 168.12 15.73 Favored Pre-proline 0 N--CA 1.453 -0.282 0 C-N-CA 128.1 2.56 . . . . 0.0 112.451 167.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -57.8 -42.24 61.33 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.552 3.501 . . . . 0.0 115.831 177.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -81.99 -18.27 43.98 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 126.2 2.187 . . . . 0.0 114.791 -175.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -71.12 -44.21 66.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 170.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 48' ' ' ARG . . . . . 0.498 ' HD2' ' CZ2' ' C' ' 19' ' ' TRP . 41.1 mtm-85 -68.36 -40.42 81.47 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 171.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.06 -38.28 79.04 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 116.377 1.991 . . . . 0.0 116.377 167.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.329 . . -61.51 -43.23 99.24 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.956 -1.715 . . . . 0.0 113.135 168.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.27 -45.77 92.15 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.773 -1.829 . . . . 0.0 115.282 175.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.26 -40.12 91.28 Favored Glycine 0 CA--C 1.525 0.658 0 O-C-N 126.762 2.539 . . . . 0.0 114.279 169.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 8.1 m -61.7 -43.53 98.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.286 1.835 . . . . 0.0 114.661 166.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.274 96.7 mtt180 -59.69 -41.98 91.93 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 175.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 55' ' ' VAL . . . . . 0.426 ' H ' HG23 ' D' ' 55' ' ' VAL . 9.1 t -41.28 -59.87 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 O-C-N 120.316 -1.49 . . . . 0.0 113.851 164.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -72.32 -24.11 61.26 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 55.9 mt -71.0 -46.22 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 C-N-CA 127.338 2.255 . . . . 0.0 107.545 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . 0.322 18.7 t -62.68 -39.19 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 174.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -66.91 -52.1 47.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 119.666 -1.896 . . . . 0.0 111.57 170.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -62.38 -31.18 71.8 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 33.1 mt -61.28 -40.45 94.18 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 118.126 2.639 . . . . 0.0 118.126 167.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 42.1 mt -69.84 -34.47 73.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 116.953 -3.592 . . . . 0.0 111.241 167.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 63' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' D' ' 63' ' ' ARG . 30.5 ttm180 -64.96 -47.56 77.18 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 117.351 -3.343 . . . . 0.0 114.945 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 44.93 62.57 2.93 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-O 124.512 2.173 . . . . 0.0 116.884 -174.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -124.63 -35.37 2.74 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.0 -3.059 . . . . 0.0 112.888 170.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 28.6 mtt -75.97 58.75 1.21 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 124.284 3.22 . . . . 0.0 106.797 155.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 88.5 p -82.3 168.1 17.92 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 119.542 -1.974 . . . . 0.0 113.785 -175.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.298 8.0 tp60 69.54 -53.62 0.6 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 120.842 3.645 . . . . 0.0 120.842 167.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . 0.285 74.1 ttt180 -120.92 -33.12 3.82 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.396 2.279 . . . . 0.0 112.567 171.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.77 -26.73 40.58 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 122.675 2.489 . . . . 0.0 112.557 -167.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mt -63.23 -52.78 60.82 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.949 0.9 . . . . 0.0 111.39 174.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -68.19 -26.55 65.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 116.604 -3.81 . . . . 0.0 115.156 173.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -109.86 -26.1 9.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 124.977 3.535 . . . . 0.0 118.502 -173.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -104.52 -44.9 4.78 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 116.422 -1.751 . . . . 0.0 115.599 176.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.77 -41.09 88.27 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 124.29 0.994 . . . . 0.0 110.666 158.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 93.6 -171.05 31.56 Favored Glycine 0 C--N 1.337 0.597 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 155.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -40.13 -32.39 0.17 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 129.281 3.032 . . . . 0.0 117.357 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.73 -23.13 49.29 Favored Glycine 0 C--N 1.338 0.676 0 CA-C-O 116.52 -2.267 . . . . 0.0 118.334 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 6.5 tt -50.01 -16.25 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 131.163 3.785 . . . . 0.0 117.611 170.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . 0.276 . . -84.75 -42.46 15.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 116.546 -3.846 . . . . 0.0 114.052 174.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 96.8 m -59.17 -27.55 65.78 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 125.348 2.499 . . . . 0.0 111.754 171.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 39.0 mm -100.12 -25.32 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 O-C-N 120.204 -1.56 . . . . 0.0 112.262 -170.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 44.9 p -109.54 5.19 22.94 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 173.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 41.4 mtp85 -125.05 159.96 30.13 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.664 0.745 . . . . 0.0 109.844 172.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 87.98 151.66 22.58 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-O 125.247 2.582 . . . . 0.0 113.236 -170.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 35.7 p -84.68 2.47 41.63 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 109.58 -3.31 . . . . 0.0 116.971 -153.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -123.41 29.5 6.62 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.268 1.027 . . . . 0.0 112.888 159.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 2.1 p -63.16 173.86 1.34 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 117.198 -1.801 . . . . 0.0 114.571 169.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.6 -21.82 54.39 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 119.846 3.276 . . . . 0.0 119.846 163.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -78.49 -12.41 60.01 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 122.78 1.276 . . . . 0.0 113.328 169.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -123.75 1.07 8.76 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 113.331 -1.759 . . . . 0.0 112.536 -169.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 92' ' ' ALA . . . . . 0.472 ' HB1' HG22 ' D' ' 94' ' ' VAL . . . 39.55 95.86 0.04 OUTLIER Pre-proline 0 N--CA 1.451 -0.392 0 C-N-CA 127.727 2.411 . . . . 0.0 108.76 144.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 93' ' ' PRO . . . . . 0.47 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 84.9 Cg_exo 32.15 35.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.257 0 N-CA-C 119.587 2.88 . . . . 0.0 119.587 32.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 94' ' ' VAL . . . . . 0.472 HG22 ' HB1' ' D' ' 92' ' ' ALA . 39.8 t -60.32 -25.9 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-O 117.263 -1.351 . . . . 0.0 107.665 -176.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.9 -25.21 28.08 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 126.252 2.22 . . . . 0.0 110.886 -171.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 29.4 tp -72.42 -35.75 68.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 124.038 0.836 . . . . 0.0 113.092 162.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -62.61 -53.15 58.93 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 123.205 1.478 . . . . 0.0 113.789 176.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -51.88 -39.94 59.83 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 118.776 -2.453 . . . . 0.0 111.031 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -73.4 -33.39 64.97 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 120.44 -1.412 . . . . 0.0 108.298 -166.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 61.2 mt -81.11 -31.98 34.05 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -174.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.19 -31.12 72.18 Favored 'General case' 0 N--CA 1.447 -0.577 1 CA-C-O 111.471 -4.109 . . . . 0.0 109.828 175.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -89.76 -36.71 15.0 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 126.727 2.517 . . . . 0.0 111.12 -177.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.377 41.8 t -78.8 -36.0 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 C-N-CA 128.508 2.723 . . . . 0.0 113.509 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 60.5 mt -96.15 -39.09 9.87 Favored 'General case' 0 N--CA 1.447 -0.61 1 CA-C-O 111.285 -4.198 . . . . 0.0 108.109 -175.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 17.6 mt -90.93 14.74 12.96 Favored 'General case' 0 N--CA 1.452 -0.347 1 CA-C-N 127.333 4.606 . . . . 0.0 113.453 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -44.46 156.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 162.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -7.76 52.48 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 127.917 3.722 . . . . 0.0 117.148 -160.131 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 129.555 3.142 . . . . 0.0 109.434 -179.772 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 118.317 -0.849 . . . . 0.0 109.139 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -58.73 -60.65 3.49 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 116.333 -1.794 . . . . 0.0 114.051 -168.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -76.21 -11.83 59.99 Favored 'General case' 0 N--CA 1.451 -0.414 1 CA-C-N 126.722 4.328 . . . . 0.0 112.492 -174.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -82.43 -37.75 25.0 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 169.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 96.6 p -61.82 146.04 91.49 Favored Pre-proline 0 N--CA 1.45 -0.457 0 CA-C-O 113.813 -2.994 . . . . 0.0 115.224 172.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -80.68 -0.62 10.75 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 N-CA-C 119.704 2.925 . . . . 0.0 119.704 -170.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -144.17 143.07 30.92 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 129.616 3.166 . . . . 0.0 110.819 -171.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.9 t -113.76 120.0 39.29 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 113.419 -1.719 . . . . 0.0 114.426 162.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.63 -28.13 40.91 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 119.472 -2.017 . . . . 0.0 113.607 167.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.7 -53.56 45.85 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 116.856 -3.653 . . . . 0.0 114.108 166.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.6 ttp -61.97 -40.85 97.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.789 1.236 . . . . 0.0 111.216 -178.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.58 -54.44 45.9 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -51.15 -44.04 61.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.229 2.611 . . . . 0.0 114.054 166.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -66.7 -41.02 88.7 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 113.317 -3.23 . . . . 0.0 111.951 173.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -67.47 -23.27 65.48 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 122.756 2.525 . . . . 0.0 112.647 168.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 25.1 t60 -71.82 -44.38 64.0 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 119.06 2.985 . . . . 0.0 119.06 177.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -56.15 -26.64 51.16 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 166.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -70.85 -36.9 73.07 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 123.308 2.776 . . . . 0.0 111.302 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -58.92 -42.6 90.09 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 125.944 1.698 . . . . 0.0 114.845 166.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.8 mt -70.3 -8.69 52.34 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 -71.45 -36.74 71.35 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.784 1.633 . . . . 0.0 107.996 177.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.66 -51.24 58.39 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.977 1.711 . . . . 0.0 111.886 174.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 t -57.39 -41.07 77.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 117.952 2.575 . . . . 0.0 117.952 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -61.19 -50.45 73.1 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 118.29 2.7 . . . . 0.0 118.29 161.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.9 tp -58.28 -36.55 73.45 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.115 -1.857 . . . . 0.0 109.589 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 54.2 tp -72.98 -43.93 61.66 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 116.345 -1.788 . . . . 0.0 108.846 -177.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -44.62 -60.8 1.82 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.854 1.262 . . . . 0.0 109.42 167.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -71.32 -19.2 62.34 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -171.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.54 -33.06 62.66 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 117.708 -3.12 . . . . 0.0 111.861 173.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -63.43 -26.07 68.56 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 116.762 -1.59 . . . . 0.0 112.823 170.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -91.38 12.95 18.87 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.128 1.786 . . . . 0.0 111.48 -176.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -137.9 3.16 2.44 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 130.14 3.376 . . . . 0.0 112.695 173.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 61.77 32.12 18.29 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 120.564 -1.335 . . . . 0.0 111.765 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.274 28.6 mt -105.54 -0.78 25.51 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 126.045 1.738 . . . . 0.0 114.306 172.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -58.35 -42.01 85.92 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 114.941 -2.457 . . . . 0.0 116.212 -176.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.292 6.5 mt -66.54 -47.89 56.45 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-N 123.281 2.764 . . . . 0.0 111.618 172.16 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -49.2 -46.63 25.05 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 122.496 2.13 . . . . 0.0 115.616 163.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . 0.265 26.4 tp -68.63 -41.23 79.74 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.986 1.374 . . . . 0.0 110.741 -177.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.8 mt -74.8 -14.36 60.68 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 117.975 -2.953 . . . . 0.0 116.862 175.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . 0.351 3.9 m-80 -72.44 -23.99 61.15 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 117.503 -3.248 . . . . 0.0 112.727 163.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.0 tt -85.7 -52.49 5.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 128.863 2.865 . . . . 0.0 112.808 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.323 83.4 mmm -68.42 -42.84 78.37 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 109.891 -3.322 . . . . 0.0 112.46 -168.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.9 mt -110.4 142.51 42.01 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.939 1.296 . . . . 0.0 109.406 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 p -84.75 151.64 58.48 Favored Pre-proline 0 N--CA 1.447 -0.579 0 C-N-CA 127.888 2.475 . . . . 0.0 113.787 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -58.34 -40.71 73.07 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 CA-C-N 126.351 3.304 . . . . 0.0 116.756 -157.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -65.34 -16.31 63.46 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 116.901 -3.624 . . . . 0.0 113.483 172.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -87.64 -28.66 21.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 119.796 1.18 . . . . 0.0 112.711 169.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 38.0 mtm-85 -75.18 -44.93 43.83 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 124.523 1.139 . . . . 0.0 108.225 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.72 -38.48 69.79 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 116.341 1.978 . . . . 0.0 116.341 167.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.64 -37.95 62.63 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.451 HD22 ' CE2' ' B' ' 22' ' ' PHE . 73.5 mt -62.3 -32.98 73.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 114.796 -2.526 . . . . 0.0 115.058 166.232 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.72 -32.0 68.74 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 123.065 2.666 . . . . 0.0 109.614 168.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.1 m -89.62 -28.42 19.53 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 115.578 -2.449 . . . . 0.0 110.149 -164.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -62.48 -21.23 65.31 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 126.152 2.158 . . . . 0.0 111.244 174.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.81 -49.39 82.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 115.178 -2.344 . . . . 0.0 109.76 169.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -68.33 -24.66 64.86 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 126.272 2.233 . . . . 0.0 116.711 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 55.8 mt -73.26 -47.57 46.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 116.539 -1.696 . . . . 0.0 109.267 168.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 17.1 t -65.12 -20.52 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 122.784 2.538 . . . . 0.0 110.958 171.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -74.73 -49.84 19.62 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 117.982 -2.949 . . . . 0.0 109.64 167.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -79.39 -25.67 42.08 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 120.375 1.443 . . . . 0.0 111.168 -169.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.31 -43.1 98.78 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.081 1.352 . . . . 0.0 111.266 161.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 51.7 tp -76.29 -38.69 55.78 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 123.083 2.674 . . . . 0.0 109.037 -172.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.1 ttm105 -60.34 -31.68 70.54 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 117.254 2.316 . . . . 0.0 117.254 165.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.27 2.36 4.03 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 120.877 3.111 . . . . 0.0 120.877 177.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -85.48 -47.78 9.59 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 129.927 3.291 . . . . 0.0 110.695 -166.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 36.3 ttm -73.65 142.29 46.47 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 126.509 2.38 . . . . 0.0 110.484 167.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.2 p -102.27 170.1 8.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 119.581 3.178 . . . . 0.0 119.581 175.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -58.12 -38.14 75.94 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 113.707 1.002 . . . . 0.0 113.707 -174.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -63.48 -39.84 95.51 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 116.879 2.177 . . . . 0.0 116.879 175.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -70.73 -35.14 72.55 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 127.495 2.318 . . . . 0.0 113.493 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . 0.285 56.0 mt -63.15 -40.94 99.04 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 123.284 1.516 . . . . 0.0 111.795 175.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -63.5 -17.72 63.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 114.049 -2.881 . . . . 0.0 111.251 -175.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -89.63 -64.34 1.15 Allowed 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 120.54 1.518 . . . . 0.0 109.5 158.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -65.98 -21.0 66.38 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 118.472 2.768 . . . . 0.0 118.472 -159.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.5 mt -130.49 7.33 4.89 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.875 1.27 . . . . 0.0 110.77 168.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.33 31.73 80.32 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-O 114.852 -3.193 . . . . 0.0 113.132 173.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -94.21 118.48 31.64 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.084 2.554 . . . . 0.0 110.18 -168.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.09 125.78 38.48 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 128.655 3.026 . . . . 0.0 108.477 172.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 92.3 mt -54.84 -47.08 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 120.3 2.05 . . . . 0.0 112.055 -163.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -50.73 -41.0 55.9 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 122.197 2.271 . . . . 0.0 114.564 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 19.1 p -69.83 -25.89 63.97 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 127.61 2.364 . . . . 0.0 113.719 -174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 25.7 mm -76.5 -40.16 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 165.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.6 m -62.66 -31.36 72.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.695 -2.503 . . . . 0.0 109.21 -173.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -78.81 -40.05 33.97 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 124.878 2.275 . . . . 0.0 111.962 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.61 -26.14 72.87 Favored Glycine 0 N--CA 1.449 -0.491 0 O-C-N 119.653 -1.904 . . . . 0.0 114.393 175.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.5 m -64.45 -48.33 75.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.496 2.318 . . . . 0.0 112.807 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.461 ' HA ' ' HB2' ' A' ' 90' ' ' LYS . 75.2 m-20 -75.49 -21.08 58.35 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 114.711 -2.796 . . . . 0.0 114.514 173.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.3 m -73.69 -28.93 61.99 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 117.601 -3.187 . . . . 0.0 114.571 168.16 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.3 tp -77.52 -27.38 51.72 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 117.631 -3.168 . . . . 0.0 109.138 172.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.461 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 41.3 mttm -69.05 -20.43 64.11 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 112.138 -3.792 . . . . 0.0 108.398 166.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -99.37 -26.9 13.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 125.579 3.809 . . . . 0.0 119.27 177.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.27 140.81 97.75 Favored Pre-proline 0 N--CA 1.449 -0.481 0 O-C-N 125.685 1.866 . . . . 0.0 108.56 168.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -83.83 158.42 13.89 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 121.537 1.491 . . . . 0.0 111.974 -165.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.6 m -61.11 -35.08 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 114.572 -2.632 . . . . 0.0 112.887 178.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.446 24.2 pm0 -53.05 -33.7 53.12 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 122.409 2.368 . . . . 0.0 116.378 163.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 15.6 tp -81.69 -51.12 8.52 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.908 -2.995 . . . . 0.0 108.453 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.3 mtm180 -60.35 -49.67 76.67 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.385 1.564 . . . . 0.0 112.933 -173.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.03 -17.8 64.93 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 126.288 2.947 . . . . 0.0 114.05 -177.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -91.44 -27.64 18.16 Favored 'General case' 0 N--CA 1.447 -0.602 1 O-C-N 114.885 -4.884 . . . . 0.0 110.366 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.5 mt -68.65 -18.01 64.21 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 118.11 2.633 . . . . 0.0 118.11 161.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -67.06 -28.04 67.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 120.36 1.437 . . . . 0.0 111.676 176.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -82.82 -4.51 58.13 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 118.757 -1.177 . . . . 0.0 113.99 -176.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 42.5 t -114.0 -47.71 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 124.443 1.097 . . . . 0.0 113.25 -173.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.5 mt -97.42 -23.67 15.97 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.319 1.048 . . . . 0.0 111.611 -172.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 14.5 mt -112.59 -25.57 9.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.1 tttp -65.12 -24.79 67.52 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 122.245 2.293 . . . . 0.0 114.435 -165.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 71.2 p -110.31 6.76 22.69 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 119.893 3.294 . . . . 0.0 119.893 -160.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 . . . . . 0 C--O 1.253 1.252 0 CA-C-N 112.341 -2.209 . . . . 0.0 114.354 -167.937 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 116.914 -1.517 . . . . 0.0 113.031 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.04 -25.86 68.3 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 122.501 2.41 . . . . 0.0 112.604 -162.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -84.1 -29.47 26.76 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.051 0.841 . . . . 0.0 111.188 -172.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -78.68 -31.75 46.77 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 116.064 1.875 . . . . 0.0 116.064 170.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 19.8 m -81.59 143.57 51.27 Favored Pre-proline 0 N--CA 1.449 -0.513 0 C-N-CA 125.967 1.707 . . . . 0.0 112.06 -170.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -62.3 -32.81 81.82 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.711 2.274 . . . . 0.0 112.353 172.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -134.33 151.73 51.4 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 125.923 2.773 . . . . 0.0 118.174 173.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 20.4 t -143.1 121.47 12.34 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 118.34 -2.725 . . . . 0.0 109.054 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.77 -14.15 60.67 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.052 -1.655 . . . . 0.0 110.445 174.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.8 -36.36 25.67 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 116.767 2.136 . . . . 0.0 116.767 176.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 27.4 mtt -67.99 -36.1 79.43 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 122.228 2.285 . . . . 0.0 114.216 165.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.08 -49.37 60.8 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 118.216 2.673 . . . . 0.0 118.216 167.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 tp10 -57.48 -42.18 82.13 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 112.719 -2.037 . . . . 0.0 113.968 168.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -63.39 -42.49 98.8 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 112.657 -3.544 . . . . 0.0 112.028 176.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -69.88 -34.76 73.99 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.673 2.483 . . . . 0.0 114.405 174.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -60.61 -36.61 79.0 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.039 1.745 . . . . 0.0 110.998 170.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -83.85 -31.16 25.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 126.2 1.8 . . . . 0.0 109.635 -174.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -72.92 -34.22 66.46 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 115.491 -2.195 . . . . 0.0 107.902 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -67.34 -25.81 66.18 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 122.329 2.331 . . . . 0.0 112.975 167.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 49.7 mt -65.18 -23.04 66.99 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 123.212 2.733 . . . . 0.0 115.095 176.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -72.49 -20.86 61.3 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.119 1.767 . . . . 0.0 113.208 174.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' PHE . . . . . 0.451 ' CE2' HD22 ' A' ' 51' ' ' LEU . 84.7 t80 -71.61 -47.87 51.76 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 117.571 -1.205 . . . . 0.0 112.11 168.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 33.8 t -61.96 -41.57 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 C-N-CA 126.439 1.896 . . . . 0.0 113.908 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -68.28 -45.18 73.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 173.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 37.2 tp -61.88 -42.28 98.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 -174.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 25.9 tp -76.21 -31.4 58.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.749 2.02 . . . . 0.0 108.628 -177.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -50.41 -42.72 54.22 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 123.406 2.821 . . . . 0.0 112.767 168.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -89.38 -9.42 50.4 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 127.452 2.97 . . . . 0.0 115.102 -177.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.59 -42.85 21.54 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.826 2.05 . . . . 0.0 110.261 178.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -63.36 -34.94 78.8 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 118.041 -2.912 . . . . 0.0 107.262 170.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -75.77 4.36 8.09 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 118.846 -2.409 . . . . 0.0 116.305 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -128.91 -1.03 5.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 113.889 -1.505 . . . . 0.0 110.235 168.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.417 46.5 m-20 64.7 23.04 12.71 Favored 'General case' 0 N--CA 1.447 -0.582 2 O-C-N 115.117 -4.739 . . . . 0.0 116.749 -168.33 . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.278 83.4 mt -99.02 5.48 47.08 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.063 1.745 . . . . 0.0 111.793 174.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 14.3 p-80 -58.14 -54.31 48.36 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.797 1.239 . . . . 0.0 113.435 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 28.0 mt -62.88 -47.82 86.29 Favored Pre-proline 0 N--CA 1.448 -0.526 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.67 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -60.02 -24.03 75.17 Favored 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 124.497 3.465 . . . . 0.0 116.057 171.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . 0.329 43.2 tp -76.03 -52.07 10.97 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 125.594 1.809 . . . . 0.0 114.779 169.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . 0.307 17.3 mt -53.28 -49.69 66.42 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 124.925 1.391 . . . . 0.0 110.833 174.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -64.64 -17.77 64.34 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 119.898 -1.751 . . . . 0.0 112.831 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 12.0 tp -93.67 -30.28 15.0 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 9.0 mmt -84.05 -26.13 29.31 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 5.0 mt -126.75 134.38 50.65 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 126.288 1.835 . . . . 0.0 111.688 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 81.5 p -85.17 160.3 54.99 Favored Pre-proline 0 N--CA 1.45 -0.434 0 C-N-CA 126.006 1.723 . . . . 0.0 107.758 176.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -52.11 -30.66 41.78 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 N-CA-C 121.111 3.466 . . . . 0.0 121.111 -172.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.62 -32.66 64.17 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 124.579 1.174 . . . . 0.0 110.788 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.33 -32.7 62.92 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.567 1.947 . . . . 0.0 109.339 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 -70.6 -45.04 66.03 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 127.663 2.385 . . . . 0.0 110.102 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -63.98 -38.36 90.79 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.6 1.56 . . . . 0.0 114.014 168.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.31 -53.56 56.9 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 120.632 1.56 . . . . 0.0 112.879 167.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 27.4 mt -52.22 -38.87 59.24 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 114.631 -2.604 . . . . 0.0 117.33 175.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.75 -56.65 24.11 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 127.679 2.561 . . . . 0.0 111.768 166.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 13.6 m -74.67 -22.82 58.68 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 124.419 2.057 . . . . 0.0 113.927 -169.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 58.8 mtt180 -58.38 -37.14 74.64 Favored 'General case' 0 N--CA 1.449 -0.486 1 O-C-N 114.887 -4.883 . . . . 0.0 113.352 169.09 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 97.9 t -68.91 -36.81 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 124.057 0.943 . . . . 0.0 109.757 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -75.72 -33.3 60.29 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.038 -1.039 . . . . 0.0 110.304 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 54.0 mt -69.62 -47.14 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 120.401 1.455 . . . . 0.0 110.611 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.258 59.5 t -74.86 -21.01 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 O-C-N 124.479 1.112 . . . . 0.0 113.527 177.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -72.44 -38.53 68.29 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 119.286 -2.134 . . . . 0.0 113.01 175.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -61.71 -30.62 70.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.562 1.145 . . . . 0.0 109.127 171.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 1.1 mt -78.49 -26.19 45.93 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 117.893 -3.004 . . . . 0.0 111.153 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 89.4 mt -83.93 -19.92 33.86 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 119.606 3.188 . . . . 0.0 119.606 166.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 23.5 ttm105 -89.53 -71.75 0.59 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 115.976 -1.964 . . . . 0.0 111.022 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.59 75.11 1.22 Allowed Glycine 0 C--N 1.335 0.478 0 C-N-CA 125.928 1.728 . . . . 0.0 109.68 -171.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -140.5 9.62 2.24 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 121.04 2.42 . . . . 0.0 112.338 173.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 22.1 mtt -119.02 143.77 46.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 116.368 -3.957 . . . . 0.0 114.266 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 26.7 p -77.61 162.25 27.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 130.71 3.604 . . . . 0.0 112.739 164.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . 0.258 45.4 mt-30 -67.08 -33.5 75.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 -171.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -58.86 -45.31 90.45 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 160.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -59.71 -36.9 77.46 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 121.075 1.761 . . . . 0.0 112.53 171.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.417 HD23 HD12 ' B' ' 75' ' ' LEU . 90.9 mt -63.49 -33.04 74.7 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.458 175.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -84.72 -31.5 24.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.91 2.084 . . . . 0.0 112.956 -177.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -130.54 -19.69 3.01 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 117.61 -3.181 . . . . 0.0 114.422 -167.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -87.17 -13.37 44.2 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 160.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.417 HD12 HD23 ' B' ' 71' ' ' LEU . 96.6 mt -132.56 -43.74 0.91 Allowed 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.671 -3.143 . . . . 0.0 114.848 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 98.69 4.04 57.09 Favored Glycine 0 CA--C 1.522 0.476 0 CA-C-O 124.136 1.964 . . . . 0.0 110.257 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.72 80.02 6.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 117.218 -3.519 . . . . 0.0 113.066 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.42 -179.33 5.22 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-O 126.593 3.33 . . . . 0.0 110.97 159.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 45.5 mt -61.68 -40.5 86.98 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 O-C-N 117.354 -3.439 . . . . 0.0 112.407 -168.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.26 87.77 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 120.667 -1.271 . . . . 0.0 114.208 171.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 21.6 m -66.43 -34.83 78.83 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.927 1.291 . . . . 0.0 114.121 -178.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mm -81.36 -41.01 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 115.278 -2.296 . . . . 0.0 106.731 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 4.7 m -64.25 -47.54 79.24 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 131.256 3.823 . . . . 0.0 113.055 174.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 19.4 ttt180 -57.59 -51.09 70.89 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 117.237 -1.785 . . . . 0.0 114.691 167.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -45.63 -44.87 12.33 Favored Glycine 0 C--N 1.334 0.471 0 CA-C-O 115.508 -2.829 . . . . 0.0 114.94 173.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 4.3 p -77.86 -36.93 49.3 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 126.542 1.966 . . . . 0.0 112.37 -176.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -62.63 -37.57 86.83 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 106.552 -1.648 . . . . 0.0 106.552 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 68.5 m -67.31 -29.03 68.5 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 126.934 3.254 . . . . 0.0 114.712 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 70.6 mt -77.7 -38.44 47.38 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 117.706 -3.121 . . . . 0.0 116.377 173.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 52.6 tttm -64.48 -41.76 96.28 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.309 1.444 . . . . 0.0 108.801 168.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.15 -23.08 62.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 118.591 -2.568 . . . . 0.0 113.474 177.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.41 147.56 98.56 Favored Pre-proline 0 N--CA 1.448 -0.575 0 CA-C-N 121.6 2.0 . . . . 0.0 113.474 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -72.03 162.11 42.79 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 123.989 3.126 . . . . 0.0 113.315 167.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 28.0 m -82.86 -16.31 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 1 O-C-N 115.586 -4.446 . . . . 0.0 117.274 -170.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -65.24 -8.15 16.28 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.779 1.632 . . . . 0.0 114.23 163.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 31.7 tp -112.66 -52.14 2.8 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 104.457 -2.423 . . . . 0.0 104.457 -177.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . 0.275 17.8 mtp180 -58.16 -37.29 74.41 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 124.437 1.086 . . . . 0.0 112.42 -175.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -79.41 -33.91 42.24 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 127.281 2.233 . . . . 0.0 112.822 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 81.3 t90 -71.59 -39.39 70.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 121.284 -0.885 . . . . 0.0 112.359 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 86.8 mt -63.3 -30.34 71.49 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.659 170.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -54.73 -40.75 69.59 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 119.192 3.034 . . . . 0.0 119.192 169.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -97.09 -1.61 44.91 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.521 1.528 . . . . 0.0 113.797 -170.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 25.8 t -113.59 -36.9 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 O-C-N 118.226 -2.797 . . . . 0.0 109.174 176.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 55.7 mt -84.26 -75.71 0.33 Allowed 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 119.979 -1.701 . . . . 0.0 107.18 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 20.9 mt -47.73 -41.1 22.17 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 -165.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.01 3.32 4.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 115.048 -2.406 . . . . 0.0 113.674 178.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 56.4 m -94.92 9.12 40.5 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 115.213 1.561 . . . . 0.0 115.213 166.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 . . . . . 0 C--O 1.251 1.146 0 O-C-N 117.709 -3.12 . . . . 0.0 115.433 164.584 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 22.6 ttt . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.66 172.58 10.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 118.097 2.629 . . . . 0.0 118.097 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -89.67 152.27 21.45 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 66.3 tt0 -130.66 141.13 50.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 120.623 1.556 . . . . 0.0 113.464 155.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 7.9 p -124.74 148.73 60.23 Favored Pre-proline 0 N--CA 1.448 -0.53 0 O-C-N 120.076 -1.64 . . . . 0.0 114.567 -173.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -67.18 -19.8 50.35 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.259 1.973 . . . . 0.0 115.848 169.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -156.02 148.48 23.72 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 128.546 2.738 . . . . 0.0 111.36 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.8 t -147.81 127.72 13.56 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 125.301 1.626 . . . . 0.0 113.021 174.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.78 62.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 126.953 2.658 . . . . 0.0 110.807 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.53 -22.48 63.57 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 129.368 3.067 . . . . 0.0 114.034 167.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 23.0 mtt -81.57 -44.3 17.48 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 118.123 -2.861 . . . . 0.0 113.202 164.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.55 69.18 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 118.998 2.962 . . . . 0.0 118.998 177.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -76.62 -38.67 54.33 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 113.808 -1.542 . . . . 0.0 113.213 168.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -56.54 -43.41 79.86 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.909 -2.369 . . . . 0.0 113.9 170.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -47.74 83.86 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 130.107 3.363 . . . . 0.0 113.538 168.181 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -45.78 -49.36 15.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 162.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -69.9 -33.98 72.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 176.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.22 -27.7 67.45 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 115.955 -2.298 . . . . 0.0 113.462 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -73.13 -52.75 13.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 126.671 1.988 . . . . 0.0 112.869 169.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . 0.272 1.0 OUTLIER -62.03 -18.91 62.11 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 115.551 -2.166 . . . . 0.0 110.085 178.598 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -81.55 -44.23 17.61 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 114.935 -2.46 . . . . 0.0 112.644 176.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -48.89 -38.84 23.78 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 118.629 2.826 . . . . 0.0 118.629 171.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 43.7 t -75.04 -34.65 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 C-N-CA 127.526 2.33 . . . . 0.0 113.673 177.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -74.86 -39.54 61.5 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 122.662 2.483 . . . . 0.0 115.908 172.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 37.4 tp -55.59 -34.18 64.61 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 117.631 -3.168 . . . . 0.0 114.661 169.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . 0.283 30.5 tp -71.72 -32.52 67.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.52 1.928 . . . . 0.0 113.166 170.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -69.15 -34.3 74.76 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 125.603 1.814 . . . . 0.0 111.911 172.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 30.1 m-20 -73.17 -38.17 66.27 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 116.448 -3.907 . . . . 0.0 109.627 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.4 -32.64 65.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.723 2.809 . . . . 0.0 118.171 176.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -68.11 -18.25 64.59 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.642 1.977 . . . . 0.0 115.341 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -76.08 -23.32 55.0 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -174.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 19.5 p-10 -141.06 39.08 1.78 Allowed 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 127.417 2.287 . . . . 0.0 112.432 -166.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.345 0.8 OUTLIER 31.86 46.86 0.06 Allowed 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 118.405 2.743 . . . . 0.0 118.405 -176.073 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 27.3 mt -99.3 -2.49 36.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.619 2.081 . . . . 0.0 116.619 163.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 -58.28 -49.73 76.11 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 126.726 3.155 . . . . 0.0 110.875 -174.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 18.6 mt -74.03 -41.1 5.16 Favored Pre-proline 0 N--CA 1.447 -0.604 0 O-C-N 116.325 -3.985 . . . . 0.0 110.633 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -56.93 -39.87 88.25 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 124.26 3.306 . . . . 0.0 108.536 170.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 54.7 tp -77.96 -29.14 49.68 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 117.554 2.428 . . . . 0.0 117.554 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 51.5 mt -67.03 -23.31 65.89 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 117.254 -1.355 . . . . 0.0 113.758 161.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -91.31 -25.12 19.59 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 118.773 -1.171 . . . . 0.0 111.605 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.32 -54.34 46.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 119.029 -2.294 . . . . 0.0 112.038 159.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 21.5 mmt -72.05 -36.92 69.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 119.169 3.025 . . . . 0.0 119.169 -171.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.2 mp -105.66 144.21 32.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 117.837 2.532 . . . . 0.0 117.837 -175.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 67.0 p -78.38 161.7 69.02 Favored Pre-proline 0 N--CA 1.448 -0.527 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 166.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -47.8 -43.31 29.39 Favored 'Trans proline' 0 N--CA 1.447 -1.255 0 C-N-CA 124.81 3.673 . . . . 0.0 112.725 166.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -58.0 -42.49 85.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 172.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -68.6 -35.43 77.33 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 127.296 3.427 . . . . 0.0 114.239 -174.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 39.5 mtm-85 -73.52 -37.64 65.58 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 118.901 -2.374 . . . . 0.0 111.735 172.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -66.04 -36.59 83.64 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 125.444 1.715 . . . . 0.0 114.818 170.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.08 96.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 128.998 2.919 . . . . 0.0 107.975 177.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 57.4 mt -84.86 -31.73 23.61 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 117.19 -3.444 . . . . 0.0 111.969 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.52 -37.85 50.38 Favored Glycine 0 CA--C 1.526 0.725 0 O-C-N 126.768 2.542 . . . . 0.0 115.049 158.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 25.8 m -77.49 -40.11 44.08 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 33.5 mtt180 -72.99 -24.95 60.83 Favored 'General case' 0 N--CA 1.448 -0.525 1 CA-C-O 110.55 -4.548 . . . . 0.0 113.405 -173.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 80.3 t -62.54 -41.93 93.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 122.623 2.465 . . . . 0.0 111.991 163.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -76.06 -29.58 58.05 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 118.574 2.805 . . . . 0.0 118.574 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 63.5 mt -59.14 -42.1 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 O-C-N 118.805 -2.434 . . . . 0.0 111.942 166.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 66.8 t -59.41 -49.26 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 C-N-CA 126.176 1.791 . . . . 0.0 111.591 174.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -64.51 -38.5 91.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 113.172 -1.831 . . . . 0.0 110.585 -172.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -73.08 -33.7 65.77 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 117.391 -3.318 . . . . 0.0 114.93 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 87.1 mt -76.36 -13.57 60.13 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 169.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 55.7 mt -93.07 -15.92 25.56 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 120.738 1.608 . . . . 0.0 108.759 170.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -94.41 -34.91 12.57 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 120.51 1.505 . . . . 0.0 113.121 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.71 3.9 74.48 Favored Glycine 0 C--N 1.339 0.739 1 CA-C-O 110.552 -5.582 . . . . 0.0 113.827 165.722 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -93.24 58.36 2.85 Favored 'General case' 0 N--CA 1.444 -0.758 1 CA-C-N 124.327 4.064 . . . . 0.0 112.365 -154.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 20.3 mtt -147.16 144.4 28.95 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 125.073 1.483 . . . . 0.0 111.62 -167.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . 0.275 83.0 p -64.83 162.2 16.69 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 158.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -52.21 -41.74 62.95 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 129.44 3.096 . . . . 0.0 112.952 166.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 34.0 ttp-105 -53.2 -62.98 1.3 Allowed 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 128.644 3.715 . . . . 0.0 110.022 170.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -51.84 -51.82 53.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 123.931 0.77 . . . . 0.0 113.034 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 53.7 mt -50.94 -48.46 60.86 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 121.417 1.917 . . . . 0.0 114.278 174.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 54.5 tttt -62.31 -46.78 87.2 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 121.465 1.939 . . . . 0.0 106.536 -171.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -77.18 -35.45 55.82 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 115.784 -2.055 . . . . 0.0 116.535 -177.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -79.67 -36.95 36.91 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 118.155 2.65 . . . . 0.0 118.155 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.252 7.3 mp -94.39 -27.81 15.86 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 126.011 2.07 . . . . 0.0 110.728 -176.425 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.18 -149.33 49.94 Favored Glycine 0 CA--C 1.523 0.581 0 O-C-N 119.946 -1.721 . . . . 0.0 113.134 -175.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -52.82 -23.06 6.19 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 116.062 1.875 . . . . 0.0 116.062 163.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.28 -7.61 84.96 Favored Glycine 0 C--N 1.337 0.595 0 CA-C-O 114.855 -3.192 . . . . 0.0 112.794 -169.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 7.4 tt -59.05 -44.15 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 1 CA-C-O 111.512 -4.089 . . . . 0.0 113.155 167.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.53 -22.66 60.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 124.682 3.401 . . . . 0.0 113.871 172.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 8.5 m -64.66 -39.14 93.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.882 1.273 . . . . 0.0 107.665 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 36.8 mm -83.11 -33.73 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 119.327 -2.108 . . . . 0.0 114.384 170.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.6 p -105.06 9.56 34.31 Favored 'General case' 0 N--CA 1.449 -0.482 1 N-CA-C 122.846 4.387 . . . . 0.0 122.846 -164.152 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 20.7 mtp85 -128.14 145.56 50.98 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 118.032 -2.917 . . . . 0.0 113.086 -178.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 96.01 166.95 34.46 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 67.3 m -65.29 -30.97 71.88 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -171.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -98.79 6.48 46.87 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -173.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 51.6 p -55.86 158.67 3.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 130.946 3.699 . . . . 0.0 114.627 165.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 48.9 tp -61.81 -32.57 72.89 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 129.664 3.186 . . . . 0.0 111.066 -151.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.25 87.1 mttt -98.59 12.39 35.43 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 120.006 3.336 . . . . 0.0 120.006 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -136.19 -11.45 1.93 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 130.457 3.503 . . . . 0.0 115.217 -179.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.5 161.38 0.33 Allowed Pre-proline 0 N--CA 1.45 -0.47 0 C-N-CA 129.815 3.246 . . . . 0.0 113.14 166.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -49.66 138.61 32.4 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 123.745 2.964 . . . . 0.0 113.46 162.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 87.5 t -61.89 -31.7 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 128.841 2.856 . . . . 0.0 110.021 -177.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 12.7 pm0 -67.44 -34.6 77.54 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 116.853 -3.654 . . . . 0.0 114.288 -176.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 9.2 tp -73.0 -42.91 62.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.689 1.996 . . . . 0.0 110.1 174.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 70.0 mtp180 -61.53 -49.43 76.72 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 125.654 1.846 . . . . 0.0 112.082 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -73.51 -37.69 65.6 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 127.406 2.282 . . . . 0.0 109.289 -176.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.1 t90 -51.6 -56.9 10.93 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 163.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 100' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' C' ' 100' ' ' LEU . 55.6 mt -65.75 -17.51 64.67 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 120.107 -1.621 . . . . 0.0 111.975 -174.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -88.98 -25.95 21.75 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 122.819 2.554 . . . . 0.0 114.954 166.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.46 -12.89 61.28 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 169.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.16 -48.7 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 C-N-CA 127.005 2.122 . . . . 0.0 113.659 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 96.1 mt -85.12 -31.02 23.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 121.888 2.131 . . . . 0.0 112.635 -169.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.1 27.74 8.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 121.034 1.743 . . . . 0.0 113.695 -168.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 106' ' ' LYS . . . . . 0.52 ' HG3' ' H ' ' C' ' 108' ' ' ASP . 14.8 pttp -83.57 160.45 21.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.214 -1.374 . . . . 0.0 113.049 -169.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 66.9 m -111.75 47.73 1.01 Allowed 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.697 170.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 108' ' ' ASP . . . . . 0.52 ' H ' ' HG3' ' C' ' 106' ' ' LYS . 18.3 t0 . . . . . 0 C--O 1.249 1.036 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 170.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 11.4 ttt . . . . . 0 N--CA 1.473 0.683 0 CA-C-O 116.032 -1.937 . . . . 0.0 111.955 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.82 127.37 4.07 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 -173.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -85.37 150.05 25.01 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -168.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -124.27 144.45 49.97 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 112.771 -2.013 . . . . 0.0 110.167 176.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 53.6 p -129.97 149.43 73.1 Favored Pre-proline 0 N--CA 1.445 -0.697 0 CA-C-O 117.718 -1.134 . . . . 0.0 110.767 175.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . 0.275 15.7 Cg_exo -68.01 -24.25 39.46 Favored 'Trans proline' 0 N--CA 1.451 -0.992 1 C-N-CA 125.851 4.367 . . . . 0.0 114.147 177.171 . . . . . . . . 3 2 . 1 . 008 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -149.75 145.32 26.58 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-O 113.449 -3.167 . . . . 0.0 109.362 169.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 1.9 t -79.8 130.39 35.28 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 127.424 2.952 . . . . 0.0 108.112 173.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.37 -40.58 59.5 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 128.011 3.319 . . . . 0.0 110.905 162.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.03 -36.06 77.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 115.938 1.829 . . . . 0.0 115.938 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.269 14.0 mmt -62.05 -39.79 93.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.718 -1.134 . . . . 0.0 109.746 165.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.21 -20.46 62.81 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 122.371 2.35 . . . . 0.0 116.504 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -88.6 -44.6 10.52 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 119.152 -2.218 . . . . 0.0 107.381 171.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -62.0 -44.0 97.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.045 -1.659 . . . . 0.0 110.703 -172.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -27.97 69.78 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.27 1.952 . . . . 0.0 116.27 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -74.65 -34.21 62.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.107 1.763 . . . . 0.0 109.2 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -81.73 -23.11 36.91 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 118.003 -2.936 . . . . 0.0 112.123 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . 0.253 59.4 mt-10 -70.39 -26.03 63.52 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 117.836 -3.04 . . . . 0.0 111.848 161.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 5.9 t-105 -82.04 -35.89 28.31 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 117.019 -1.467 . . . . 0.0 113.44 174.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.49 -25.99 68.51 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 117.0 -1.476 . . . . 0.0 110.336 173.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -73.55 -20.77 60.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 130.58 3.552 . . . . 0.0 107.949 177.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -97.52 -24.66 15.47 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 120.965 1.711 . . . . 0.0 113.014 167.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 79.6 t -65.14 -41.65 92.3 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 O-C-N 117.936 -2.977 . . . . 0.0 110.252 169.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -65.95 -40.62 91.51 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 121.945 2.157 . . . . 0.0 115.351 171.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 16.3 tp -57.76 -43.84 85.74 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 120.095 -1.628 . . . . 0.0 111.274 174.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 23.8 tp -60.02 -45.75 91.76 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 ttpp -56.05 -45.0 79.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 126.564 3.078 . . . . 0.0 110.809 176.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -69.9 -15.67 63.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 112.139 -2.3 . . . . 0.0 114.574 174.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 29' ' ' ALA . . . . . 0.44 ' HB1' ' HA ' ' D' ' 35' ' ' HIS . . . -83.03 -34.87 26.17 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 127.911 2.484 . . . . 0.0 117.404 167.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -62.84 -33.45 75.28 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 121.049 -1.032 . . . . 0.0 111.416 170.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -73.8 -25.98 60.4 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 129.595 3.158 . . . . 0.0 115.489 -171.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.9 p30 -116.79 1.35 12.73 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.907 1.379 . . . . 0.0 112.788 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 70.01 29.01 4.0 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 129.825 3.25 . . . . 0.0 115.019 -178.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 61.3 mt -99.29 10.31 41.66 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 119.979 -1.701 . . . . 0.0 109.896 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 35' ' ' HIS . . . . . 0.44 ' HA ' ' HB1' ' D' ' 29' ' ' ALA . 0.0 OUTLIER -54.91 -57.95 9.55 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 3.1 mt -64.95 -36.93 17.93 Favored Pre-proline 0 N--CA 1.449 -0.509 0 O-C-N 121.221 -0.925 . . . . 0.0 110.786 -172.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.81 -40.25 65.18 Favored 'Trans proline' 0 N--CA 1.447 -1.221 0 N-CA-C 119.207 2.734 . . . . 0.0 119.207 162.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 16.5 tp -68.41 -43.07 78.02 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 117.073 -3.517 . . . . 0.0 112.096 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 77.1 mt -57.52 -48.38 79.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 126.515 2.384 . . . . 0.0 110.137 171.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -78.96 -29.24 43.8 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 117.439 -3.288 . . . . 0.0 108.734 -166.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.38 -54.8 41.24 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.181 0.992 . . . . 0.0 109.348 161.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 5.1 mmt -57.53 -49.16 77.24 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 114.424 -2.703 . . . . 0.0 114.624 -177.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 23.0 mt -111.09 133.03 53.78 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.464 1.906 . . . . 0.0 114.212 -164.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 76.5 p -68.1 151.0 97.53 Favored Pre-proline 0 N--CA 1.448 -0.543 0 O-C-N 126.061 2.101 . . . . 0.0 112.016 173.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -46.46 -43.82 21.64 Favored 'Trans proline' 0 N--CA 1.447 -1.215 1 C-N-CA 129.252 6.634 . . . . 0.0 114.904 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.89 -24.07 62.42 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 174.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -73.46 -25.3 60.43 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 114.187 -2.816 . . . . 0.0 112.986 166.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 26.0 mtm180 -89.31 -26.58 21.04 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 125.072 3.578 . . . . 0.0 111.743 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -51.78 -48.89 63.58 Favored 'General case' 0 N--CA 1.45 -0.455 1 C-N-CA 132.703 4.401 . . . . 0.0 111.761 159.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.3 -38.39 35.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 126.552 2.407 . . . . 0.0 115.272 -179.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.18 -34.74 78.29 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 118.214 2.672 . . . . 0.0 118.214 165.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.34 -41.62 99.74 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-O 117.665 -1.631 . . . . 0.0 115.86 166.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 52.1 m -59.58 -46.8 87.86 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 123.658 1.694 . . . . 0.0 110.016 168.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -59.16 -31.94 69.44 Favored 'General case' 0 N--CA 1.45 -0.453 2 O-C-N 114.297 -5.252 . . . . 0.0 111.011 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 99.0 t -57.37 -57.5 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 CA-C-N 122.116 2.234 . . . . 0.0 110.38 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -68.94 -27.24 65.56 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 115.63 -2.128 . . . . 0.0 114.451 176.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 79.6 mt -54.26 -66.14 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-N 121.27 1.85 . . . . 0.0 106.803 167.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 61.2 t -42.87 -51.01 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 O-C-N 120.818 -1.176 . . . . 0.0 113.765 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.36 -48.75 76.19 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 60' ' ' GLU . . . . . 0.43 ' HA ' ' HB3' ' D' ' 63' ' ' ARG . 29.3 mm-40 -68.35 -22.51 64.67 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 117.474 -1.251 . . . . 0.0 113.505 177.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 31.8 mt -77.33 -3.13 38.41 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 125.397 2.522 . . . . 0.0 116.96 174.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 77.6 mt -104.01 -28.63 11.42 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.573 1.949 . . . . 0.0 111.946 168.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 63' ' ' ARG . . . . . 0.43 ' HB3' ' HA ' ' D' ' 60' ' ' GLU . 39.4 ttm105 -77.49 -51.11 11.29 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.882 -3.011 . . . . 0.0 113.313 175.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.37 41.51 91.0 Favored Glycine 0 C--N 1.337 0.637 0 CA-C-O 116.173 -2.46 . . . . 0.0 111.362 163.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -115.95 -42.07 3.12 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 121.342 2.571 . . . . 0.0 108.212 -174.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 15.0 mmt -77.73 61.37 2.4 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 113.584 -1.644 . . . . 0.0 111.67 159.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 75.2 p -93.42 -176.49 4.13 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.192 1.397 . . . . 0.0 114.032 -173.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.371 2.8 tp-100 69.22 -109.0 0.08 Allowed 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 119.193 -2.192 . . . . 0.0 114.903 165.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -73.88 -37.29 64.78 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 116.545 -1.693 . . . . 0.0 110.477 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -69.84 -45.1 68.54 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 130.477 3.511 . . . . 0.0 113.631 -169.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.03 -18.03 59.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 113.824 -2.989 . . . . 0.0 111.377 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -106.25 -12.27 15.77 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 123.07 2.668 . . . . 0.0 116.318 174.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -119.76 -15.62 8.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 118.885 2.92 . . . . 0.0 118.885 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -124.59 -17.9 5.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 123.123 2.692 . . . . 0.0 112.204 172.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 75' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' D' ' 75' ' ' LEU . 4.4 mm? -84.99 -52.9 5.65 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.604 -1.665 . . . . 0.0 111.652 161.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 109.19 -167.14 12.81 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 119.257 -1.449 . . . . 0.0 112.206 146.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.09 -34.79 63.94 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -173.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -38.16 -24.14 0.02 OUTLIER Glycine 0 CA--C 1.523 0.548 0 CA-C-O 117.023 -1.987 . . . . 0.0 114.966 165.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 19.8 tt -60.64 -25.77 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 120.373 2.086 . . . . 0.0 112.847 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.85 -33.54 34.43 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 117.293 -1.337 . . . . 0.0 109.03 -176.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 33.9 m -70.57 -20.24 62.8 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 122.159 2.254 . . . . 0.0 109.929 170.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 25.1 mm -95.49 -30.64 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -173.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 7.1 p -105.19 -26.01 12.23 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 114.495 -2.669 . . . . 0.0 113.883 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.275 22.9 mtp85 -82.6 168.77 16.99 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 125.376 3.716 . . . . 0.0 112.493 167.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.92 154.24 29.37 Favored Glycine 0 C--N 1.337 0.618 0 CA-C-O 122.952 1.306 . . . . 0.0 114.617 177.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 92.5 p -74.17 -16.66 60.98 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.974 -1.113 . . . . 0.0 111.448 -147.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -135.3 64.48 1.58 Allowed 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 125.612 2.625 . . . . 0.0 107.735 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 24.8 p -97.62 -169.4 1.83 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 127.106 2.163 . . . . 0.0 112.389 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.21 -21.39 56.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 119.25 -2.156 . . . . 0.0 111.479 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 19.6 tttt -84.96 0.07 52.55 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.953 2.901 . . . . 0.0 109.748 174.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.45 -34.43 6.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 120.28 -1.513 . . . . 0.0 110.854 175.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 53.1 76.52 0.52 Allowed Pre-proline 0 N--CA 1.449 -0.519 0 CA-C-N 122.794 2.543 . . . . 0.0 111.389 164.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.283 98.5 Cg_exo 17.2 40.53 0.0 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.002 0 N-CA-C 116.941 1.862 . . . . 0.0 116.941 53.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 72.8 t -43.61 -26.33 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 128.564 2.746 . . . . 0.0 115.897 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.49 -30.29 8.01 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.695 1.998 . . . . 0.0 110.337 -160.165 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 24.2 tp -57.5 -46.4 83.81 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.744 -2.472 . . . . 0.0 111.223 147.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -60.38 -43.82 96.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 115.742 1.756 . . . . 0.0 115.742 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -62.62 -36.58 83.22 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.116 2.167 . . . . 0.0 113.616 166.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 80.6 t90 -65.45 -44.42 87.34 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 118.351 -2.718 . . . . 0.0 110.137 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 100' ' ' LEU . . . . . 0.4 ' HB3' HD12 ' D' ' 104' ' ' LEU . 47.2 mt -60.69 -36.3 78.45 Favored 'General case' 0 N--CA 1.446 -0.663 1 O-C-N 116.103 -4.123 . . . . 0.0 109.744 179.023 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -57.41 -29.26 63.97 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -101.74 -22.14 14.47 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 129.712 3.205 . . . . 0.0 110.79 -173.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 50.6 t -86.69 -38.53 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-O 123.78 1.752 . . . . 0.0 111.761 175.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 104' ' ' LEU . . . . . 0.4 HD12 ' HB3' ' D' ' 100' ' ' LEU 0.294 15.3 mt -96.58 -28.73 14.23 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 114.002 -2.904 . . . . 0.0 116.062 -175.479 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 12.3 mt -102.05 34.71 2.6 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.754 1.615 . . . . 0.0 107.883 172.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . 0.313 17.6 pttp -62.15 165.69 5.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.828 178.106 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.37 -42.48 15.05 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.668 3.587 . . . . 0.0 113.232 -177.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.249 1.032 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 176.756 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.11 -53.81 22.69 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 119.923 -1.736 . . . . 0.0 113.414 -158.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . 0.251 25.3 tt0 -60.97 -20.04 61.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.834 -3.041 . . . . 0.0 113.697 178.042 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -78.21 -15.97 58.3 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 127.794 2.438 . . . . 0.0 114.571 171.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.432 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 27.7 p -90.78 151.51 43.75 Favored Pre-proline 0 N--CA 1.45 -0.436 0 C-N-CA 125.746 1.618 . . . . 0.0 113.086 -172.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 5' ' ' SER . 53.1 Cg_exo -85.05 14.61 2.43 Favored 'Trans proline' 0 N--CA 1.448 -1.153 0 N-CA-C 118.982 2.647 . . . . 0.0 118.982 167.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -161.95 156.3 22.19 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 117.257 -3.402 . . . . 0.0 110.466 172.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.269 16.1 t -125.48 124.15 40.75 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 124.189 1.947 . . . . 0.0 111.624 175.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -98.82 -22.95 15.57 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 112.37 -2.196 . . . . 0.0 113.354 -175.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.97 77.16 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.068 1.747 . . . . 0.0 110.437 159.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 17.0 ttp -52.12 -44.82 64.68 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 119.764 -1.835 . . . . 0.0 111.805 170.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.44 -31.62 68.87 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 114.121 -2.847 . . . . 0.0 110.499 -173.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.271 26.6 tp10 -58.97 -43.63 91.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 125.85 1.969 . . . . 0.0 114.334 168.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -59.8 -50.7 72.77 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 125.783 2.706 . . . . 0.0 114.554 174.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -62.78 -24.74 67.88 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 117.253 -3.404 . . . . 0.0 114.396 170.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . 0.271 1.8 t60 -66.99 -43.17 83.66 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.433 1.493 . . . . 0.0 113.38 171.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -76.38 -30.71 57.64 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 125.955 2.034 . . . . 0.0 107.749 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -65.86 -41.59 91.48 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 122.053 2.206 . . . . 0.0 111.448 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 12.8 t-105 -70.0 -52.96 19.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 127.651 2.38 . . . . 0.0 108.063 176.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 mt -62.17 -21.45 65.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 114.264 -2.779 . . . . 0.0 115.378 177.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -53.28 -43.04 67.15 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 118.439 2.755 . . . . 0.0 118.439 161.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -62.38 -39.31 92.77 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 129.17 2.988 . . . . 0.0 107.429 172.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.4 t -79.68 -24.11 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 120.465 1.484 . . . . 0.0 109.997 -176.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . 0.26 6.1 m-20 -59.92 -61.25 2.75 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 116.716 -3.74 . . . . 0.0 115.937 160.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 47.9 tp -44.73 -53.22 7.56 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 131.533 3.933 . . . . 0.0 114.154 173.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.6 tp -67.24 -36.29 81.32 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -64.73 -38.37 90.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.349 176.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -75.06 -32.8 61.6 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 114.956 -2.45 . . . . 0.0 111.516 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.96 -25.14 52.46 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 120.763 1.62 . . . . 0.0 114.863 172.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -59.8 -44.85 93.77 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 122.361 2.346 . . . . 0.0 112.042 162.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -78.31 16.68 0.74 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 113.978 -2.915 . . . . 0.0 113.348 176.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -131.76 7.39 4.42 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 121.461 1.937 . . . . 0.0 113.659 162.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.28 14.3 m-20 46.58 32.6 1.71 Allowed 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 128.138 2.575 . . . . 0.0 117.576 -165.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.1 mt -90.09 4.42 50.37 Favored 'General case' 0 N--CA 1.452 -0.368 1 O-C-N 115.877 -4.264 . . . . 0.0 113.235 166.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 p-80 -58.11 -43.73 87.31 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 116.968 -3.583 . . . . 0.0 115.164 -177.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 56.7 mt -64.06 -47.02 80.53 Favored Pre-proline 0 N--CA 1.452 -0.326 0 CA-C-O 117.087 -1.435 . . . . 0.0 111.676 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 15.0 Cg_exo -53.09 -40.2 77.54 Favored 'Trans proline' 0 N--CA 1.448 -1.187 1 C-N-CA 125.667 4.245 . . . . 0.0 114.471 174.512 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 24.7 tp -74.19 -39.4 63.19 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 117.196 -3.44 . . . . 0.0 110.277 -175.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.8 mt -83.44 3.06 33.63 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 126.334 2.271 . . . . 0.0 112.837 176.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -103.96 -9.04 19.17 Favored 'General case' 0 N--CA 1.446 -0.635 1 O-C-N 115.398 -4.564 . . . . 0.0 116.225 162.13 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 tt -97.0 -55.77 2.76 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.827 2.051 . . . . 0.0 108.385 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 57.8 mmm -72.69 -10.9 60.34 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 123.693 1.711 . . . . 0.0 115.41 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.5 mt -134.82 135.07 41.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 118.404 -2.685 . . . . 0.0 110.62 -176.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 74.2 p -87.27 162.18 43.9 Favored Pre-proline 0 N--CA 1.448 -0.536 0 O-C-N 116.744 -3.723 . . . . 0.0 111.64 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -56.7 -51.83 8.22 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 124.139 3.226 . . . . 0.0 112.593 -169.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -68.94 -16.76 63.83 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 127.454 2.302 . . . . 0.0 113.452 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -87.14 -39.41 15.56 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 118.237 -2.789 . . . . 0.0 112.344 170.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.266 78.5 mtm-85 -64.2 -40.5 96.2 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 117.386 -3.321 . . . . 0.0 114.205 167.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.44 ' HG3' ' HD2' ' B' ' 15' ' ' ARG . 23.2 tt0 -61.4 -45.65 93.44 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 116.054 -1.927 . . . . 0.0 111.946 176.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.28 -37.78 78.03 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 128.778 3.799 . . . . 0.0 112.247 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 70.6 mt -69.34 -26.08 64.52 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 121.236 1.834 . . . . 0.0 114.401 172.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.84 -45.49 57.58 Favored Glycine 0 C--N 1.336 0.537 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 173.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.1 m -64.15 -30.26 71.34 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 115.795 -2.05 . . . . 0.0 113.18 171.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.484 HH12 ' CD ' ' B' ' 47' ' ' GLU . 32.0 ttm180 -56.8 -34.78 68.02 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 120.438 1.472 . . . . 0.0 113.099 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 65.5 t -59.03 -37.41 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 116.411 -1.757 . . . . 0.0 113.019 172.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -67.63 -31.84 72.14 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 122.749 2.522 . . . . 0.0 114.236 171.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.276 64.4 mt -63.57 -39.42 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 O-C-N 120.019 -1.676 . . . . 0.0 107.846 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.6 t -79.13 -37.19 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 127.648 2.379 . . . . 0.0 113.369 -177.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -47.16 -60.9 2.16 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 125.711 1.882 . . . . 0.0 110.87 158.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -70.6 -14.05 62.33 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 126.685 3.136 . . . . 0.0 116.204 -175.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.406 HD21 HG22 ' A' ' 82' ' ' ILE . 93.9 mt -82.45 -39.35 22.68 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 116.739 -3.726 . . . . 0.0 111.673 167.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 tp -68.96 -47.48 65.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.354 1.433 . . . . 0.0 111.439 172.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.1 ttm105 -57.21 -62.19 1.94 Allowed 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.521 -3.237 . . . . 0.0 108.39 173.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.06 7.53 64.05 Favored Glycine 0 CA--C 1.522 0.506 0 O-C-N 119.756 -1.84 . . . . 0.0 117.404 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -97.11 -12.7 22.82 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 -165.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 22.1 ttm -138.41 134.68 34.42 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 127.394 2.933 . . . . 0.0 114.285 -167.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -97.56 157.9 15.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.099 -2.251 . . . . 0.0 115.845 -152.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -48.67 -37.19 17.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -174.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.3 tpt85 -75.83 -13.78 60.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 118.18 -2.825 . . . . 0.0 113.509 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -102.0 -36.56 8.55 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 117.159 -3.463 . . . . 0.0 105.778 -173.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 29.0 mt -67.78 -22.11 65.21 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 117.87 -3.019 . . . . 0.0 116.32 170.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.0 tptt -50.44 -29.98 11.53 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 115.502 1.668 . . . . 0.0 115.502 159.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -103.94 -50.74 3.31 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 174.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -66.46 -16.0 63.78 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 116.89 2.181 . . . . 0.0 116.89 -175.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 95.7 mt -129.63 -5.54 4.67 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 115.313 -2.279 . . . . 0.0 112.299 170.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 73.79 6.48 72.52 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-N 119.989 1.268 . . . . 0.0 115.839 -172.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.15 157.09 22.91 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 124.321 2.01 . . . . 0.0 113.404 -160.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.71 130.12 9.61 Favored Glycine 0 N--CA 1.446 -0.689 0 O-C-N 120.436 -1.415 . . . . 0.0 115.971 172.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 16.4 mt -61.32 -38.32 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 128.346 2.658 . . . . 0.0 114.12 -168.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.12 -13.15 62.27 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 117.686 2.476 . . . . 0.0 117.686 171.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.0 p -82.67 -48.3 11.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 120.83 -1.169 . . . . 0.0 111.992 169.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.406 HG22 HD21 ' A' ' 61' ' ' LEU . 6.5 mm -49.13 -39.42 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 123.147 1.451 . . . . 0.0 114.013 164.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.0 m -68.55 -49.2 61.31 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 120.74 -1.225 . . . . 0.0 108.496 -174.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.9 ttt180 -64.2 -37.32 87.04 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 125.411 1.695 . . . . 0.0 113.816 174.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.38 -47.48 62.3 Favored Glycine 0 C--N 1.338 0.64 0 C-N-CA 127.18 2.324 . . . . 0.0 109.791 172.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.6 m -58.99 -54.19 49.92 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 118.966 2.95 . . . . 0.0 118.966 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -59.13 -27.53 65.7 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 126.126 1.77 . . . . 0.0 113.49 168.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 56.1 m -67.0 -43.88 81.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 120.931 1.696 . . . . 0.0 112.011 168.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 89' ' ' LEU . 12.7 tp -62.33 -41.94 98.97 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.811 2.044 . . . . 0.0 109.2 176.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -60.37 -34.97 74.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 124.405 3.275 . . . . 0.0 110.29 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.33 -5.72 59.23 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.735 -1.853 . . . . 0.0 115.956 177.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.86 140.52 58.42 Favored Pre-proline 0 N--CA 1.449 -0.521 0 O-C-N 125.207 1.567 . . . . 0.0 110.605 -176.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -57.98 139.12 89.29 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 C-N-CA 125.218 3.946 . . . . 0.0 110.037 173.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.9 m -57.23 -29.52 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 119.705 -1.872 . . . . 0.0 111.738 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -70.16 -36.49 74.75 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 124.362 1.039 . . . . 0.0 113.145 -177.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 14.8 tp -60.18 -49.61 76.93 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 166.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -54.15 -42.52 69.66 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.61 1.564 . . . . 0.0 107.928 177.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -74.53 -31.1 62.03 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 123.571 1.653 . . . . 0.0 114.131 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . 0.296 65.4 t90 -70.73 -42.42 70.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 116.411 -3.93 . . . . 0.0 109.884 173.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.1 mt -60.83 -37.28 81.5 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 118.75 -2.469 . . . . 0.0 116.88 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . 0.274 44.2 mt-10 -60.65 -14.06 18.3 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 118.407 2.743 . . . . 0.0 118.407 -178.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -99.38 -12.81 19.94 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.433 2.293 . . . . 0.0 113.782 176.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.4 t -117.99 -31.98 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 O-C-N 118.106 -2.871 . . . . 0.0 116.807 -174.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.2 mt -84.08 -35.04 24.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 126.309 2.957 . . . . 0.0 118.808 174.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.283 21.3 mt -112.02 -18.83 12.53 Favored 'General case' 0 N--CA 1.448 -0.553 1 N-CA-C 122.516 4.265 . . . . 0.0 122.516 -160.289 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -75.13 -4.02 36.21 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.843 2.535 . . . . 0.0 117.843 -176.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.1 p -129.96 13.65 5.76 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -168.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.296 2.4 m-20 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 116.003 -1.951 . . . . 0.0 114.254 175.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? . . . . . 0 N--CA 1.467 0.421 0 CA-C-O 121.827 0.822 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -56.14 -44.25 79.05 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 128.799 2.84 . . . . 0.0 117.6 -175.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -79.36 -16.37 56.39 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 120.564 -1.335 . . . . 0.0 108.263 -175.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -84.39 -12.84 53.73 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.087 -2.258 . . . . 0.0 111.656 175.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 52.7 m -104.22 158.71 31.36 Favored Pre-proline 0 N--CA 1.449 -0.521 0 N-CA-C 119.887 3.292 . . . . 0.0 119.887 -162.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -62.34 -40.68 38.61 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 CA-C-N 124.364 2.594 . . . . 0.0 110.909 176.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -123.17 158.84 29.89 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 124.937 2.303 . . . . 0.0 111.154 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 4.4 t -160.02 129.73 5.29 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 114.002 -1.454 . . . . 0.0 110.181 169.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.04 74.52 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.329 -2.107 . . . . 0.0 114.133 169.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.275 . . -71.62 -34.15 69.57 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 -172.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 90.4 mtp -74.67 -47.58 30.98 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 120.503 -1.373 . . . . 0.0 110.204 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.4 -37.73 70.53 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 170.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -73.88 -33.62 64.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.779 2.082 . . . . 0.0 116.133 172.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -55.58 -59.11 5.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 163.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.44 ' HD2' ' HG3' ' A' ' 49' ' ' GLU . 35.4 mmt180 -48.75 -33.19 9.82 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 120.462 3.504 . . . . 0.0 120.462 172.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -60.27 -40.27 89.78 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 121.269 1.85 . . . . 0.0 112.664 170.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -72.6 -38.61 67.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 118.06 2.615 . . . . 0.0 118.06 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -59.87 -23.49 63.47 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.263 -0.975 . . . . 0.0 113.532 169.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 6.4 t-105 -82.22 -46.74 13.33 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.72 2.408 . . . . 0.0 109.167 172.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 76.9 mt -57.82 -27.21 62.96 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 119.567 -1.958 . . . . 0.0 115.727 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -59.5 -45.32 92.04 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 119.154 -2.216 . . . . 0.0 111.963 174.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -59.31 -51.58 69.32 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 114.942 -2.456 . . . . 0.0 110.96 176.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 89.1 t -67.6 -27.54 38.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 O-C-N 127.957 3.286 . . . . 0.0 110.327 -173.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -77.21 -39.74 47.6 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 116.547 -3.846 . . . . 0.0 111.397 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 31.7 tp -70.07 -37.24 75.44 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 117.659 -3.151 . . . . 0.0 110.961 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.61 -47.57 85.05 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 118.793 2.886 . . . . 0.0 118.793 165.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -61.02 -29.66 69.85 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 128.338 3.524 . . . . 0.0 111.698 173.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -91.57 -24.69 19.52 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 117.073 2.249 . . . . 0.0 117.073 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.41 -26.34 63.15 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.253 1.946 . . . . 0.0 116.253 164.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -61.56 -32.09 72.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 126.205 1.802 . . . . 0.0 115.547 169.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -81.64 -2.16 49.29 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 123.744 1.735 . . . . 0.0 111.52 -170.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -128.71 7.96 5.75 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 119.039 -2.288 . . . . 0.0 109.893 -173.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.392 14.5 m-20 58.36 21.58 8.49 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 119.732 -1.855 . . . . 0.0 115.144 -167.185 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 mt -102.26 20.02 17.61 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 120.582 3.549 . . . . 0.0 120.582 178.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -76.52 -46.46 26.46 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 118.692 -2.505 . . . . 0.0 112.779 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 25.7 mt -63.57 -41.66 67.66 Favored Pre-proline 0 N--CA 1.448 -0.569 0 CA-C-N 121.737 2.062 . . . . 0.0 113.18 174.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.287 40.1 Cg_exo -49.08 -47.97 19.93 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 124.941 3.76 . . . . 0.0 115.887 162.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -65.78 -35.01 79.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.267 -2.771 . . . . 0.0 108.688 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 57.2 mt -70.04 -40.75 74.95 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 118.087 2.625 . . . . 0.0 118.087 177.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -52.03 -25.54 8.77 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.4 1.88 . . . . 0.0 113.129 162.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 19.0 tp -91.96 -35.31 14.07 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.587 1.555 . . . . 0.0 112.853 178.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 21.8 mmt -94.46 -8.88 37.22 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 118.507 2.78 . . . . 0.0 118.507 -176.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 53.4 mt -141.94 126.85 18.24 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.786 1.634 . . . . 0.0 113.501 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 44.7 p -61.08 154.93 58.37 Favored Pre-proline 0 N--CA 1.449 -0.501 1 O-C-N 113.841 -5.537 . . . . 0.0 110.541 169.196 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -50.28 -22.8 8.96 Favored 'Trans proline' 0 N--CA 1.447 -1.213 0 N-CA-C 120.498 3.23 . . . . 0.0 120.498 174.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -81.68 -36.77 28.36 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 117.483 -3.261 . . . . 0.0 114.554 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' GLU . . . . . 0.484 ' CD ' HH12 ' A' ' 54' ' ' ARG . 19.5 mt-10 -62.23 -43.63 98.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 114.469 -2.682 . . . . 0.0 111.366 162.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -65.81 -33.99 77.13 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 125.587 1.804 . . . . 0.0 112.045 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -60.48 -43.45 96.94 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.885 -1.052 . . . . 0.0 113.276 168.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . 0.347 . . -65.91 -56.56 11.15 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 115.72 -2.086 . . . . 0.0 109.677 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.302 10.6 mt -59.0 -30.95 68.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 121.196 1.816 . . . . 0.0 111.427 -178.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.03 -52.86 44.65 Favored Glycine 0 CA--C 1.523 0.582 0 CA-C-O 114.747 -3.252 . . . . 0.0 110.929 170.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 25.8 m -66.78 -28.63 68.54 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.189 2.195 . . . . 0.0 108.713 -174.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -63.08 -26.03 68.64 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.937 1.695 . . . . 0.0 111.809 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 79.6 t -64.89 -48.89 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 125.032 1.457 . . . . 0.0 111.225 169.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 24.7 mtp180 -66.33 -33.53 75.95 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 118.121 -2.862 . . . . 0.0 109.624 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 85.2 mt -64.07 -59.27 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 O-C-N 121.022 -1.049 . . . . 0.0 111.7 172.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 39.6 t -56.33 -40.01 63.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 O-C-N 121.399 -0.813 . . . . 0.0 111.449 178.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -67.01 -32.43 73.65 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.228 -0.92 . . . . 0.0 111.828 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -80.79 -18.78 46.45 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.828 1.299 . . . . 0.0 108.935 176.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . 0.334 76.1 mt -88.93 10.18 22.28 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 114.699 -2.572 . . . . 0.0 110.95 170.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 15.1 mt -112.8 -29.33 7.44 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 118.931 2.937 . . . . 0.0 118.931 150.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.37 21.5 ttm105 -58.83 -70.0 0.17 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 127.533 2.333 . . . . 0.0 111.639 176.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.67 27.89 9.35 Favored Glycine 0 C--N 1.336 0.538 1 CA-C-O 112.905 -4.275 . . . . 0.0 112.273 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -113.41 -22.19 10.5 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 119.496 3.147 . . . . 0.0 119.496 -176.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . 0.277 13.5 mtt -84.82 147.48 26.8 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 126.364 2.29 . . . . 0.0 111.313 -174.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 87.4 p -95.1 169.55 10.03 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 116.799 -1.961 . . . . 0.0 112.322 168.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -62.56 -31.85 72.73 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 116.883 -1.532 . . . . 0.0 112.51 -176.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 31.3 ttt180 -63.1 -50.88 68.77 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 126.345 2.278 . . . . 0.0 106.052 176.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -61.53 -44.39 97.14 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 127.672 2.389 . . . . 0.0 109.232 -174.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 31.1 mt -63.49 -46.42 86.2 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.82 -1.086 . . . . 0.0 113.48 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -63.93 -43.14 96.78 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.725 1.266 . . . . 0.0 110.954 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -68.58 -59.35 3.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.102 0.961 . . . . 0.0 110.421 -176.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -93.21 -61.11 1.64 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.42 -1.276 . . . . 0.0 111.444 -161.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 30.1 mt -74.23 -14.66 60.96 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 92.89 -1.29 70.76 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-O 124.188 1.993 . . . . 0.0 112.033 162.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.07 114.72 26.67 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -162.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.7 171.1 53.65 Favored Glycine 0 C--N 1.332 0.312 0 O-C-N 119.42 -2.05 . . . . 0.0 116.074 -176.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 11.4 mm -52.91 -43.62 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-O 115.319 -2.276 . . . . 0.0 111.368 -174.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.58 -27.52 62.24 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 123.366 2.803 . . . . 0.0 113.91 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 30.3 m -67.45 -49.62 62.88 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 121.252 1.842 . . . . 0.0 112.822 173.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 15.6 mm -64.5 -39.6 86.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 C-N-CA 125.827 1.651 . . . . 0.0 112.777 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 98.3 m -49.25 -52.63 25.98 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 162.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 42.5 ttt180 -63.22 -34.56 77.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 125.91 1.684 . . . . 0.0 114.498 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -60.49 -46.76 93.76 Favored Glycine 0 CA--C 1.521 0.438 0 O-C-N 126.125 2.141 . . . . 0.0 114.198 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 2.4 p -76.02 -27.36 57.32 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.614 1.166 . . . . 0.0 107.855 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -67.26 -43.09 82.74 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 119.71 1.141 . . . . 0.0 112.314 170.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . 0.26 51.5 m -79.66 -22.6 43.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.728 2.411 . . . . 0.0 109.886 -168.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 15.0 mt -78.13 -39.92 39.68 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 118.993 -2.317 . . . . 0.0 109.102 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 47.8 tttm -70.44 -24.32 62.88 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.873 1.269 . . . . 0.0 110.483 -172.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.9 -23.67 31.11 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 115.25 -2.309 . . . . 0.0 113.502 166.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.93 150.2 88.48 Favored Pre-proline 0 N--CA 1.45 -0.46 0 CA-C-N 121.391 1.905 . . . . 0.0 115.098 -164.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -46.52 132.56 16.17 Favored 'Trans proline' 0 N--CA 1.451 -1.024 0 O-C-N 122.944 0.971 . . . . 0.0 110.641 163.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.422 ' H ' HG13 ' B' ' 94' ' ' VAL . 1.1 m -61.93 -26.38 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 O-C-N 119.583 -1.948 . . . . 0.0 113.322 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pm0 -67.84 -25.04 65.35 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 124.372 2.034 . . . . 0.0 114.829 176.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 21.3 tp -73.33 -46.94 46.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 117.046 -3.534 . . . . 0.0 109.478 167.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 48.8 mtp85 -60.75 -38.63 85.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 126.743 2.527 . . . . 0.0 115.386 -175.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -60.45 -45.14 94.78 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.967 2.107 . . . . 0.0 112.182 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -77.28 -46.19 23.88 Favored 'General case' 0 N--CA 1.449 -0.525 1 C-N-CA 131.731 4.013 . . . . 0.0 108.264 -170.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 38.3 mt -54.77 -49.23 71.39 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 174.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -49.24 -55.35 12.87 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 126.099 2.125 . . . . 0.0 109.614 172.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -72.59 -18.03 61.64 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 121.037 3.717 . . . . 0.0 121.037 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 56.3 t -87.8 -42.28 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 115.639 -2.124 . . . . 0.0 111.281 171.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 52.7 mt -88.19 -65.57 1.0 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 120.405 1.457 . . . . 0.0 112.752 -167.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 83.9 mt -57.0 -30.52 64.24 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 120.054 -1.654 . . . . 0.0 114.022 -167.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -66.38 -10.26 41.65 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 117.78 2.511 . . . . 0.0 117.78 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 45.8 m -104.81 7.07 34.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 124.38 2.038 . . . . 0.0 114.651 -177.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 . . . . . 0 C--O 1.25 1.119 1 O-C-N 115.555 -4.466 . . . . 0.0 113.697 163.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ttt . . . . . 0 N--CA 1.469 0.51 0 N-CA-C 104.306 -2.479 . . . . 0.0 104.306 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.24 155.68 20.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.502 1.921 . . . . 0.0 112.77 176.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -122.6 161.88 22.9 Favored 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 125.825 1.953 . . . . 0.0 110.219 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -123.59 164.64 18.62 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.737 1.215 . . . . 0.0 110.157 165.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -151.83 154.25 32.66 Favored Pre-proline 0 N--CA 1.447 -0.592 0 O-C-N 127.25 2.843 . . . . 0.0 115.479 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.92 -14.24 13.83 Favored 'Trans proline' 0 N--CA 1.446 -1.307 1 C-N-CA 125.591 4.194 . . . . 0.0 113.321 174.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -147.48 135.31 21.15 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.766 -2.459 . . . . 0.0 106.33 172.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 15.4 t -138.19 134.47 34.53 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 123.15 1.452 . . . . 0.0 109.819 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.38 -34.54 78.19 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 116.39 -3.944 . . . . 0.0 115.198 177.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.96 -35.38 72.14 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.622 1.569 . . . . 0.0 113.018 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 59.2 mtt -64.0 -40.71 96.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 122.264 1.03 . . . . 0.0 109.374 171.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.29 -20.46 61.5 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 176.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -66.14 -50.86 62.52 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 120.456 -1.403 . . . . 0.0 107.86 162.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -60.96 -40.42 93.3 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -170.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -44.57 83.08 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 128.737 2.815 . . . . 0.0 113.906 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -62.65 -28.83 70.19 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 170.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -68.68 -24.81 64.55 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 119.01 2.967 . . . . 0.0 119.01 169.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -80.92 -42.05 21.99 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 125.729 1.893 . . . . 0.0 110.544 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 19' ' ' TRP . . . . . 0.661 ' CZ2' ' HD2' ' D' ' 48' ' ' ARG . 28.9 t-105 -62.96 -46.7 86.47 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 125.674 1.59 . . . . 0.0 112.997 169.384 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 5.7 mp -60.89 -36.8 80.17 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 116.358 -1.782 . . . . 0.0 109.551 175.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -70.24 -31.59 69.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 118.852 2.908 . . . . 0.0 118.852 171.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -53.34 -42.93 67.25 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.564 1.945 . . . . 0.0 111.175 161.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.312 42.6 t -65.63 -50.23 72.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 124.89 1.369 . . . . 0.0 112.287 174.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -70.44 -29.54 66.14 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 117.569 2.433 . . . . 0.0 117.569 -175.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 24.0 tp -70.19 -61.2 1.87 Allowed 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 126.453 3.025 . . . . 0.0 104.501 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 36.0 tp -52.12 -30.35 25.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 118.155 -2.84 . . . . 0.0 113.695 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -62.52 -39.5 93.75 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.804 1.241 . . . . 0.0 113.631 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -81.71 -20.52 39.24 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 125.868 1.667 . . . . 0.0 111.265 178.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.14 71.26 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.377 1.071 . . . . 0.0 112.102 -176.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -61.03 -35.68 77.54 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 120.059 1.3 . . . . 0.0 112.406 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -59.42 -29.22 67.6 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 126.922 2.639 . . . . 0.0 110.552 -157.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 34.7 p-10 -128.68 35.36 4.37 Favored 'General case' 0 N--CA 1.447 -0.587 1 C-N-CA 132.886 4.474 . . . . 0.0 115.339 172.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.415 79.3 m-20 61.98 18.3 9.76 Favored 'General case' 0 N--CA 1.45 -0.472 1 N-CA-C 122.293 4.183 . . . . 0.0 122.293 175.543 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.309 45.6 mt -78.71 -4.31 48.51 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 118.072 -2.893 . . . . 0.0 116.343 174.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -71.39 -41.98 68.97 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 117.081 -1.438 . . . . 0.0 111.892 -170.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 36' ' ' LEU . . . . . 0.449 ' HB2' ' HD3' ' C' ' 37' ' ' PRO . 12.9 mt -64.2 -51.23 63.5 Favored Pre-proline 0 N--CA 1.446 -0.669 0 CA-C-O 116.017 -1.944 . . . . 0.0 110.923 174.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 37' ' ' PRO . . . . . 0.449 ' HD3' ' HB2' ' C' ' 36' ' ' LEU . 7.7 Cg_exo -45.22 -36.5 12.4 Favored 'Trans proline' 0 N--CA 1.452 -0.963 1 C-N-CA 130.296 7.331 . . . . 0.0 116.495 167.069 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.79 -44.84 22.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 116.552 -1.689 . . . . 0.0 110.019 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 36.2 mt -69.63 -28.88 66.29 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 126.21 2.194 . . . . 0.0 110.67 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -79.29 -14.8 58.78 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.918 2.487 . . . . 0.0 110.493 -177.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 41' ' ' LEU . . . . . 0.53 HD13 ' HA ' ' D' ' 88' ' ' SER . 58.4 tp -101.71 -42.74 6.08 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.034 3.334 . . . . 0.0 111.808 172.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 12.0 mmt -62.99 -22.65 66.99 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 175.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mp -125.3 155.51 40.09 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.936 2.094 . . . . 0.0 115.092 -175.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -90.54 167.4 16.61 Favored Pre-proline 0 N--CA 1.45 -0.45 0 C-N-CA 129.136 2.975 . . . . 0.0 115.555 163.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -56.65 -38.36 95.75 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 N-CA-C 115.689 1.38 . . . . 0.0 115.689 177.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -68.76 -37.11 79.12 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 128.553 2.741 . . . . 0.0 108.442 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -71.66 -26.11 62.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 116.193 -1.86 . . . . 0.0 112.104 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . 0.256 34.0 mtm-85 -64.99 -47.48 77.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.688 2.395 . . . . 0.0 115.96 168.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.27 -49.3 77.62 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.587 1.955 . . . . 0.0 108.406 176.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -45.94 -52.91 10.82 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 126.225 2.203 . . . . 0.0 112.491 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 92.0 mt -66.89 -45.58 77.6 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 126.346 1.858 . . . . 0.0 113.03 -177.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.17 -29.03 67.62 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 121.433 1.924 . . . . 0.0 109.269 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 94.0 m -82.47 -41.42 19.81 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 121.175 -1.191 . . . . 0.0 110.249 -174.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.35 55.2 mtt180 -44.95 -38.27 4.58 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 116.045 1.869 . . . . 0.0 116.045 165.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 54.7 t -67.72 -38.3 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-O 114.093 -2.86 . . . . 0.0 109.547 174.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -70.79 -36.22 72.92 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 124.658 3.39 . . . . 0.0 113.799 170.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 70.5 mt -69.48 -27.7 35.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 122.336 2.335 . . . . 0.0 113.476 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 79.6 t -71.79 -29.49 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 117.056 2.243 . . . . 0.0 117.056 167.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -70.75 -43.36 68.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.766 2.826 . . . . 0.0 113.023 171.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -71.65 -42.42 67.57 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 119.548 1.067 . . . . 0.0 112.127 -176.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.8 -33.29 73.61 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 117.351 -1.309 . . . . 0.0 113.507 174.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . 0.392 72.0 mt -56.59 -51.7 67.64 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 121.775 2.08 . . . . 0.0 110.115 164.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -59.13 -45.2 91.56 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.36 56.65 10.41 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 106.75 -2.54 . . . . 0.0 106.75 174.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -125.45 57.96 1.31 Allowed 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 129.631 3.172 . . . . 0.0 103.719 168.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 34.0 mtt -136.69 142.61 43.15 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 127.618 2.367 . . . . 0.0 110.983 176.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 94.5 p -77.2 159.71 29.48 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 128.749 2.82 . . . . 0.0 115.711 163.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -58.73 -24.13 61.04 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.136 3.375 . . . . 0.0 111.325 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 31.3 ttp-105 -77.07 -35.0 56.96 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 167.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -75.23 -36.83 61.3 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 121.673 -0.642 . . . . 0.0 111.036 174.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.54 -14.46 42.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.081 -2.262 . . . . 0.0 113.947 171.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.7 tttt -94.4 -44.42 7.92 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 118.036 -2.915 . . . . 0.0 114.817 165.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -97.44 -23.28 16.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 126.893 2.077 . . . . 0.0 115.54 -163.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -94.35 -36.43 11.94 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 119.346 -2.096 . . . . 0.0 114.224 170.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 9.4 mp -88.25 -29.61 20.3 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.228 -1.844 . . . . 0.0 108.579 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 75.87 -154.25 44.85 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 122.038 2.199 . . . . 0.0 110.968 -176.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.71 -15.96 60.22 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 126.564 3.078 . . . . 0.0 111.959 174.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.79 -12.39 82.95 Favored Glycine 0 N--CA 1.446 -0.68 0 O-C-N 117.121 -3.487 . . . . 0.0 113.742 -166.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 13.9 tt -54.95 -40.07 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-O 115.471 -2.204 . . . . 0.0 110.989 170.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.24 -42.72 63.84 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 123.601 2.909 . . . . 0.0 112.652 174.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 3.4 m -50.47 -33.71 22.21 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 127.329 2.251 . . . . 0.0 115.726 176.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 32.1 mm -105.17 -10.68 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 126.539 1.936 . . . . 0.0 112.154 -171.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . 0.367 20.8 p -125.4 -15.97 6.01 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 119.344 3.091 . . . . 0.0 119.344 -167.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 38.9 mtp85 -110.83 164.94 12.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 O-C-N 119.799 -1.813 . . . . 0.0 112.468 162.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.88 160.48 17.85 Favored Glycine 0 C--N 1.339 0.72 0 C-N-CA 129.792 3.568 . . . . 0.0 111.44 -171.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 2.1 m -65.73 -7.31 14.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 116.858 2.17 . . . . 0.0 116.858 -173.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -105.47 7.24 32.99 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 -179.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 45.6 p -75.63 168.75 19.44 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 111.707 -3.996 . . . . 0.0 112.39 -170.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . 0.3 54.9 tp -65.93 -28.21 68.76 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 122.366 2.348 . . . . 0.0 113.454 -145.228 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 81.4 mttt -104.22 -14.54 15.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.998 1.272 . . . . 0.0 114.047 178.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.73 -38.12 88.29 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 117.21 -3.431 . . . . 0.0 115.066 155.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 92' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' C' ' 93' ' ' PRO . . . -47.33 153.46 0.95 Allowed Pre-proline 0 N--CA 1.449 -0.516 0 C-N-CA 128.868 2.867 . . . . 0.0 113.052 174.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 93' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' C' ' 92' ' ' ALA . 1.0 OUTLIER -65.7 149.98 86.63 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-O 124.838 1.933 . . . . 0.0 114.521 -172.547 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 94' ' ' VAL . . . . . 0.46 ' HA ' ' HB2' ' C' ' 97' ' ' ARG . 7.4 t -79.21 -24.07 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 114.559 -2.639 . . . . 0.0 106.913 -167.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 21.8 pm0 -75.24 -16.41 60.46 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 122.043 2.201 . . . . 0.0 113.488 171.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -86.41 -37.97 17.83 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 167.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 97' ' ' ARG . . . . . 0.46 ' HB2' ' HA ' ' C' ' 94' ' ' VAL . 66.6 mtp180 -68.12 -31.28 70.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 120.443 -1.411 . . . . 0.0 112.896 -170.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -84.72 -50.59 7.49 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.181 2.192 . . . . 0.0 110.118 -178.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 49.5 t90 -53.97 -40.4 66.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 172.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.42 -40.18 93.48 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 118.764 -2.46 . . . . 0.0 112.701 178.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -70.73 -33.85 71.27 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 120.519 1.509 . . . . 0.0 111.79 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -61.71 -27.25 68.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 116.516 2.043 . . . . 0.0 116.516 168.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 60.3 t -91.77 -53.28 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.756 -178.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 52.0 mt -91.99 -39.57 11.59 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 117.976 -1.489 . . . . 0.0 113.057 -166.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 11.0 mt -108.45 50.26 0.78 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 -173.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -96.1 144.89 25.95 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 119.333 -2.104 . . . . 0.0 113.808 -173.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 58.8 m -88.43 -1.23 57.93 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 127.435 2.294 . . . . 0.0 117.115 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 30.6 t0 . . . . . 0 C--O 1.249 1.038 0 C-N-CA 130.228 3.411 . . . . 0.0 112.157 174.862 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 43.4 mtp . . . . . 0 N--CA 1.47 0.536 0 CA-C-O 127.173 3.368 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.74 122.2 7.35 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 118.542 -2.599 . . . . 0.0 114.14 -176.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -85.18 91.33 8.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 114.908 -2.472 . . . . 0.0 108.3 -174.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -83.94 107.54 16.37 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 126.42 2.325 . . . . 0.0 112.859 178.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 96.2 p -85.09 170.67 12.72 Favored Pre-proline 0 N--CA 1.449 -0.498 0 CA-C-N 112.391 -2.186 . . . . 0.0 113.075 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -67.98 -32.86 27.56 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 N-CA-C 121.102 3.462 . . . . 0.0 121.102 -173.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -160.74 132.69 5.92 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 109.383 -3.553 . . . . 0.0 103.923 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.5 t -54.17 132.6 43.48 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 118.269 -2.769 . . . . 0.0 115.812 178.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.09 -34.62 73.73 Favored 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 117.58 -3.2 . . . . 0.0 114.737 176.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.98 -23.57 55.31 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 124.044 1.878 . . . . 0.0 111.173 -177.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -77.92 -35.7 50.25 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 117.128 -3.482 . . . . 0.0 111.095 173.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -41.6 98.29 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 121.986 0.898 . . . . 0.0 112.52 169.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -60.91 -52.18 66.14 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 113.71 -1.586 . . . . 0.0 108.644 169.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -55.1 -35.78 64.98 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 176.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.56 0.3 34.46 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 117.391 2.367 . . . . 0.0 117.391 172.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -101.69 -19.35 15.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 116.879 -1.928 . . . . 0.0 110.513 158.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 78.7 mm-40 -82.18 -31.4 30.43 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -66.55 -27.11 67.48 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 119.168 -2.208 . . . . 0.0 112.273 165.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -73.8 -44.5 55.67 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.045 0.841 . . . . 0.0 112.406 173.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 73.3 mt -59.85 -16.75 31.27 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 118.342 2.719 . . . . 0.0 118.342 165.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -75.17 -40.91 59.1 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 125.404 2.526 . . . . 0.0 109.17 169.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -65.51 -47.0 77.48 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.014 -3.554 . . . . 0.0 110.907 171.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 58.6 t -55.52 -53.36 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-O 116.479 -1.724 . . . . 0.0 110.236 178.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -55.43 -36.58 66.66 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 118.597 2.814 . . . . 0.0 118.597 175.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 31.3 tp -76.72 -44.78 31.93 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 113.594 -1.639 . . . . 0.0 114.132 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.01 -41.04 99.47 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 113.369 -3.205 . . . . 0.0 111.103 170.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 ttpp -53.83 -57.22 11.69 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.319 2.327 . . . . 0.0 113.42 165.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -42.81 -48.88 5.78 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 116.468 -1.729 . . . . 0.0 113.186 164.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.359 . . -58.26 -38.37 76.8 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 120.454 1.479 . . . . 0.0 114.74 175.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -59.54 -31.4 69.37 Favored 'General case' 0 N--CA 1.454 -0.268 1 O-C-N 115.045 -4.784 . . . . 0.0 111.439 174.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -86.53 -23.35 25.9 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.919 2.088 . . . . 0.0 111.672 -167.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 50.4 p30 -122.95 5.08 9.35 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.985 1.314 . . . . 0.0 108.991 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.385 11.9 m-20 74.88 25.74 1.4 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 114.529 -2.653 . . . . 0.0 117.593 176.122 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . 0.269 66.0 mt -96.78 5.74 50.03 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 126.456 2.348 . . . . 0.0 112.432 -172.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -80.49 -48.84 12.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.852 3.261 . . . . 0.0 111.72 -155.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 1.2 mt -50.77 -46.88 86.69 Favored Pre-proline 0 N--CA 1.451 -0.418 0 O-C-N 119.707 -1.87 . . . . 0.0 112.894 174.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.256 17.1 Cg_exo -70.23 -18.19 34.94 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 N-CA-C 117.731 2.166 . . . . 0.0 117.731 176.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 32.0 tp -77.32 -37.09 53.28 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.313 3.045 . . . . 0.0 108.886 167.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.13 -38.88 60.88 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 115.372 -2.252 . . . . 0.0 108.789 -179.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -75.43 -22.2 57.54 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 128.523 3.64 . . . . 0.0 112.312 174.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 18.6 tp -70.72 -42.98 69.87 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 115.898 -2.001 . . . . 0.0 111.338 171.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 19.8 mmt -84.74 -36.34 21.85 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 129.148 2.979 . . . . 0.0 114.846 -171.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mt -122.35 126.98 49.19 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 125.049 2.357 . . . . 0.0 109.208 -171.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 68.2 p -78.32 166.62 41.76 Favored Pre-proline 0 N--CA 1.448 -0.534 0 CA-C-N 111.2 -2.727 . . . . 0.0 113.352 -176.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_exo -59.07 -43.84 39.32 Favored 'Trans proline' 0 N--CA 1.447 -1.21 0 CA-C-N 121.575 1.598 . . . . 0.0 114.912 -162.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.274 48.7 m-20 -75.37 -17.28 60.26 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 117.558 -3.214 . . . . 0.0 109.238 -177.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -74.25 -37.52 63.74 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 124.912 2.292 . . . . 0.0 108.602 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 48' ' ' ARG . . . . . 0.661 ' HD2' ' CZ2' ' C' ' 19' ' ' TRP . 17.1 mtm180 -76.72 -31.07 56.91 Favored 'General case' 0 N--CA 1.45 -0.459 1 C-N-CA 132.386 4.275 . . . . 0.0 108.599 174.155 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -66.85 -38.34 86.18 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 122.566 2.439 . . . . 0.0 109.549 168.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.277 . . -79.71 -36.89 36.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 114.718 -2.563 . . . . 0.0 116.635 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 18.2 mt -61.16 -49.07 78.72 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 125.182 1.551 . . . . 0.0 114.418 164.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.37 -44.43 58.43 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 82.7 m -73.76 -23.33 59.72 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 127.212 2.205 . . . . 0.0 113.118 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -62.26 -20.69 64.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 117.428 -3.295 . . . . 0.0 115.288 166.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 43.7 t -66.59 -57.51 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 119.946 1.248 . . . . 0.0 108.216 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -69.31 -17.39 63.72 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.247 1.819 . . . . 0.0 112.837 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 31.8 mt -74.4 -44.2 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 O-C-N 118.055 -2.903 . . . . 0.0 110.803 173.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.45 -39.39 80.66 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 C-N-CA 128.274 2.63 . . . . 0.0 111.718 174.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -58.13 -49.44 76.97 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 117.931 -2.981 . . . . 0.0 109.731 176.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -70.42 -22.27 62.74 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 116.223 1.935 . . . . 0.0 116.223 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 46.1 mt -72.82 -28.51 62.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 121.44 1.927 . . . . 0.0 112.691 164.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 62' ' ' LEU . . . . . 0.415 HD22 ' HB2' ' D' ' 101' ' ' GLU . 78.9 mt -76.53 -36.89 57.43 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 120.835 1.652 . . . . 0.0 110.239 169.194 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -76.94 -33.88 57.67 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.437 0.695 . . . . 0.0 111.498 -173.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 45.31 52.46 8.58 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 121.909 3.523 . . . . 0.0 121.909 176.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -127.48 -12.69 5.55 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 119.232 -2.334 . . . . 0.0 109.701 173.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 16.4 mmt -87.85 59.36 5.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.093 1.357 . . . . 0.0 109.977 164.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 1.5 p -66.23 144.72 56.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 119.94 3.311 . . . . 0.0 119.94 -171.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 49.03 -101.41 0.08 Allowed 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 128.768 2.827 . . . . 0.0 109.355 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -58.42 -37.38 75.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 115.038 -2.411 . . . . 0.0 114.785 -174.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -70.79 -38.73 73.38 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.279 1.99 . . . . 0.0 111.708 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.75 -35.6 81.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 117.992 -2.943 . . . . 0.0 112.13 169.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -76.68 -25.13 53.34 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 121.119 1.781 . . . . 0.0 115.691 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -119.85 -30.78 4.66 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 113.103 -3.332 . . . . 0.0 111.95 -171.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . 0.258 17.5 tp10 -94.99 -45.54 7.21 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 123.453 2.842 . . . . 0.0 110.899 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 75' ' ' LEU . . . . . 0.462 HD13 ' HA ' ' D' ' 75' ' ' LEU . 4.3 mm? -73.87 -50.51 19.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 102.676 -3.083 . . . . 0.0 102.676 170.41 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 94.33 -141.28 15.47 Favored Glycine 0 N--CA 1.448 -0.506 1 CA-C-O 129.212 4.784 . . . . 0.0 118.298 153.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.61 -33.38 73.81 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.694 -2.651 . . . . 0.0 113.616 -167.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.18 -25.56 25.77 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 126.175 1.845 . . . . 0.0 116.166 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 5.2 tt -65.39 -15.29 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 119.732 1.766 . . . . 0.0 115.597 -173.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.23 -44.16 65.91 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.902 -1.047 . . . . 0.0 113.571 173.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 26.4 m -61.64 -39.63 91.99 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 170.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 45.6 mm -77.2 -34.98 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 O-C-N 120.864 -1.148 . . . . 0.0 111.131 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 70.0 p -104.01 -9.8 18.56 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 113.308 -3.234 . . . . 0.0 112.761 -174.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -96.16 -175.7 3.45 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 104.354 -2.461 . . . . 0.0 104.354 173.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 66.37 161.62 1.08 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 126.518 2.008 . . . . 0.0 112.445 -173.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 57.1 p -77.49 -22.5 51.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 116.142 1.905 . . . . 0.0 116.142 -148.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 72.0 m-80 -121.67 62.71 0.92 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 131.335 3.854 . . . . 0.0 111.093 175.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 88' ' ' SER . . . . . 0.53 ' HA ' HD13 ' C' ' 41' ' ' LEU . 84.0 p -85.41 175.92 8.58 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 125.821 2.724 . . . . 0.0 115.324 171.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.39 -11.56 60.28 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 118.933 -2.354 . . . . 0.0 110.977 161.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -71.22 -18.18 62.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 162.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -118.21 -23.38 7.34 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 116.947 2.202 . . . . 0.0 116.947 -165.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 42.62 85.85 0.15 Allowed Pre-proline 0 N--CA 1.449 -0.488 0 CA-C-O 124.298 1.999 . . . . 0.0 111.707 169.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 93' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo 20.11 45.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.123 0 O-C-N 116.84 -2.242 . . . . 0.0 114.45 51.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -58.95 -23.79 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 C-N-CA 127.363 2.265 . . . . 0.0 106.747 -175.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.53 -27.76 11.2 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 117.31 -1.329 . . . . 0.0 109.207 -160.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 34.5 tp -60.92 -54.24 47.51 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 128.486 2.715 . . . . 0.0 107.003 152.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 43.7 ttp180 -55.34 -52.81 62.29 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 124.739 3.427 . . . . 0.0 112.857 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -56.39 -24.78 46.84 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 124.2 3.182 . . . . 0.0 115.868 172.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 99' ' ' TRP . . . . . 0.429 ' CZ2' HG21 ' D' ' 103' ' ' VAL . 84.6 t90 -85.11 -40.93 16.2 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 123.238 1.494 . . . . 0.0 112.475 176.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.06 -35.25 79.61 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 118.331 -2.73 . . . . 0.0 108.967 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 101' ' ' GLU . . . . . 0.415 ' HB2' HD22 ' D' ' 62' ' ' LEU . 18.1 tt0 -68.08 -4.84 14.85 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 112.635 -2.075 . . . . 0.0 114.051 176.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -119.21 -33.63 4.08 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 119.331 -0.948 . . . . 0.0 108.599 177.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 103' ' ' VAL . . . . . 0.429 HG21 ' CZ2' ' D' ' 99' ' ' TRP . 25.4 t -77.34 -36.21 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 116.169 1.915 . . . . 0.0 116.169 171.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 24.6 mt -80.24 -39.38 29.13 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 127.923 2.489 . . . . 0.0 112.659 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 15.1 mt -110.84 37.41 2.8 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 126.62 3.105 . . . . 0.0 111.622 -174.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -58.08 165.71 1.81 Allowed 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.526 -2.609 . . . . 0.0 112.113 176.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 59.6 m -44.79 -36.48 3.25 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 129.258 3.023 . . . . 0.0 114.692 173.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 . . . . . 0 C--O 1.253 1.242 0 C-N-CA 129.175 2.99 . . . . 0.0 115.48 -178.612 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 113.457 -3.163 . . . . 0.0 113.011 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -35.53 -52.0 0.65 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 124.341 3.246 . . . . 0.0 115.427 177.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -83.02 -15.1 52.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.67 2.788 . . . . 0.0 116.88 -171.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -87.57 -22.73 24.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 117.322 -1.323 . . . . 0.0 114.174 -166.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.51 159.78 52.15 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 121.284 1.856 . . . . 0.0 112.862 -172.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -81.86 -11.79 11.17 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 C-N-CA 124.715 3.61 . . . . 0.0 113.061 174.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -137.2 145.08 43.24 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.292 2.237 . . . . 0.0 114.399 165.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 33.4 t -120.93 124.3 44.6 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.895 2.078 . . . . 0.0 107.681 170.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.94 -33.27 21.21 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.027 0.931 . . . . 0.0 110.613 -177.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.88 -44.94 96.39 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 117.044 2.238 . . . . 0.0 117.044 163.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -28.15 67.94 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 117.466 -3.271 . . . . 0.0 115.403 170.085 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.39 -41.72 88.92 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 125.735 2.683 . . . . 0.0 114.014 171.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -71.5 -32.62 68.43 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 127.22 2.208 . . . . 0.0 112.105 171.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -60.33 -46.89 88.29 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.498 -2.001 . . . . 0.0 113.145 165.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.7 mmt-85 -70.32 -31.6 68.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 115.762 -2.066 . . . . 0.0 112.581 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.8 t60 -58.06 -50.88 71.91 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.038 -1.934 . . . . 0.0 111.796 165.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -53.53 -41.08 66.01 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.164 1.785 . . . . 0.0 113.421 174.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.254 34.7 tt0 -60.19 -49.86 75.95 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.187 1.795 . . . . 0.0 110.013 170.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -57.77 -61.07 2.78 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.394 -2.691 . . . . 0.0 117.014 172.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.8 mt -55.88 -29.17 59.56 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -175.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -47.89 -43.48 28.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 128.547 2.739 . . . . 0.0 111.023 168.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -67.15 -43.23 82.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 119.72 -1.862 . . . . 0.0 110.198 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.7 t -66.23 -36.81 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-O 113.722 -3.037 . . . . 0.0 111.171 175.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -61.99 -58.33 8.29 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.168 1.804 . . . . 0.0 109.67 168.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 36.8 tp -47.12 -54.62 10.08 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.171 -1.581 . . . . 0.0 113.17 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 36.3 tp -62.35 -39.95 94.8 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 124.137 3.153 . . . . 0.0 113.271 176.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -54.87 -35.77 64.4 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 127.003 3.287 . . . . 0.0 111.406 170.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -90.48 -6.28 55.01 Favored 'General case' 0 N--CA 1.452 -0.341 1 O-C-N 116.208 -4.057 . . . . 0.0 112.244 -177.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.0 -31.67 17.99 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 119.376 0.989 . . . . 0.0 111.961 163.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -50.95 -37.1 42.34 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.238 -2.163 . . . . 0.0 111.63 165.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -81.64 -10.46 59.41 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 121.91 2.141 . . . . 0.0 116.309 -174.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -109.76 -1.44 17.95 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.678 1.191 . . . . 0.0 113.771 172.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.442 12.4 m-20 63.94 34.52 11.51 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.822 2.049 . . . . 0.0 114.574 -175.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.6 mt -107.14 13.72 27.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.748 2.819 . . . . 0.0 113.978 174.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.3 p-80 -63.24 -60.04 3.93 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 116.091 1.886 . . . . 0.0 116.091 172.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.27 14.3 mt -59.92 -43.18 94.01 Favored Pre-proline 0 N--CA 1.449 -0.494 0 O-C-N 125.056 1.472 . . . . 0.0 112.734 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -45.46 -57.63 2.04 Favored 'Trans proline' 0 N--CA 1.448 -1.164 0 C-N-CA 123.216 2.611 . . . . 0.0 117.48 160.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.52 -40.38 92.9 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 117.605 -3.184 . . . . 0.0 117.375 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.3 mt -53.79 -35.18 61.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 115.793 -2.051 . . . . 0.0 110.434 169.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 -81.2 -10.45 59.62 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 120.789 1.631 . . . . 0.0 112.475 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.5 tt -92.68 -32.75 14.62 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 116.976 -3.578 . . . . 0.0 114.839 169.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 94.8 mmm -92.01 -17.59 24.86 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 120.065 3.358 . . . . 0.0 120.065 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.5 mt -120.6 129.83 53.92 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 169.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.9 p -70.34 154.11 94.71 Favored Pre-proline 0 N--CA 1.449 -0.481 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -49.01 -51.37 10.69 Favored 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 124.739 3.626 . . . . 0.0 119.089 -172.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.42 -9.59 58.74 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 116.863 -3.648 . . . . 0.0 115.269 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -81.92 -43.03 18.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 117.616 -3.177 . . . . 0.0 110.889 168.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 78.6 mtm-85 -54.28 -41.83 69.33 Favored 'General case' 0 N--CA 1.445 -0.693 1 O-C-N 114.666 -5.021 . . . . 0.0 112.226 171.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -65.83 -50.02 66.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 110.672 -2.967 . . . . 0.0 110.829 174.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.95 -33.6 62.49 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.953 2.101 . . . . 0.0 113.187 174.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.5 mt -88.75 -21.74 23.67 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 114.674 -2.584 . . . . 0.0 108.785 -175.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.93 -46.85 92.72 Favored Glycine 0 C--N 1.337 0.626 0 CA-C-N 121.391 1.905 . . . . 0.0 111.098 162.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.6 m -61.76 -28.67 69.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.132 -2.393 . . . . 0.0 110.462 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -60.68 -33.4 72.78 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 115.551 -2.166 . . . . 0.0 113.485 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.2 t -65.63 -40.33 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 121.592 1.996 . . . . 0.0 112.809 169.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -66.2 -23.17 66.39 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 122.641 2.473 . . . . 0.0 116.961 170.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.279 72.7 mt -64.67 -52.84 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 125.188 2.423 . . . . 0.0 109.101 168.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.4 t -68.55 -29.33 43.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-N 113.208 -1.815 . . . . 0.0 111.879 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -63.59 -44.98 92.45 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 118.604 -2.56 . . . . 0.0 112.816 174.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -83.9 -10.97 57.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -178.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 21.5 mt -78.74 -41.23 31.3 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 120.542 -1.349 . . . . 0.0 109.878 166.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.2 -43.44 17.66 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 115.475 -2.203 . . . . 0.0 107.476 -166.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -62.59 -36.97 84.41 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.317 2.261 . . . . 0.0 112.258 166.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.84 14.29 81.67 Favored Glycine 0 C--N 1.336 0.568 0 CA-C-N 122.392 2.36 . . . . 0.0 116.082 162.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -81.58 -28.58 33.75 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 129.255 3.022 . . . . 0.0 112.955 173.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.8 mtt -100.69 141.39 33.64 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 123.9 1.809 . . . . 0.0 108.399 -174.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 93.2 p -93.95 165.17 12.79 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.778 165.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -56.35 -35.48 67.71 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 125.72 2.676 . . . . 0.0 116.094 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.1 tpt85 -73.59 -21.23 60.39 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.808 -2.433 . . . . 0.0 110.532 -177.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -79.22 -42.53 25.79 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 113.911 -2.947 . . . . 0.0 110.55 166.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 57.4 mt -70.77 -18.36 62.76 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 115.612 -2.435 . . . . 0.0 114.752 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -57.25 -34.75 68.93 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.736 2.014 . . . . 0.0 111.804 169.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -90.83 -59.57 2.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.186 1.794 . . . . 0.0 107.914 167.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -62.32 -26.71 68.57 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 128.552 2.741 . . . . 0.0 117.829 -166.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.5 mt -122.82 11.35 9.68 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.393 1.877 . . . . 0.0 114.383 165.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 57.52 20.53 38.46 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 120.309 1.413 . . . . 0.0 114.26 -171.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -79.99 139.03 37.17 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.128 1.771 . . . . 0.0 114.051 -161.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.42 103.57 1.53 Allowed Glycine 0 CA--C 1.523 0.56 0 C-N-CA 127.908 2.671 . . . . 0.0 109.571 172.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 67.6 mt -37.61 -48.83 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 128.877 2.871 . . . . 0.0 112.347 -179.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.32 -34.45 74.66 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 129.731 3.212 . . . . 0.0 110.972 -172.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.3 p -65.31 -45.81 82.85 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 119.24 -2.162 . . . . 0.0 111.788 167.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.0 mm -63.64 -32.06 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 O-C-N 117.604 -3.185 . . . . 0.0 110.952 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -49.97 -52.52 33.03 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 118.645 -2.534 . . . . 0.0 115.137 165.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -59.55 -42.29 92.05 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 125.32 1.638 . . . . 0.0 110.729 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.86 -40.67 99.15 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 113.06 -1.882 . . . . 0.0 113.65 -177.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.9 m -61.74 -34.9 76.65 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 113.529 -3.129 . . . . 0.0 110.877 171.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -75.8 -30.17 58.97 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 120.771 1.623 . . . . 0.0 114.561 177.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 17.8 m -68.39 -34.97 76.99 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 115.902 -1.999 . . . . 0.0 109.967 171.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.9 tp -77.58 -45.61 24.72 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 117.255 -1.355 . . . . 0.0 111.41 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -53.76 -45.64 70.69 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 130.264 3.425 . . . . 0.0 108.262 169.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.25 -34.94 75.97 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.073 1.749 . . . . 0.0 115.302 176.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.05 171.87 4.19 Favored Pre-proline 0 N--CA 1.447 -0.614 0 O-C-N 119.496 -2.003 . . . . 0.0 113.321 -168.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . 0.317 28.5 Cg_exo -67.79 131.74 24.95 Favored 'Trans proline' 0 N--CA 1.447 -1.258 1 C-N-CA 126.847 5.032 . . . . 0.0 116.615 178.514 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 m -45.08 -39.93 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 N-CA-C 117.838 2.533 . . . . 0.0 117.838 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.1 pm0 -75.93 -31.84 59.31 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 118.26 -2.775 . . . . 0.0 110.796 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.495 HD12 HD13 ' B' ' 34' ' ' LEU . 15.7 tp -64.87 -41.95 95.24 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 112.696 -3.526 . . . . 0.0 111.394 164.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 89.1 mtm-85 -64.53 -43.47 93.91 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 126.167 2.167 . . . . 0.0 111.572 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -56.32 -20.86 20.87 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.376 2.27 . . . . 0.0 113.752 170.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -94.78 -46.26 6.98 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 127.562 3.553 . . . . 0.0 110.378 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 29.2 mt -56.32 -26.69 53.2 Favored 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 115.373 -4.579 . . . . 0.0 111.263 171.515 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -70.65 -24.85 62.78 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 118.11 -2.869 . . . . 0.0 117.433 170.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -101.41 -4.17 27.4 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.29 1.836 . . . . 0.0 111.968 176.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . 0.301 59.6 t -122.67 -36.66 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -170.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.2 mt -82.36 -54.83 4.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 117.866 -3.021 . . . . 0.0 115.135 165.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.7 mt -70.08 -3.89 18.63 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.747 2.019 . . . . 0.0 112.832 -167.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.264 28.9 tttt -101.5 0.37 36.51 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 129.597 3.159 . . . . 0.0 113.694 -166.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.8 p -75.37 -9.03 58.2 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 120.102 3.371 . . . . 0.0 120.102 160.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.256 1.399 0 CA-C-O 123.981 1.848 . . . . 0.0 114.367 -166.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.2 tmm? . . . . . 0 N--CA 1.472 0.664 0 CA-C-O 115.565 -2.16 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -56.72 -24.72 51.56 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 122.232 2.287 . . . . 0.0 115.566 -165.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -75.85 -36.71 59.5 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 127.259 2.224 . . . . 0.0 109.015 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -92.25 -24.05 19.12 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 124.345 1.058 . . . . 0.0 111.529 -163.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -86.98 131.59 44.41 Favored Pre-proline 0 N--CA 1.446 -0.668 0 C-N-CA 128.438 2.695 . . . . 0.0 108.578 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -81.48 0.15 10.1 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 O-C-N 115.483 -2.956 . . . . 0.0 117.081 -174.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -123.88 135.46 53.74 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 126.311 2.257 . . . . 0.0 111.32 158.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.3 t -133.66 141.81 47.77 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 120.742 -1.224 . . . . 0.0 112.651 161.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.25 -39.91 84.32 Favored 'General case' 0 N--CA 1.448 -0.571 1 O-C-N 116.255 -4.028 . . . . 0.0 116.896 172.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.89 -43.8 82.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 125.95 2.031 . . . . 0.0 111.236 175.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 36.9 mtt -69.73 -34.77 74.31 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 114.152 -2.832 . . . . 0.0 110.402 176.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.68 -40.68 93.05 Favored 'General case' 0 N--CA 1.449 -0.509 1 O-C-N 130.196 4.685 . . . . 0.0 111.766 177.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 32.1 tp10 -65.46 -29.56 70.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 126.474 3.035 . . . . 0.0 116.86 171.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -68.36 -37.99 81.0 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 125.326 2.489 . . . . 0.0 116.761 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 51.9 mmt-85 -81.34 -20.0 41.61 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 115.036 -2.411 . . . . 0.0 111.078 176.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -61.53 -57.24 12.91 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 122.502 2.41 . . . . 0.0 108.064 162.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.35 -31.68 72.98 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 123.107 2.685 . . . . 0.0 116.767 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.69 -39.25 83.93 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 117.648 2.462 . . . . 0.0 117.648 165.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 11.8 t-105 -74.69 -46.91 34.64 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.708 2.003 . . . . 0.0 107.385 175.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 83.7 mt -58.93 -17.94 29.04 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 118.105 -2.872 . . . . 0.0 114.996 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . 0.381 49.4 ttt180 -67.55 -45.04 76.79 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.172 1.789 . . . . 0.0 113.527 168.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -60.03 -39.66 86.67 Favored 'General case' 0 N--CA 1.451 -0.4 1 O-C-N 115.997 -4.189 . . . . 0.0 119.492 165.026 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.01 -34.14 67.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-O 122.656 1.217 . . . . 0.0 110.738 176.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -61.88 -47.91 82.86 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 116.719 -3.738 . . . . 0.0 110.771 173.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 51.6 tp -62.79 -41.58 99.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.974 1.845 . . . . 0.0 109.061 -173.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.327 14.1 tp -76.46 -28.49 56.54 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 124.003 1.859 . . . . 0.0 115.917 -178.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -62.98 -37.52 87.46 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 119.04 -2.287 . . . . 0.0 111.987 164.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -79.41 -23.29 43.33 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 119.622 -1.924 . . . . 0.0 110.727 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.49 -32.34 32.5 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -69.61 -35.79 75.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 124.107 3.14 . . . . 0.0 113.921 167.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.33 -8.97 4.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 120.469 3.507 . . . . 0.0 120.469 159.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . 0.266 65.2 m-80 -128.74 9.79 5.95 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 116.389 -3.945 . . . . 0.0 110.002 -175.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.489 5.2 m-20 55.65 9.7 0.44 Allowed 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 121.137 3.754 . . . . 0.0 121.137 -168.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.495 HD13 HD12 ' A' ' 96' ' ' LEU . 25.3 mt -82.04 10.0 7.41 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 113.654 -1.612 . . . . 0.0 115.078 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . 0.266 18.5 p-80 -61.3 -49.92 75.07 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 119.801 -1.812 . . . . 0.0 112.783 -170.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.337 54.8 mt -63.07 -55.29 38.57 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-O 115.724 -2.084 . . . . 0.0 113.679 176.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -42.23 -36.24 4.01 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 N-CA-C 118.918 2.622 . . . . 0.0 118.918 168.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 58.6 tp -87.23 -28.35 22.42 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.141 0.428 . . . . 0.0 111.291 -176.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 19.8 mt -79.9 -34.07 39.37 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 120.833 -1.167 . . . . 0.0 113.362 172.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ASN . . . . . 0.44 ' HA ' ' NH1' ' B' ' 48' ' ' ARG . 86.8 m-20 -60.8 -42.97 98.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 113.309 -3.234 . . . . 0.0 108.032 167.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -61.89 -55.59 28.07 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 126.245 2.216 . . . . 0.0 112.14 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.0 mmt -82.85 -31.5 27.98 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 126.398 2.311 . . . . 0.0 114.759 -165.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 33.4 mt -108.3 127.13 53.59 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 104.715 -2.328 . . . . 0.0 104.715 -179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 24.3 p -69.59 157.4 89.64 Favored Pre-proline 0 N--CA 1.448 -0.538 0 C-N-CA 125.393 1.477 . . . . 0.0 113.741 172.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.67 -29.79 63.08 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 123.68 2.92 . . . . 0.0 115.721 -176.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.05 -21.04 43.91 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 125.244 1.59 . . . . 0.0 114.429 178.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -84.15 -28.11 27.65 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 169.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' ARG . . . . . 0.44 ' NH1' ' HA ' ' B' ' 40' ' ' ASN . 25.1 mtm180 -70.86 -46.77 62.09 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 117.703 -3.123 . . . . 0.0 107.076 171.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -58.72 -37.61 76.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.102 1.501 . . . . 0.0 114.007 170.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.88 -45.32 95.03 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 119.666 -1.896 . . . . 0.0 114.31 169.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 12.0 mt -68.51 -43.42 76.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 117.33 -1.748 . . . . 0.0 112.426 -174.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.11 -30.27 60.54 Favored Glycine 0 CA--C 1.525 0.715 0 O-C-N 125.427 1.704 . . . . 0.0 115.485 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.6 m -73.85 -44.41 55.66 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 174.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 38.2 mtt180 -60.56 -27.9 68.04 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.064 -3.523 . . . . 0.0 110.74 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 90.9 t -41.76 -62.75 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 123.245 2.748 . . . . 0.0 114.5 162.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 -71.13 -29.09 64.81 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -166.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 19.1 mt -71.45 -44.51 71.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 C-N-CA 126.795 2.038 . . . . 0.0 112.572 177.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 93.7 t -66.76 -41.8 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 124.332 2.015 . . . . 0.0 111.232 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -52.67 -49.19 65.75 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 115.343 1.608 . . . . 0.0 115.343 168.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . 0.254 22.8 tp10 -68.35 -30.45 69.42 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 113.169 -3.3 . . . . 0.0 109.798 174.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 8.5 mt -66.58 -25.11 66.47 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 123.353 2.797 . . . . 0.0 111.568 172.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 48.4 mt -86.61 -28.68 23.11 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 124.52 1.138 . . . . 0.0 109.614 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 28.5 ttm105 -83.02 -44.86 14.74 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 118.855 2.909 . . . . 0.0 118.855 -171.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.79 64.19 3.72 Favored Glycine 0 CA--C 1.522 0.47 0 O-C-N 119.256 -2.152 . . . . 0.0 114.638 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -128.39 -36.13 1.92 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 127.298 2.239 . . . . 0.0 109.077 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 60.0 mtp -81.16 134.31 35.61 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 118.526 -2.609 . . . . 0.0 116.117 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 88.5 p -84.29 174.41 10.17 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 125.322 1.639 . . . . 0.0 113.255 168.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -64.47 -36.47 84.3 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.293 -2.129 . . . . 0.0 113.657 -169.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -72.25 -35.88 68.91 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 120.029 -1.669 . . . . 0.0 112.923 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.72 -40.75 79.79 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 113.457 -1.701 . . . . 0.0 109.051 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 87.5 mt -58.93 -61.45 2.63 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.181 2.192 . . . . 0.0 112.21 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -53.58 -50.55 65.35 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 128.342 2.657 . . . . 0.0 112.974 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -104.14 -7.44 20.18 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 128.129 3.393 . . . . 0.0 109.764 -165.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -118.47 -7.04 10.7 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 125.201 3.637 . . . . 0.0 111.466 173.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 36.4 mt -122.09 -17.24 7.28 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 113.985 -2.912 . . . . 0.0 115.316 168.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.56 16.85 78.68 Favored Glycine 0 C--N 1.336 0.533 0 CA-C-N 125.08 3.582 . . . . 0.0 119.376 -168.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -105.23 71.03 0.92 Allowed 'General case' 0 N--CA 1.447 -0.58 1 C-N-CA 132.278 4.231 . . . . 0.0 106.571 -160.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.92 179.58 44.54 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 119.805 -1.188 . . . . 0.0 115.749 172.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 51.2 mm -44.85 -51.27 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-O 115.788 -2.054 . . . . 0.0 114.089 -171.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.8 -32.02 73.39 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.272 2.323 . . . . 0.0 117.272 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 2.9 m -66.59 -43.07 85.88 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 31.4 mm -70.08 -42.25 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 130.228 3.411 . . . . 0.0 113.432 168.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 26.3 m -59.17 -51.04 71.71 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 118.284 -2.76 . . . . 0.0 109.52 172.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -63.11 -42.58 99.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 114.916 -2.469 . . . . 0.0 113.077 175.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.84 -45.16 90.05 Favored Glycine 0 CA--C 1.522 0.499 0 O-C-N 125.703 1.877 . . . . 0.0 115.779 -176.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 88.2 p -62.88 -39.85 95.72 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 164.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -68.07 -37.46 81.28 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 117.074 -3.516 . . . . 0.0 112.469 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 48.1 m -74.41 -0.75 18.34 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 171.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mt -95.77 -43.52 7.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 128.271 2.628 . . . . 0.0 116.548 167.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 54.8 tttm -68.84 -31.76 70.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 123.003 0.521 . . . . 0.0 110.698 169.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.74 -14.72 60.33 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 129.554 3.141 . . . . 0.0 117.227 166.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.38 148.36 98.71 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-N 121.599 2.0 . . . . 0.0 108.9 165.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -72.71 151.53 52.04 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 122.598 2.198 . . . . 0.0 115.308 169.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.323 31.4 m -62.71 -34.84 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 O-C-N 118.892 -2.38 . . . . 0.0 117.362 -166.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -50.62 -34.51 26.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 128.204 2.602 . . . . 0.0 111.63 172.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 7.0 tp -97.23 -38.61 9.62 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 115.952 -1.975 . . . . 0.0 108.333 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 26.0 mtp85 -47.87 -51.91 21.25 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 121.748 2.067 . . . . 0.0 111.552 171.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -62.86 -28.64 70.17 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 117.365 2.357 . . . . 0.0 117.365 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -71.26 -60.4 2.25 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.35 1.86 . . . . 0.0 110.702 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 96.4 mt -54.49 -43.79 72.09 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -66.48 -13.94 61.55 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -104.19 -8.51 19.34 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 126.478 1.911 . . . . 0.0 114.134 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 39.4 t -111.55 -43.55 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 123.38 1.562 . . . . 0.0 107.875 -177.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.96 -47.17 39.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 116.948 -3.595 . . . . 0.0 109.567 -178.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 84.0 mt -72.25 -24.25 61.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 117.75 -1.58 . . . . 0.0 112.701 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -90.25 -8.97 49.66 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 119.373 -2.08 . . . . 0.0 111.329 -178.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.3 m -71.89 -22.77 61.46 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 165.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.394 61.9 m-20 . . . . . 0 C--O 1.249 1.036 0 N-CA-C 117.117 2.266 . . . . 0.0 117.117 161.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ttt . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.61 170.36 15.93 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.454 -1.299 . . . . 0.0 113.832 172.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -130.81 149.72 52.32 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 113.485 -1.689 . . . . 0.0 108.542 177.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -121.48 153.49 37.86 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 124.155 3.161 . . . . 0.0 109.492 177.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 94.9 p -143.85 169.7 9.84 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 172.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -89.8 -27.24 0.34 Allowed 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 116.873 -1.618 . . . . 0.0 114.333 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -140.88 144.29 35.17 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 117.167 -1.397 . . . . 0.0 114.16 176.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.7 t -148.06 118.53 7.42 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 125.335 1.647 . . . . 0.0 113.243 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.71 -12.31 2.85 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 157.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.87 -40.76 95.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 123.485 2.857 . . . . 0.0 115.399 163.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 39.2 mtt -79.38 -36.98 38.4 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 124.067 1.889 . . . . 0.0 110.513 -172.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.06 -36.04 60.18 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 128.549 2.74 . . . . 0.0 112.158 175.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -79.58 -37.69 35.74 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 119.4 -2.063 . . . . 0.0 109.724 175.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -70.56 -43.79 68.77 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 120.36 1.437 . . . . 0.0 112.334 -178.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -30.69 71.59 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 119.269 -2.144 . . . . 0.0 114.09 174.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -72.78 -48.38 38.73 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 126.6 2.437 . . . . 0.0 110.964 171.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -61.47 -24.01 66.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 112.748 -3.501 . . . . 0.0 113.871 171.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -59.65 -39.01 82.98 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 123.794 2.997 . . . . 0.0 115.999 164.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -78.22 -41.3 34.8 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.067 -1.424 . . . . 0.0 110.58 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 4.8 mp -67.12 -17.69 64.98 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 119.927 -1.733 . . . . 0.0 110.715 174.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -82.98 -38.56 22.52 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 118.159 -2.838 . . . . 0.0 116.668 175.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 22' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' D' ' 51' ' ' LEU . 73.8 t80 -55.46 -38.79 69.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 113.383 -1.735 . . . . 0.0 110.405 165.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 5.6 t -70.6 -41.94 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 O-C-N 118.91 -2.369 . . . . 0.0 108.466 -177.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -72.71 -25.62 61.3 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 119.077 2.991 . . . . 0.0 119.077 176.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 49.1 tp -71.63 -40.49 69.71 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 52.7 tp -69.35 -40.28 77.61 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -44.0 -51.5 7.71 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 123.342 1.544 . . . . 0.0 114.187 178.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -79.67 -13.4 59.51 Favored 'General case' 0 N--CA 1.45 -0.425 0 O-C-N 119.311 -2.118 . . . . 0.0 113.269 -175.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.31 -28.49 61.19 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 120.977 1.717 . . . . 0.0 114.968 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -65.19 -22.97 66.97 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 117.867 -3.021 . . . . 0.0 109.598 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.79 -20.74 61.1 Favored 'General case' 0 N--CA 1.448 -0.564 1 O-C-N 113.869 -5.519 . . . . 0.0 110.947 -166.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -126.66 30.4 5.53 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 118.545 -2.597 . . . . 0.0 113.677 168.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 42.16 44.84 3.33 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 129.151 2.98 . . . . 0.0 115.262 -173.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.264 95.9 mt -93.55 -10.0 36.3 Favored 'General case' 0 N--CA 1.448 -0.549 1 C-N-CA 132.125 4.17 . . . . 0.0 109.71 172.801 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 29.4 p-80 -47.9 -41.81 25.39 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 130.947 3.699 . . . . 0.0 109.653 168.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mt -76.34 -52.35 2.37 Favored Pre-proline 0 N--CA 1.45 -0.452 1 O-C-N 115.612 -4.43 . . . . 0.0 117.074 174.181 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -49.43 -33.58 30.2 Favored 'Trans proline' 0 N--CA 1.448 -1.174 0 C-N-CA 123.751 2.967 . . . . 0.0 118.54 164.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 18.8 tp -65.74 -39.18 90.85 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.005 -2.309 . . . . 0.0 115.337 168.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 66.9 mt -84.8 -16.22 42.2 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.986 2.175 . . . . 0.0 115.422 172.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -85.38 -5.12 59.33 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 129.336 3.054 . . . . 0.0 113.816 163.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 54.7 tp -91.77 -64.59 1.1 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 116.025 -1.941 . . . . 0.0 110.971 156.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -83.46 -5.83 59.28 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 119.642 3.201 . . . . 0.0 119.642 -162.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mp -114.85 155.06 27.49 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 112.731 -2.032 . . . . 0.0 111.915 162.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 44' ' ' THR . . . . . 0.427 ' HB ' ' CD ' ' C' ' 45' ' ' PRO . 58.6 p -94.23 173.56 4.51 Favored Pre-proline 0 N--CA 1.449 -0.495 0 C-N-CA 129.965 3.306 . . . . 0.0 110.624 166.055 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 45' ' ' PRO . . . . . 0.427 ' CD ' ' HB ' ' C' ' 44' ' ' THR . 16.8 Cg_exo -70.91 -30.91 16.23 Favored 'Trans proline' 0 N--CA 1.451 -0.989 1 C-N-CA 125.815 4.344 . . . . 0.0 111.385 -168.109 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -43.59 97.01 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.073 2.149 . . . . 0.0 108.44 178.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -71.53 -24.12 61.89 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.132 1.373 . . . . 0.0 114.465 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 82.8 mtm-85 -80.28 -33.02 38.04 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 117.156 -3.465 . . . . 0.0 108.968 170.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -64.76 -42.77 94.89 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 123.226 1.488 . . . . 0.0 113.827 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.79 -56.58 18.79 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 128.705 2.802 . . . . 0.0 109.671 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 79.9 mt -56.6 -39.81 74.23 Favored 'General case' 0 N--CA 1.446 -0.641 1 O-C-N 116.146 -4.096 . . . . 0.0 116.823 170.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.63 -18.89 46.74 Favored Glycine 0 N--CA 1.448 -0.506 0 O-C-N 119.643 -1.91 . . . . 0.0 114.598 170.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 19.7 m -92.5 -43.54 9.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 112.945 -1.628 . . . . 0.0 110.714 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -63.68 -37.65 88.15 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.61 -2.138 . . . . 0.0 107.747 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 6.8 t -52.9 -47.49 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-N 124.332 3.242 . . . . 0.0 114.346 170.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -65.36 -38.39 89.92 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 115.68 -2.105 . . . . 0.0 114.254 173.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 20.8 mt -65.14 -45.43 94.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 123.294 2.77 . . . . 0.0 107.316 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 24.3 t -57.95 -37.87 63.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 115.503 -2.189 . . . . 0.0 112.171 167.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -70.92 -41.27 71.43 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 124.159 3.163 . . . . 0.0 113.324 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -66.48 -36.33 82.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 114.402 -2.713 . . . . 0.0 111.427 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 63.7 mt -70.94 -37.62 72.85 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 122.688 2.495 . . . . 0.0 114.276 172.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 35.8 mt -77.53 -22.23 51.44 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 114.645 -2.822 . . . . 0.0 109.9 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -67.34 -51.64 49.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.069 -2.269 . . . . 0.0 112.502 165.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.27 21.02 74.19 Favored Glycine 0 CA--C 1.521 0.429 0 O-C-N 117.824 -3.048 . . . . 0.0 118.483 177.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . 0.501 30.6 tt0 -83.48 40.35 0.72 Allowed 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 128.425 2.69 . . . . 0.0 113.995 171.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 23.2 mmt -110.42 119.19 38.39 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -173.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 85.1 p -80.75 160.06 25.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.291 -3.381 . . . . 0.0 113.46 161.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.98 -30.2 61.41 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 119.275 -2.141 . . . . 0.0 112.718 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . 0.253 35.9 ttp-105 -58.7 -45.21 90.03 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 119.966 3.321 . . . . 0.0 119.966 161.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -76.16 -29.58 57.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 126.569 2.418 . . . . 0.0 112.03 -177.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.92 -16.66 52.6 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 117.326 -3.359 . . . . 0.0 115.799 171.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -98.74 -69.58 0.76 Allowed 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 172.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -74.87 -10.92 59.96 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.618 -3.176 . . . . 0.0 113.679 -164.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -106.32 -35.57 7.11 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 120.301 1.41 . . . . 0.0 110.896 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.5 mp -88.81 -28.23 20.57 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 116.776 -1.583 . . . . 0.0 113.165 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 76' ' ' GLY . . . . . 0.436 ' O ' HG22 ' C' ' 79' ' ' ILE . . . 54.66 -122.85 26.56 Favored Glycine 0 C--N 1.336 0.577 1 C-N-CA 130.95 4.119 . . . . 0.0 114.79 -173.574 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.2 -23.99 37.76 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 126.121 1.768 . . . . 0.0 113.301 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.68 -14.7 77.86 Favored Glycine 0 CA--C 1.526 0.74 0 O-C-N 128.617 3.698 . . . . 0.0 117.198 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 79' ' ' ILE . . . . . 0.436 HG22 ' O ' ' C' ' 76' ' ' GLY . 17.4 tt -51.4 -55.94 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 155.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 80' ' ' ALA . . . . . 0.425 ' HB1' ' HD3' ' C' ' 84' ' ' ARG . . . -69.31 -25.85 64.43 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 119.327 -2.108 . . . . 0.0 111.724 -177.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 1.4 m -68.92 -27.91 66.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.916 1.686 . . . . 0.0 113.171 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 19.5 mm -98.33 -36.55 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 O-C-N 125.538 1.774 . . . . 0.0 114.075 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 78.1 p -91.95 -24.33 19.3 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -170.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 84' ' ' ARG . . . . . 0.425 ' HD3' ' HB1' ' C' ' 80' ' ' ALA . 71.9 mtp85 -93.6 161.09 14.49 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 130.654 3.582 . . . . 0.0 112.053 177.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.06 169.28 41.38 Favored Glycine 0 CA--C 1.524 0.642 0 O-C-N 118.706 -2.496 . . . . 0.0 116.879 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 25.5 m -64.26 -33.93 76.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 119.048 2.981 . . . . 0.0 119.048 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -93.78 28.66 2.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 126.649 2.468 . . . . 0.0 113.749 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 8.0 p -75.15 159.17 31.95 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.766 -2.459 . . . . 0.0 108.27 -172.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 30.3 tp -44.13 -54.7 5.35 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.833 2.453 . . . . 0.0 113.1 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -82.73 2.45 33.72 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 120.893 1.679 . . . . 0.0 112.663 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -124.03 -16.4 6.55 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.376 1.87 . . . . 0.0 113.054 -172.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.53 152.9 88.36 Favored Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 130.536 3.534 . . . . 0.0 114.822 163.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -66.01 158.98 51.44 Favored 'Trans proline' 0 N--CA 1.446 -1.295 0 O-C-N 115.515 -2.939 . . . . 0.0 117.926 -167.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 89.3 t -65.9 -43.63 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 117.948 -1.025 . . . . 0.0 108.648 -170.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.3 pm0 -60.88 -23.05 64.89 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 116.194 -1.86 . . . . 0.0 112.229 -178.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 18.3 tp -76.86 -49.71 15.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.254 1.822 . . . . 0.0 108.745 169.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 67.6 mtp180 -71.84 -42.44 66.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 118.695 -2.503 . . . . 0.0 111.208 -167.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -50.05 -50.0 49.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 128.794 2.838 . . . . 0.0 108.783 167.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 90.6 t90 -63.31 -41.25 98.91 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 127.998 3.311 . . . . 0.0 117.467 -178.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 81.3 mt -51.79 -36.67 48.54 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 117.077 -1.44 . . . . 0.0 114.349 168.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -80.94 -24.57 38.03 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.774 1.296 . . . . 0.0 113.708 172.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -71.12 -14.23 62.22 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 119.944 1.247 . . . . 0.0 111.162 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 72.9 t -112.03 -61.3 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-O 115.221 -2.324 . . . . 0.0 112.454 176.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 31.6 mt -66.05 -32.43 73.9 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 121.58 1.991 . . . . 0.0 115.398 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 84.9 mt -136.83 62.82 1.59 Allowed 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.662 1.585 . . . . 0.0 111.185 -168.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.281 15.2 pttp -98.42 173.83 6.76 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 112.262 -2.244 . . . . 0.0 112.595 -174.217 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 6.7 m -132.79 2.21 3.69 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 173.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 35.4 t0 . . . . . 0 C--O 1.251 1.166 0 O-C-N 117.347 -3.346 . . . . 0.0 111.646 172.846 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 6.5 ttt . . . . . 0 N--CA 1.468 0.475 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.62 165.59 35.11 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.047 1.339 . . . . 0.0 110.428 -167.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -128.82 140.51 51.67 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 118.496 -2.628 . . . . 0.0 107.683 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -143.95 125.15 14.56 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 117.339 2.348 . . . . 0.0 117.339 172.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 78.2 p -100.38 154.79 37.0 Favored Pre-proline 0 N--CA 1.452 -0.357 0 C-N-CA 125.392 1.477 . . . . 0.0 114.41 -173.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -50.18 -38.71 51.47 Favored 'Trans proline' 0 N--CA 1.446 -1.322 1 C-N-CA 125.585 4.19 . . . . 0.0 109.728 170.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -153.24 147.22 25.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 128.325 2.65 . . . . 0.0 108.889 178.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 12.7 t -92.66 140.37 29.6 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 120.382 1.446 . . . . 0.0 113.935 -175.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.6 -17.47 64.13 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 120.558 -1.339 . . . . 0.0 112.939 173.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.28 -35.74 66.21 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 120.653 -1.28 . . . . 0.0 111.194 167.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 14.8 mmm -72.01 -47.86 48.85 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 127.311 2.244 . . . . 0.0 114.193 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.97 -59.97 2.05 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.279 2.632 . . . . 0.0 112.263 169.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -67.43 -37.56 83.19 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 116.648 -1.644 . . . . 0.0 113.909 173.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -57.69 -22.54 46.68 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 121.705 2.048 . . . . 0.0 114.286 164.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER -93.88 -4.67 49.56 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 125.13 3.605 . . . . 0.0 106.74 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -90.19 -21.13 22.33 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 122.683 2.492 . . . . 0.0 114.81 153.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . 0.305 75.3 mm-40 -92.41 -36.14 13.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 123.876 1.798 . . . . 0.0 110.13 -166.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -46.6 -36.27 6.75 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 127.201 2.201 . . . . 0.0 111.807 161.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 19' ' ' TRP . . . . . 0.456 ' CZ3' ' CD1' ' D' ' 22' ' ' PHE 0.254 4.7 t-105 -85.14 -36.32 21.16 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 118.778 -2.451 . . . . 0.0 114.658 -177.564 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 50.7 mt -70.95 -22.75 62.17 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 120.037 -1.664 . . . . 0.0 113.05 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -66.51 -32.19 73.38 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 164.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 22' ' ' PHE . . . . . 0.456 ' CD1' ' CZ3' ' D' ' 19' ' ' TRP 0.297 13.8 t80 -66.76 -55.26 15.79 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 121.049 1.75 . . . . 0.0 107.728 173.86 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 61.1 t -57.83 -36.33 55.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 117.057 -1.449 . . . . 0.0 110.123 -172.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . 0.281 22.1 t70 -84.92 -28.38 25.96 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 125.745 1.618 . . . . 0.0 112.637 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 23.8 tp -66.27 -53.59 35.0 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 170.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 26' ' ' LEU . . . . . 0.558 ' O ' ' HB3' ' D' ' 29' ' ' ALA . 57.7 tp -55.33 -38.55 68.87 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 114.386 -2.721 . . . . 0.0 112.123 -178.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp -66.96 -37.35 84.12 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 127.124 2.765 . . . . 0.0 112.895 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -72.17 -29.98 64.54 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 113.535 -1.666 . . . . 0.0 113.143 171.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 29' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' D' ' 26' ' ' LEU . . . -60.3 -35.91 76.66 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 126.217 1.807 . . . . 0.0 115.591 164.219 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -73.39 -11.03 60.34 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 123.553 1.645 . . . . 0.0 113.734 172.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -102.36 -2.47 28.85 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 112.308 -3.71 . . . . 0.0 116.266 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 52.1 p30 -137.4 10.63 2.97 Favored 'General case' 0 N--CA 1.448 -0.55 1 O-C-N 129.228 4.08 . . . . 0.0 117.857 169.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 66.28 33.93 6.84 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 117.627 2.455 . . . . 0.0 117.627 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 20.2 mt -103.24 7.69 38.45 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.553 1.541 . . . . 0.0 111.485 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.42 -49.18 77.07 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 130.762 3.625 . . . . 0.0 112.541 174.196 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 18.0 mt -71.37 -45.68 13.59 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-N 122.729 2.513 . . . . 0.0 110.486 -178.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.259 82.4 Cg_exo -61.26 -32.47 90.3 Favored 'Trans proline' 0 N--CA 1.45 -1.085 1 C-N-CA 125.465 4.11 . . . . 0.0 115.982 173.745 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 34.6 tp -72.46 -45.59 58.84 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 118.836 -2.415 . . . . 0.0 110.726 174.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 11.3 mt -70.02 -27.85 65.01 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 117.575 -3.203 . . . . 0.0 112.53 176.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -76.85 -30.39 56.29 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 118.046 -2.909 . . . . 0.0 115.195 172.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 56.9 tp -57.97 -46.43 85.15 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 157.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.0 mmt -82.59 -37.7 24.68 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.064 -1.023 . . . . 0.0 112.695 -165.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 64.0 mt -114.63 137.42 51.91 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 114.691 -2.576 . . . . 0.0 111.957 -165.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 42.7 p -78.27 168.16 29.72 Favored Pre-proline 0 N--CA 1.449 -0.493 0 O-C-N 125.421 1.701 . . . . 0.0 112.342 -176.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -52.34 -32.9 53.57 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-N 123.164 2.166 . . . . 0.0 117.631 -174.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -91.49 -32.12 15.7 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 127.028 2.131 . . . . 0.0 112.805 -172.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -58.36 -39.75 80.38 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.05 1.34 . . . . 0.0 113.318 168.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 31.2 mtm-85 -64.26 -52.6 57.89 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.589 2.356 . . . . 0.0 108.491 169.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -54.28 -35.99 63.18 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 127.535 3.022 . . . . 0.0 114.082 174.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.22 -36.91 66.55 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 119.615 -1.928 . . . . 0.0 114.374 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 51' ' ' LEU . . . . . 0.444 ' HB3' ' CE2' ' C' ' 22' ' ' PHE . 43.5 mt -72.15 -45.73 59.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 119.211 -2.181 . . . . 0.0 113.412 -179.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.3 -42.41 99.77 Favored Glycine 0 C--N 1.338 0.676 0 C-N-CA 125.16 1.362 . . . . 0.0 110.572 166.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 36.2 m -60.67 -33.86 73.47 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 124.175 3.988 . . . . 0.0 114.504 169.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.4 61.2 mtt180 -52.99 -27.12 17.67 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 118.038 -2.914 . . . . 0.0 116.993 166.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 76.4 t -69.2 -50.5 52.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-O 114.75 -2.548 . . . . 0.0 107.377 175.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 56' ' ' ARG . . . . . 0.4 ' HG2' ' H ' ' D' ' 56' ' ' ARG . 3.2 ptm180 -68.02 -35.9 79.05 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 125.601 3.819 . . . . 0.0 110.67 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 57' ' ' ILE . . . . . 0.41 HD13 HG21 ' D' ' 57' ' ' ILE . 59.4 mt -52.48 -53.8 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 120.56 1.527 . . . . 0.0 109.877 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 69.6 t -67.66 -44.96 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 O-C-N 117.136 -3.478 . . . . 0.0 106.234 -175.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -49.67 -41.72 43.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.043 -2.286 . . . . 0.0 116.427 168.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . 0.254 45.1 mm-40 -76.28 -24.3 54.44 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 125.802 1.939 . . . . 0.0 110.73 178.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 48.0 mt -76.74 -44.78 31.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 119.29 -2.131 . . . . 0.0 110.447 176.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . 0.261 30.6 mt -62.11 -25.79 67.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.957 1.703 . . . . 0.0 114.213 168.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 37.4 ttm180 -84.99 -41.41 15.86 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 119.924 -1.735 . . . . 0.0 111.547 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 41.03 64.71 1.21 Allowed Glycine 0 CA--C 1.522 0.478 0 C-N-CA 126.524 2.011 . . . . 0.0 116.797 -174.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -130.95 -36.81 1.33 Allowed 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 131.121 3.768 . . . . 0.0 112.457 177.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 13.4 mmt -85.37 49.08 1.68 Allowed 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 130.04 3.336 . . . . 0.0 108.322 166.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 53.3 p -69.64 165.3 21.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 124.549 2.119 . . . . 0.0 115.583 -168.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 56.62 -103.42 0.18 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 117.594 2.442 . . . . 0.0 117.594 158.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -53.44 -45.06 69.33 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 114.306 -2.759 . . . . 0.0 114.48 168.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -82.03 -40.1 22.55 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 123.682 2.946 . . . . 0.0 110.314 -166.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.63 -30.74 14.16 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 118.146 2.647 . . . . 0.0 118.146 165.35 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -86.2 -46.85 9.99 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 116.792 2.145 . . . . 0.0 116.792 169.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -74.74 -45.81 41.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 115.278 -2.296 . . . . 0.0 110.9 -175.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -119.0 -32.55 4.43 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 120.085 1.311 . . . . 0.0 112.788 -160.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.258 1.3 mm? -72.73 -28.85 62.89 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 116.131 -1.89 . . . . 0.0 109.24 157.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 105.68 -174.35 20.88 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-O 125.63 2.795 . . . . 0.0 106.959 151.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.254 . . -58.72 -9.2 1.61 Allowed 'General case' 0 N--CA 1.45 -0.47 1 C-N-CA 133.719 4.808 . . . . 0.0 119.596 171.2 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.87 -21.79 65.81 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 115.243 0.857 . . . . 0.0 115.243 164.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 3.7 tt -38.06 -31.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 127.031 2.132 . . . . 0.0 115.672 172.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.54 -7.25 13.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 118.283 -2.761 . . . . 0.0 114.924 -171.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 47.3 m -66.89 -44.02 81.94 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.536 150.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 15.7 mm -68.09 -35.85 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 129.164 2.986 . . . . 0.0 114.328 168.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 68.4 p -119.75 8.1 11.12 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 123.868 3.031 . . . . 0.0 116.692 -175.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.2 mtp85 -115.76 170.54 8.38 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 121.744 2.066 . . . . 0.0 113.848 149.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.11 156.12 32.38 Favored Glycine 0 C--N 1.334 0.464 0 CA-C-O 123.794 1.775 . . . . 0.0 111.659 -166.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 53.1 p -78.16 -5.91 53.17 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 -156.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -138.89 41.24 2.14 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 128.839 2.856 . . . . 0.0 109.944 169.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 12.7 p -56.67 174.51 0.15 Allowed 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 129.271 3.028 . . . . 0.0 107.586 164.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp -66.38 -24.76 66.54 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 118.021 -2.925 . . . . 0.0 111.145 174.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 36.8 tttt -76.65 0.75 19.13 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 167.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -130.86 5.32 4.58 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 115.069 -2.396 . . . . 0.0 115.09 -176.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 92' ' ' ALA . . . . . 0.57 ' HA ' ' C ' ' D' ' 93' ' ' PRO 0.376 . . 48.33 76.5 0.54 Allowed Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 119.252 3.056 . . . . 0.0 119.252 140.939 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 93' ' ' PRO . . . . . 0.57 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 76.8 Cg_exo 33.01 28.4 0.0 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.985 0 CA-C-N 123.543 2.301 . . . . 0.0 113.665 36.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 94' ' ' VAL . . . . . 0.42 ' H ' ' C ' ' D' ' 92' ' ' ALA . 3.6 t -50.76 -21.93 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 C-N-CA 125.784 1.634 . . . . 0.0 108.781 166.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 95' ' ' GLU . . . . . 0.46 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.333 0.0 OUTLIER -103.47 -35.92 8.17 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.948 1.699 . . . . 0.0 111.919 -169.082 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 27.4 tp -50.86 -54.24 25.6 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 117.445 -1.702 . . . . 0.0 110.031 151.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 -60.48 -46.02 91.62 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 128.582 2.753 . . . . 0.0 113.816 -169.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -75.1 -12.99 60.43 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 116.957 -3.589 . . . . 0.0 116.927 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 64.5 t90 -77.47 -48.41 17.19 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 117.144 -1.408 . . . . 0.0 110.81 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 38.9 mt -58.24 -34.68 70.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 126.742 2.526 . . . . 0.0 108.33 169.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -60.97 -31.74 71.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.298 2.239 . . . . 0.0 114.018 175.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -97.97 -23.12 15.94 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 119.681 -1.887 . . . . 0.0 112.884 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.254 49.0 t -78.19 -23.57 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 CA-C-N 121.702 2.047 . . . . 0.0 111.488 167.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 78.7 mt -120.75 -20.1 7.13 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 -163.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 67.7 mt -115.44 29.72 7.82 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.252 2.221 . . . . 0.0 107.188 166.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -52.6 167.32 0.15 Allowed 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.713 2.805 . . . . 0.0 115.704 173.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 53.8 m -40.35 -50.26 2.81 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 119.524 3.157 . . . . 0.0 119.524 -175.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 . . . . . 0 C--O 1.245 0.832 0 C-N-CA 126.055 1.742 . . . . 0.0 113.944 177.54 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.254 1.1 tmt? . . . . . 0 N--CA 1.47 0.541 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.39 -43.9 97.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 116.352 -1.785 . . . . 0.0 113.35 177.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -69.95 -9.98 56.97 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 124.699 3.409 . . . . 0.0 113.272 -175.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -106.22 -42.64 5.01 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 116.493 -3.879 . . . . 0.0 107.658 -171.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.6 m -73.32 117.44 60.35 Favored Pre-proline 0 N--CA 1.446 -0.641 0 C-N-CA 126.72 2.008 . . . . 0.0 108.643 -163.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -71.82 0.64 6.78 Favored 'Trans proline' 0 N--CA 1.449 -1.113 1 C-N-CA 127.406 5.404 . . . . 0.0 110.469 -165.078 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -155.99 151.73 27.29 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 117.711 -3.118 . . . . 0.0 112.279 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.9 t -142.36 111.62 6.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.242 1.417 . . . . 0.0 107.208 -174.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.96 -36.47 81.54 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 125.274 1.609 . . . . 0.0 113.075 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.67 -31.25 64.92 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 119.4 -2.063 . . . . 0.0 115.042 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.2 ttt -67.53 -47.12 70.81 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.004 0.922 . . . . 0.0 111.02 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -37.62 74.78 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.215 -0.902 . . . . 0.0 112.915 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -64.97 -37.19 86.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 120.027 -1.671 . . . . 0.0 110.915 166.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -55.33 -49.34 72.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 117.231 -3.418 . . . . 0.0 111.141 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -74.53 -17.84 60.69 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.769 -177.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -65.84 -49.74 67.1 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 118.914 -1.115 . . . . 0.0 110.85 168.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -70.12 -24.78 63.24 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.332 2.345 . . . . 0.0 117.332 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -67.31 -41.93 84.54 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.756 2.423 . . . . 0.0 109.808 170.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . 0.261 3.0 t-105 -74.51 -44.1 52.86 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.977 -2.327 . . . . 0.0 113.456 174.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 15.4 mt -67.07 -29.27 68.99 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 117.527 -1.669 . . . . 0.0 112.061 -176.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 25.8 ttt180 -30.14 -63.05 0.14 Allowed 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 116.437 2.014 . . . . 0.0 116.437 153.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -53.95 -37.07 63.51 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 116.326 1.972 . . . . 0.0 116.326 173.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.279 2.7 t -69.51 -40.62 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 125.406 1.482 . . . . 0.0 112.282 -176.056 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -68.54 -50.68 50.13 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 116.203 -1.856 . . . . 0.0 109.329 167.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.429 ' CD1' HG11 ' B' ' 103' ' ' VAL . 22.0 tp -53.26 -40.15 64.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 123.536 2.88 . . . . 0.0 111.506 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.47 HD11 ' CE2' ' A' ' 30' ' ' TYR . 14.3 tp -76.74 -30.16 56.47 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 120.103 1.319 . . . . 0.0 111.526 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -62.74 -47.67 82.56 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 166.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -53.97 -38.81 65.39 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.38 -2.724 . . . . 0.0 111.028 165.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.94 -38.81 57.21 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 122.834 2.561 . . . . 0.0 110.964 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.47 ' CE2' HD11 ' A' ' 26' ' ' LEU . 28.2 m-85 -67.49 -35.42 79.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 118.732 -2.48 . . . . 0.0 109.02 176.056 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -66.59 -10.78 49.03 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 173.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -115.8 7.22 14.52 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.384 1.073 . . . . 0.0 112.242 177.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.28 24.7 m-20 60.88 14.91 5.56 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 121.474 3.879 . . . . 0.0 121.474 -171.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.1 mt -101.03 13.49 35.03 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 119.624 -1.922 . . . . 0.0 113.648 -175.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.434 ' CG ' ' CD1' ' A' ' 30' ' ' TYR . 19.8 p-80 -55.2 -53.38 56.8 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.822 -2.423 . . . . 0.0 113.381 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.9 mt -70.09 -47.33 21.74 Favored Pre-proline 0 N--CA 1.445 -0.716 0 CA-C-N 123.547 2.885 . . . . 0.0 111.039 -178.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -41.87 -47.81 6.28 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.299 2.666 . . . . 0.0 114.524 168.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 27.4 tp -66.56 -55.47 15.28 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 112.887 -1.96 . . . . 0.0 113.419 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 29.0 mt -61.71 -21.92 64.9 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 119.702 1.137 . . . . 0.0 112.37 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -73.63 -31.95 63.79 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.084 1.754 . . . . 0.0 109.549 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.87 -39.48 43.19 Favored 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 133.915 4.886 . . . . 0.0 115.993 169.229 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.3 mmm -73.58 -32.13 63.97 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 129.066 2.946 . . . . 0.0 113.241 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.4 mt -127.59 120.6 28.54 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.132 1.373 . . . . 0.0 108.724 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.4 p -53.79 163.01 1.19 Allowed Pre-proline 0 N--CA 1.45 -0.465 0 CA-C-N 114.836 -1.074 . . . . 0.0 113.418 172.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -64.86 -28.11 58.92 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 CA-C-N 121.965 1.737 . . . . 0.0 115.93 -172.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -77.23 -27.2 53.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.73 2.122 . . . . 0.0 116.73 177.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -72.17 -39.56 68.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.625 1.97 . . . . 0.0 114.07 172.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.6 mtm-85 -55.96 -46.58 78.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 168.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -49.26 -54.05 18.72 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 119.568 -1.958 . . . . 0.0 113.173 169.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.31 -50.08 55.98 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 114.934 -2.46 . . . . 0.0 107.464 -172.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.9 mt -54.4 -33.42 59.28 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 124.443 3.292 . . . . 0.0 115.707 171.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.24 -47.06 92.35 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 127.928 2.68 . . . . 0.0 114.566 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.0 m -60.11 -27.3 66.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 114.857 -2.497 . . . . 0.0 112.331 163.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -81.61 -23.49 37.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 125.429 1.706 . . . . 0.0 110.795 -173.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 51.6 t -57.36 -45.22 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-O 115.795 -2.05 . . . . 0.0 107.992 167.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.29 11.6 ttt180 -63.26 -37.75 88.45 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 126.779 2.032 . . . . 0.0 110.707 173.809 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 28.6 mt -57.79 -42.82 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 O-C-N 117.422 -3.299 . . . . 0.0 112.358 174.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.5 t -65.19 -48.25 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 O-C-N 119.178 -2.201 . . . . 0.0 112.458 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -57.27 -47.99 80.03 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.904 1.282 . . . . 0.0 110.526 178.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -69.0 -44.15 73.37 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 115.202 -2.333 . . . . 0.0 114.623 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.1 mt -67.63 -27.13 66.63 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 120.61 1.55 . . . . 0.0 113.997 177.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 tp -77.59 -47.66 18.84 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.359 1.464 . . . . 0.0 108.915 177.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.3 ttm105 -53.96 -35.42 61.75 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 169.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.33 -9.24 14.42 Favored Glycine 0 C--N 1.334 0.45 0 C-N-CA 129.25 3.309 . . . . 0.0 117.259 169.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -60.25 -22.51 63.15 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 127.458 2.303 . . . . 0.0 116.084 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 41.4 mtt -95.4 140.83 29.72 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 126.176 1.79 . . . . 0.0 114.915 175.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.8 p -93.44 176.87 6.22 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 127.628 2.371 . . . . 0.0 109.906 174.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -69.16 -31.88 70.83 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 119.368 -2.082 . . . . 0.0 111.482 169.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.5 tpt85 -62.27 -27.52 69.07 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 167.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -90.67 -40.04 12.11 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 117.265 -1.35 . . . . 0.0 111.763 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.4 mt -63.56 -30.21 71.36 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 120.153 1.342 . . . . 0.0 109.997 176.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -56.86 -25.48 56.63 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -95.79 -54.32 3.38 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 126.2 1.8 . . . . 0.0 111.861 172.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -65.73 -47.81 74.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 118.219 -2.801 . . . . 0.0 114.439 -170.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.3 mt -108.73 -0.34 20.07 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.535 -171.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.86 21.36 73.2 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 119.841 1.2 . . . . 0.0 114.106 -171.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.08 133.1 33.64 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 116.434 2.013 . . . . 0.0 116.434 -165.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.57 129.46 9.13 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-O 114.562 -3.354 . . . . 0.0 111.601 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 83.8 mt -61.48 -17.77 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 1 O-C-N 131.356 4.798 . . . . 0.0 111.477 -164.038 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -77.19 -28.38 53.93 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.852 2.569 . . . . 0.0 113.361 169.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 26.4 p -84.69 -25.38 28.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 118.067 -1.453 . . . . 0.0 109.855 -173.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 51.1 mm -69.92 -43.29 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-O 113.886 -2.959 . . . . 0.0 109.619 166.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.6 m -49.75 -52.05 34.5 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 122.981 2.628 . . . . 0.0 113.347 168.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.277 42.7 ttt180 -62.45 -29.62 70.65 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 113.779 -3.01 . . . . 0.0 115.396 175.063 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.64 -36.86 41.84 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 122.216 2.28 . . . . 0.0 117.696 166.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 16.3 m -61.35 -44.35 97.33 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 114.988 -2.434 . . . . 0.0 114.223 173.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -58.27 -37.85 75.8 Favored 'General case' 0 N--CA 1.448 -0.527 1 O-C-N 129.186 4.054 . . . . 0.0 112.02 165.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 64.5 m -70.55 -35.32 73.04 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 124.083 3.129 . . . . 0.0 117.709 172.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.4 tp -69.35 -40.12 77.7 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 128.176 3.422 . . . . 0.0 113.499 170.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 18.7 tttp -59.99 -36.99 78.38 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 120.575 -1.328 . . . . 0.0 113.252 176.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.13 -13.13 58.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 172.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.55 126.36 91.42 Favored Pre-proline 0 N--CA 1.449 -0.504 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -67.63 155.73 68.91 Favored 'Trans proline' 0 N--CA 1.446 -1.281 1 C-N-CA 126.786 4.991 . . . . 0.0 108.759 -172.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . 0.396 3.1 m -68.06 -34.03 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 113.288 -1.778 . . . . 0.0 113.906 -165.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.28 13.0 pm0 -61.29 -35.46 77.38 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 170.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 43.0 tp -70.34 -44.7 67.64 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 124.525 2.107 . . . . 0.0 108.618 173.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.5 mtm180 -70.09 -29.41 66.38 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 116.733 -3.729 . . . . 0.0 114.661 -168.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -80.1 -30.45 39.16 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 117.028 2.232 . . . . 0.0 117.028 168.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 85.7 t90 -73.12 -37.16 66.77 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 169.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.99 -24.31 67.67 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.489 1.516 . . . . 0.0 114.078 174.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -80.33 -8.61 59.56 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.922 2.489 . . . . 0.0 114.883 165.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -99.34 -38.61 8.78 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 112.019 -3.848 . . . . 0.0 105.904 173.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.8 t -83.88 -57.72 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 O-C-N 127.992 3.308 . . . . 0.0 106.879 -165.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.4 mt -85.25 -30.33 23.9 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 120.413 1.46 . . . . 0.0 114.04 -158.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mt -105.86 -27.64 11.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 124.686 2.184 . . . . 0.0 108.276 -148.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.8 tttt -83.18 5.12 23.87 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 128.568 2.747 . . . . 0.0 115.994 -159.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.4 p -86.5 -18.28 32.01 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.669 2.787 . . . . 0.0 110.939 171.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.261 3.6 m-20 . . . . . 0 C--O 1.249 1.031 0 C-N-CA 129.257 3.023 . . . . 0.0 118.305 -161.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.7 tmm? . . . . . 0 N--CA 1.468 0.44 0 CA-C-O 124.478 2.085 . . . . 0.0 115.126 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.56 -8.2 53.98 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 120.325 -1.485 . . . . 0.0 114.86 -157.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -106.23 -19.5 13.69 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 117.867 2.543 . . . . 0.0 117.867 165.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . 0.283 3.8 tp-100 -72.53 -38.45 68.04 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 168.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 17.5 m -82.74 137.57 44.08 Favored Pre-proline 0 N--CA 1.449 -0.485 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 178.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -74.02 5.92 3.24 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 N-CA-C 121.214 3.505 . . . . 0.0 121.214 172.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . 0.293 48.1 t80 -134.32 145.34 48.95 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 129.892 3.277 . . . . 0.0 113.323 167.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.2 t -162.05 137.3 7.27 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 126.858 2.599 . . . . 0.0 108.618 167.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.51 -28.28 65.91 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 129.062 2.945 . . . . 0.0 108.718 -179.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.93 -37.12 62.12 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 124.564 2.126 . . . . 0.0 108.332 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 21.7 mmt -74.32 -24.81 59.26 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 117.674 -3.141 . . . . 0.0 108.936 -178.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.94 -42.86 56.85 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 120.305 -1.497 . . . . 0.0 109.837 171.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -62.02 -40.56 96.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.075 1.75 . . . . 0.0 111.022 177.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -65.8 -39.25 90.75 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.577 2.351 . . . . 0.0 108.79 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -86.38 -14.54 43.15 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 118.027 -2.921 . . . . 0.0 112.824 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -51.7 -47.7 63.83 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 121.025 1.739 . . . . 0.0 114.757 149.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -64.68 -44.83 89.07 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 118.354 -2.716 . . . . 0.0 110.605 -177.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -53.94 -45.88 71.4 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.702 1.601 . . . . 0.0 112.425 174.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 28.0 t-105 -64.26 -58.91 5.19 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 170.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 73.8 mt -51.78 -25.84 8.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 116.721 -1.609 . . . . 0.0 110.651 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -65.08 -31.93 73.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 174.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -67.43 -53.84 25.56 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 121.048 1.749 . . . . 0.0 109.941 165.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.443 HG23 ' H ' ' B' ' 23' ' ' VAL . 29.7 t -46.11 -38.57 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 117.495 2.405 . . . . 0.0 117.495 171.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -75.07 -52.49 10.91 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.106 2.162 . . . . 0.0 106.61 171.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 46.2 tp -59.27 -34.08 71.83 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 124.891 3.496 . . . . 0.0 112.083 -175.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 27.8 tp -72.76 -37.58 67.62 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 114.503 -2.665 . . . . 0.0 115.39 173.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -65.14 -39.03 92.47 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 121.098 1.772 . . . . 0.0 113.363 176.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -71.59 -34.7 70.11 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 127.011 2.125 . . . . 0.0 108.484 173.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.51 -26.22 65.34 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 121.938 2.154 . . . . 0.0 113.098 175.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -70.77 -28.08 64.41 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.138 -2.226 . . . . 0.0 110.267 173.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -71.59 -13.08 61.66 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -123.55 -1.22 8.56 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 118.214 -2.804 . . . . 0.0 112.194 -172.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.332 0.3 OUTLIER 70.66 8.69 6.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.063 2.545 . . . . 0.0 116.556 -172.522 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.44 3.89 26.36 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 119.566 -1.959 . . . . 0.0 111.905 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -54.49 -47.86 72.53 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 177.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 27.8 tp -65.16 -61.9 5.47 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-O 116.167 -1.873 . . . . 0.0 111.23 -178.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -55.95 -31.47 81.96 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 CA-C-N 124.338 2.585 . . . . 0.0 118.687 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 46.5 tp -70.39 -42.11 72.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 113.623 -3.084 . . . . 0.0 114.22 170.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 21.8 mt -69.47 -33.59 73.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 123.403 2.819 . . . . 0.0 111.576 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -70.56 -26.88 63.75 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 125.144 1.528 . . . . 0.0 112.332 171.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . 0.282 11.7 tp -75.38 -33.48 61.03 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 116.543 -3.848 . . . . 0.0 115.277 164.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 24.4 mmt -84.2 -26.76 28.51 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -170.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 38.7 mt -122.82 136.92 55.03 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 124.242 0.964 . . . . 0.0 109.452 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 59.7 p -68.03 155.78 91.16 Favored Pre-proline 0 N--CA 1.447 -0.601 0 O-C-N 120.05 -1.656 . . . . 0.0 108.926 174.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -47.11 -38.84 25.43 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 122.886 2.391 . . . . 0.0 113.894 174.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -66.91 -45.41 78.05 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 115.592 -2.147 . . . . 0.0 114.902 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -64.1 -38.73 92.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 125.91 2.006 . . . . 0.0 115.118 171.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 42.2 mtm-85 -64.96 -37.95 89.35 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.052 -2.28 . . . . 0.0 111.595 170.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -69.46 -31.26 69.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 173.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.04 -62.42 1.71 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 114.622 -2.608 . . . . 0.0 109.218 170.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 7.2 mt -53.5 -35.7 60.9 Favored 'General case' 0 N--CA 1.447 -0.59 0 O-C-N 127.965 3.291 . . . . 0.0 117.548 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.17 -28.87 70.95 Favored Glycine 0 CA--C 1.522 0.494 0 O-C-N 125.446 1.716 . . . . 0.0 113.485 168.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.7 m -72.87 -34.72 66.91 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.716 -2.638 . . . . 0.0 110.099 166.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.471 ' HA ' ' HB ' ' B' ' 57' ' ' ILE . 95.4 mtt180 -69.79 -18.67 63.49 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 112.634 -3.555 . . . . 0.0 114.804 174.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.38 -59.15 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 122.145 2.248 . . . . 0.0 109.882 157.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -55.42 -34.71 64.67 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 122.437 2.381 . . . . 0.0 116.81 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.471 ' HB ' ' HA ' ' B' ' 54' ' ' ARG 0.347 45.1 mt -57.11 -70.09 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 124.763 2.22 . . . . 0.0 108.678 173.556 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 57.6 t -54.52 -38.15 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 125.382 1.473 . . . . 0.0 112.29 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -65.46 -39.48 92.03 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 119.32 3.082 . . . . 0.0 119.32 169.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -74.38 -31.55 62.41 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 119.533 -1.979 . . . . 0.0 111.096 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 3.6 mt -55.47 -33.77 63.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.442 1.897 . . . . 0.0 113.227 168.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . 0.284 73.3 mt -85.52 -45.84 11.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 116.384 -1.77 . . . . 0.0 108.625 174.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.319 5.0 ttm105 -62.17 -64.3 0.97 Allowed 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 130.035 3.334 . . . . 0.0 110.79 -169.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.91 44.87 13.19 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 119.375 2.51 . . . . 0.0 119.375 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -106.63 -36.48 6.72 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 112.538 -1.831 . . . . 0.0 115.075 168.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 52.2 mtt -70.77 145.6 50.32 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 116.836 2.162 . . . . 0.0 116.836 -173.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 83.3 p -78.46 161.59 26.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 119.77 -1.831 . . . . 0.0 112.738 164.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -68.25 -20.15 64.78 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 119.345 -2.097 . . . . 0.0 108.665 -175.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -64.26 -45.09 89.62 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 115.093 -2.384 . . . . 0.0 113.083 164.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -62.3 -36.94 83.69 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 125.173 1.545 . . . . 0.0 113.059 177.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 91.3 mt -73.01 -51.81 16.8 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.43 1.492 . . . . 0.0 113.554 173.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 18.0 tptp -65.92 -46.14 79.33 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 119.443 -2.036 . . . . 0.0 110.892 -174.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -100.93 -17.53 16.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 124.177 0.923 . . . . 0.0 111.004 -164.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . 0.296 34.9 mt-10 -121.92 -16.25 7.64 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 115.613 -2.137 . . . . 0.0 111.432 -172.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 81.7 mt -112.04 -5.03 14.32 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 117.589 2.44 . . . . 0.0 117.589 162.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.63 21.65 69.18 Favored Glycine 0 C--N 1.334 0.467 0 O-C-N 124.433 1.083 . . . . 0.0 111.758 -177.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -111.9 108.32 17.65 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.617 -0.931 . . . . 0.0 112.131 -172.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.5 -176.19 51.26 Favored Glycine 0 CA--C 1.523 0.558 0 O-C-N 126.374 2.296 . . . . 0.0 109.606 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 26.8 mm -53.68 -46.02 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-O 125.925 2.774 . . . . 0.0 112.833 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.38 -23.94 54.1 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 117.643 -3.16 . . . . 0.0 110.12 -171.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 5.6 m -79.1 -35.47 42.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 125.696 1.873 . . . . 0.0 109.919 177.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 38.5 mm -74.77 -52.03 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 C-N-CA 130.884 3.674 . . . . 0.0 110.549 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 30.9 m -57.61 -37.98 74.17 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 130.095 3.358 . . . . 0.0 113.34 173.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -66.75 -47.09 73.32 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.997 -1.001 . . . . 0.0 111.531 169.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -54.64 -36.97 59.98 Favored Glycine 0 CA--C 1.521 0.466 0 O-C-N 119.121 -2.237 . . . . 0.0 114.83 166.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 24.2 p -72.47 -29.19 63.43 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.223 1.011 . . . . 0.0 110.24 -178.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -70.77 -44.59 66.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.475 1.51 . . . . 0.0 114.821 166.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 70.5 m -57.85 -34.63 69.93 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 115.072 1.508 . . . . 0.0 115.072 177.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' B' ' 89' ' ' LEU . 16.8 mt -60.89 -24.64 66.13 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 127.599 3.062 . . . . 0.0 111.598 168.017 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -93.8 -43.35 8.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.697 1.999 . . . . 0.0 111.353 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.35 -1.21 1.56 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.398 1.879 . . . . 0.0 115.328 162.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.16 149.76 50.7 Favored Pre-proline 0 N--CA 1.447 -0.585 0 O-C-N 119.708 -1.87 . . . . 0.0 110.287 174.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -60.47 144.61 99.53 Favored 'Trans proline' 0 N--CA 1.448 -1.204 0 C-N-CA 122.857 2.371 . . . . 0.0 112.658 164.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 25.2 m -67.92 -23.72 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -178.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -68.84 -4.68 17.17 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 117.852 -3.03 . . . . 0.0 114.308 166.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 15.0 tp -99.5 -35.61 9.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 120.726 1.603 . . . . 0.0 110.338 170.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 57.9 mtp85 -54.55 -41.29 69.59 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 130.9 3.68 . . . . 0.0 113.959 173.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -74.44 -42.41 59.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.158 2.183 . . . . 0.0 110.409 167.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -52.81 -36.82 59.01 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 116.362 -1.78 . . . . 0.0 114.244 178.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 21.0 mt -83.76 -35.27 24.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.081 1.753 . . . . 0.0 113.606 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -61.91 -31.54 71.86 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 171.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -103.1 -15.49 16.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 125.493 1.746 . . . . 0.0 115.378 -175.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.429 HG11 ' CD1' ' A' ' 25' ' ' LEU . 53.9 t -85.1 -54.21 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 128.668 2.787 . . . . 0.0 110.879 167.141 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 14.0 mt -78.11 -44.36 26.34 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 116.886 2.18 . . . . 0.0 116.886 -168.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 88.3 mt -76.67 -22.72 53.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 127.308 2.88 . . . . 0.0 111.07 -169.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -86.58 -4.7 59.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 128.704 2.802 . . . . 0.0 112.255 170.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 17.6 m -104.49 3.57 32.17 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.304 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 19.1 t70 . . . . . 0 C--O 1.251 1.139 0 C-N-CA 128.704 2.802 . . . . 0.0 114.203 178.444 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ttt . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.86 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.275 . . -72.33 154.43 40.95 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 127.45 2.969 . . . . 0.0 113.35 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -126.94 145.74 50.57 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 126.193 1.797 . . . . 0.0 110.414 -177.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -121.14 126.17 49.06 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.935 1.294 . . . . 0.0 112.228 171.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 5' ' ' SER . . . . . 0.506 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 58.5 p -136.82 142.3 38.25 Favored Pre-proline 0 N--CA 1.445 -0.725 0 C-N-CA 128.117 2.567 . . . . 0.0 109.225 -179.659 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 6' ' ' PRO . . . . . 0.506 ' HD3' ' HA ' ' C' ' 5' ' ' SER . 53.3 Cg_exo -64.88 -14.99 48.12 Favored 'Trans proline' 0 N--CA 1.451 -1.013 0 N-CA-C 120.157 3.099 . . . . 0.0 120.157 -164.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -140.97 147.76 39.26 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.125 1.37 . . . . 0.0 114.29 176.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 9.1 t -140.84 133.65 28.98 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.222 1.963 . . . . 0.0 108.527 164.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.52 -25.05 53.75 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 111.981 -2.372 . . . . 0.0 113.576 173.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.19 -29.36 34.61 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 119.381 -2.074 . . . . 0.0 110.096 178.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 39.8 mtt -66.07 -38.32 88.0 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.174 2.19 . . . . 0.0 112.284 169.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.17 84.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 117.441 2.386 . . . . 0.0 117.441 164.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -73.01 -35.48 66.81 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 125.533 1.771 . . . . 0.0 106.467 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -63.51 -44.92 92.91 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.514 2.042 . . . . 0.0 116.514 166.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -32.33 73.83 Favored 'General case' 0 N--CA 1.448 -0.547 1 O-C-N 116.141 -4.099 . . . . 0.0 107.973 177.066 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -68.0 -54.09 21.08 Favored 'General case' 0 N--CA 1.453 -0.292 1 O-C-N 115.628 -4.42 . . . . 0.0 111.416 173.128 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.275 67.0 mm-40 -54.44 -35.78 63.35 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 114.867 1.432 . . . . 0.0 114.867 172.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -64.58 -35.04 79.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 172.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 -71.16 -37.51 72.23 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 124.257 1.98 . . . . 0.0 108.383 177.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . 0.285 9.7 mp -67.09 -16.87 64.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.628 177.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -93.31 -31.41 14.69 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 114.099 -2.857 . . . . 0.0 113.377 178.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -64.06 -33.9 76.81 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 126.518 2.386 . . . . 0.0 109.008 168.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.284 11.1 t -60.99 -44.31 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 O-C-N 118.562 -2.586 . . . . 0.0 114.917 168.137 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -71.7 -32.3 67.68 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 126.623 2.452 . . . . 0.0 117.229 -174.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 50.0 tp -68.37 -50.61 51.92 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 118.482 -1.287 . . . . 0.0 108.599 173.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 61.7 tp -57.23 -37.2 71.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 120.544 -1.347 . . . . 0.0 110.461 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -47.67 -55.66 8.94 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.789 2.436 . . . . 0.0 111.849 173.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -74.87 -25.13 58.74 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.192 -2.813 . . . . 0.0 107.57 -177.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.5 -26.12 68.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 118.818 2.896 . . . . 0.0 118.818 -175.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -64.01 -41.33 97.49 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 122.745 1.259 . . . . 0.0 114.343 171.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -61.34 -36.5 80.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.072 -1.422 . . . . 0.0 111.551 -174.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . 0.312 29.6 p-10 -108.29 9.31 27.95 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.13 2.172 . . . . 0.0 116.756 173.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.535 5.0 m-20 61.21 28.45 18.05 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 117.065 -3.522 . . . . 0.0 120.507 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.02 4.13 35.33 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 116.654 2.094 . . . . 0.0 116.654 165.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -67.59 -43.31 80.84 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 122.08 2.218 . . . . 0.0 115.212 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 80.6 mt -65.92 -50.21 54.12 Favored Pre-proline 0 N--CA 1.45 -0.432 0 O-C-N 117.747 -3.096 . . . . 0.0 112.449 166.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -42.82 -49.4 6.78 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 CA-C-N 124.176 2.527 . . . . 0.0 118.205 162.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 19.8 tp -63.36 -40.62 97.77 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.318 66.8 mt -70.77 -8.4 52.05 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 118.329 -2.732 . . . . 0.0 115.514 174.319 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -107.96 -1.49 20.58 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 130.997 3.719 . . . . 0.0 111.32 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 12.3 tp -104.98 -48.05 3.84 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 120.814 -1.179 . . . . 0.0 113.194 166.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 87.5 mmm -78.29 -2.53 38.41 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -170.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mp -138.75 154.84 48.56 Favored 'General case' 0 N--CA 1.452 -0.342 1 O-C-N 115.877 -4.264 . . . . 0.0 107.663 -172.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 54.6 p -79.67 160.25 69.94 Favored Pre-proline 0 N--CA 1.449 -0.521 0 C-N-CA 129.791 3.236 . . . . 0.0 112.655 163.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -48.52 -43.35 33.43 Favored 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 122.811 2.341 . . . . 0.0 114.907 169.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -40.35 94.9 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 118.091 -2.881 . . . . 0.0 108.717 175.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -66.94 -35.32 79.72 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 123.686 2.948 . . . . 0.0 113.346 -176.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 82.3 mtm-85 -64.8 -31.36 72.56 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 127.608 3.575 . . . . 0.0 115.132 165.093 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.78 -30.0 45.33 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 111.882 -2.417 . . . . 0.0 105.521 -172.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.46 -37.05 77.15 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 123.485 1.612 . . . . 0.0 114.613 175.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 68.6 mt -74.91 -25.63 59.05 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 117.724 2.49 . . . . 0.0 117.724 167.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.11 -45.88 94.49 Favored Glycine 0 CA--C 1.526 0.751 0 O-C-N 118.837 -2.414 . . . . 0.0 111.87 164.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 58.3 m -60.98 -57.16 13.8 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 130.249 3.42 . . . . 0.0 109.412 174.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.38 26.9 mtt180 -60.59 -31.37 70.52 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.025 -1.047 . . . . 0.0 113.452 -170.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 46.8 t -67.97 -45.47 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.251 0.62 . . . . 0.0 110.088 174.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.76 -1.96 6.27 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.549 -2.594 . . . . 0.0 115.329 171.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 53.1 mt -99.49 -34.13 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 120.557 1.526 . . . . 0.0 110.328 173.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 77.5 t -69.85 -41.49 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 117.592 -3.192 . . . . 0.0 113.852 172.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -64.02 -42.66 97.06 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 122.494 1.14 . . . . 0.0 111.944 176.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -64.34 -24.6 67.7 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 170.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 97.0 mt -90.73 -17.34 26.88 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 63.5 mt -84.81 -41.08 16.44 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.881 2.472 . . . . 0.0 111.482 163.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 29.7 ttm105 -61.88 -41.85 98.35 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 126.228 2.918 . . . . 0.0 112.373 175.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.35 12.99 61.96 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 119.682 2.633 . . . . 0.0 119.682 172.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -73.28 -31.49 64.09 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 118.442 -2.799 . . . . 0.0 111.604 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 17.3 mmt -72.04 141.53 49.29 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 126.503 3.049 . . . . 0.0 110.585 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 53.8 p -114.1 169.01 9.33 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 111.466 -2.606 . . . . 0.0 113.833 -171.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -43.43 -33.91 1.18 Allowed 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 126.668 2.48 . . . . 0.0 116.606 -170.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 26.2 ttp-105 -72.37 -51.68 19.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 126.252 1.821 . . . . 0.0 109.468 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -69.37 -40.78 77.24 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 128.523 2.729 . . . . 0.0 112.414 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 91.1 mt -52.28 -21.46 3.5 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 117.233 2.309 . . . . 0.0 117.233 167.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -106.16 -42.79 4.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 120.322 -1.486 . . . . 0.0 110.949 166.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -88.16 -8.21 55.72 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 120.927 -1.108 . . . . 0.0 112.788 -165.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -129.71 -47.31 1.15 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 116.185 -1.864 . . . . 0.0 114.342 -177.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 mp -64.71 -28.3 69.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 120.164 1.347 . . . . 0.0 111.336 163.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 57.09 -151.6 26.35 Favored Glycine 0 N--CA 1.447 -0.595 0 N-CA-C 117.214 1.645 . . . . 0.0 117.214 -168.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.03 -20.84 55.42 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 116.491 -3.947 . . . . 0.0 114.981 -168.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.32 -5.1 26.63 Favored Glycine 0 C--N 1.337 0.599 0 O-C-N 126.958 2.661 . . . . 0.0 115.618 -178.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 16.5 tt -64.4 -31.87 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 O-C-N 117.601 -3.293 . . . . 0.0 110.468 170.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.15 -18.44 36.72 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 122.326 2.33 . . . . 0.0 114.142 -177.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 55.1 m -73.99 -26.8 60.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.269 2.228 . . . . 0.0 112.841 170.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 24.4 mm -98.13 -6.39 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 O-C-N 117.134 -3.479 . . . . 0.0 110.954 178.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 80.8 p -125.01 4.95 7.96 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 118.584 -2.573 . . . . 0.0 116.586 -166.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -127.66 149.09 50.36 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.399 0.68 . . . . 0.0 111.952 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.61 178.15 42.55 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-O 117.194 -1.892 . . . . 0.0 114.77 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 18.4 m -71.16 -15.56 62.49 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 118.045 2.609 . . . . 0.0 118.045 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -96.15 -7.3 36.22 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 120.524 3.528 . . . . 0.0 120.524 170.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 8.4 p -42.96 158.71 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 123.209 1.48 . . . . 0.0 114.277 175.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 57.5 tp -54.59 -38.24 66.5 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 130.536 3.534 . . . . 0.0 109.119 -167.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -99.3 -1.15 39.7 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 122.126 2.239 . . . . 0.0 113.077 -175.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -116.4 -13.21 11.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.322 -0.853 . . . . 0.0 112.656 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.29 155.76 6.54 Favored Pre-proline 0 N--CA 1.454 -0.257 0 C-N-CA 126.628 1.971 . . . . 0.0 113.896 171.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.28 149.86 83.27 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.12 1.88 . . . . 0.0 112.73 178.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 29.3 t -65.88 -46.61 88.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 126.105 1.762 . . . . 0.0 109.614 -172.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -62.29 -25.85 68.08 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 113.172 -3.299 . . . . 0.0 117.684 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 15.8 tp -66.55 -48.37 69.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 125.793 1.933 . . . . 0.0 109.377 163.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -63.95 -51.01 66.35 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.355 -165.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -60.15 -29.76 68.86 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.819 2.048 . . . . 0.0 116.236 168.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.7 t90 -78.25 -30.11 48.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 122.384 2.357 . . . . 0.0 108.673 -177.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 16.2 mt -63.77 -40.54 96.93 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 116.815 -1.564 . . . . 0.0 115.121 177.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -70.18 -18.32 63.19 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 127.522 2.329 . . . . 0.0 111.552 177.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -85.7 -28.16 24.84 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 115.359 -2.258 . . . . 0.0 116.158 167.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 17.4 t -96.42 -51.03 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.99 2.632 . . . . 0.0 112.803 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 85.1 mt -76.58 -23.63 53.49 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.101 -175.373 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 71.6 mt -128.91 29.48 5.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.102 1.761 . . . . 0.0 110.494 -168.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -53.55 131.82 39.22 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 128.08 3.8 . . . . 0.0 117.518 -174.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 70.3 m -100.92 -27.19 13.44 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 117.308 -3.37 . . . . 0.0 113.269 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 29.8 t70 . . . . . 0 C--O 1.253 1.278 0 CA-C-N 120.844 1.656 . . . . 0.0 108.521 -167.81 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 11.4 ttt . . . . . 0 N--CA 1.471 0.587 0 CA-C-O 117.19 -1.386 . . . . 0.0 114.318 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -156.36 145.03 20.09 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -168.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . 0.252 4.6 tt0 -119.23 139.88 51.14 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.382 1.473 . . . . 0.0 110.49 171.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -130.88 150.53 52.0 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 116.705 -1.616 . . . . 0.0 109.922 175.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 5' ' ' SER . . . . . 0.447 ' HB2' ' HD2' ' D' ' 6' ' ' PRO . 59.7 p -103.14 168.03 9.36 Favored Pre-proline 0 N--CA 1.451 -0.388 0 C-N-CA 126.037 1.735 . . . . 0.0 111.292 170.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 6' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' D' ' 5' ' ' SER 0.329 89.5 Cg_endo -78.74 -18.42 11.83 Favored 'Trans proline' 0 N--CA 1.45 -1.049 1 C-N-CA 126.943 5.095 . . . . 0.0 118.774 -166.822 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -154.87 129.69 9.35 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.638 3.175 . . . . 0.0 106.513 156.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.9 t -64.81 124.74 22.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 118.432 2.752 . . . . 0.0 118.432 -174.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.82 -42.54 58.41 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 128.033 2.533 . . . . 0.0 110.37 166.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.38 -27.08 65.92 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.294 -2.129 . . . . 0.0 111.979 177.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.298 9.2 mmt -66.57 -49.09 67.55 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 112.956 -3.402 . . . . 0.0 113.882 161.319 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.14 -36.52 51.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 125.842 2.734 . . . . 0.0 115.126 175.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 35.7 tp10 -76.04 -47.9 22.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 116.406 -1.759 . . . . 0.0 108.899 174.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -55.55 -44.23 76.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 128.682 2.793 . . . . 0.0 110.668 176.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 15' ' ' ARG . . . . . 0.406 HH21 ' CD ' ' D' ' 18' ' ' GLU . 0.0 OUTLIER -64.66 -37.06 86.28 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.324 -2.735 . . . . 0.0 115.372 173.651 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -57.56 -45.39 85.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 119.809 1.186 . . . . 0.0 114.199 165.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -74.99 -35.04 62.04 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.639 -1.913 . . . . 0.0 114.305 -175.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 18' ' ' GLU . . . . . 0.406 ' CD ' HH21 ' D' ' 15' ' ' ARG . 79.0 mt-10 -62.0 -21.28 64.73 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 116.189 -1.862 . . . . 0.0 113.924 163.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -89.33 -26.72 20.95 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 127.22 2.825 . . . . 0.0 113.104 172.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 20' ' ' LEU . . . . . 0.479 HD23 ' HA ' ' D' ' 20' ' ' LEU . 20.4 mt -69.61 -30.23 67.93 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 123.788 1.756 . . . . 0.0 113.607 172.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 37.7 ttt180 -71.51 -24.79 62.03 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.317 -2.115 . . . . 0.0 112.261 168.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 22' ' ' PHE . . . . . 0.406 ' CZ ' HD22 ' D' ' 26' ' ' LEU . 69.3 t80 -74.06 -56.45 4.92 Favored 'General case' 0 N--CA 1.453 -0.318 1 O-C-N 115.746 -4.346 . . . . 0.0 108.972 167.406 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 23.4 t -58.76 -37.82 68.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 121.527 1.967 . . . . 0.0 114.476 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -61.19 -39.4 90.03 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 124.76 1.288 . . . . 0.0 114.442 166.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 16.6 tp -67.44 -41.67 84.38 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 119.937 -1.727 . . . . 0.0 112.466 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 26' ' ' LEU . . . . . 0.406 HD22 ' CZ ' ' D' ' 22' ' ' PHE . 55.0 tp -63.07 -49.36 74.8 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 113.53 -3.128 . . . . 0.0 112.07 171.082 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -48.91 -55.7 11.0 Favored 'General case' 0 N--CA 1.451 -0.389 1 CA-C-N 126.978 4.445 . . . . 0.0 111.561 167.601 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -52.81 -30.84 35.65 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 121.294 1.861 . . . . 0.0 112.655 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.88 -34.06 62.16 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 123.126 1.441 . . . . 0.0 112.746 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -68.78 -4.93 17.9 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.109 -3.494 . . . . 0.0 115.233 163.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -104.94 -6.97 19.63 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 117.347 -3.345 . . . . 0.0 113.054 176.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 50.2 p30 -132.97 9.75 4.18 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 128.251 2.62 . . . . 0.0 114.016 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.38 7.1 m-20 67.35 6.76 5.07 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 116.555 2.058 . . . . 0.0 116.555 173.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 32.1 mt -77.68 16.24 0.7 Allowed 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 116.484 -3.885 . . . . 0.0 115.2 166.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -81.19 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.872 2.469 . . . . 0.0 114.059 171.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 14.3 mt -48.58 -30.12 1.95 Allowed Pre-proline 0 N--CA 1.447 -0.615 0 O-C-N 116.613 -3.804 . . . . 0.0 114.085 -176.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -68.13 -48.17 1.42 Allowed 'Trans proline' 0 N--CA 1.447 -1.241 0 O-C-N 114.412 -3.52 . . . . 0.0 116.095 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . 0.261 63.6 tp -48.97 -50.74 34.15 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 116.558 -1.687 . . . . 0.0 108.713 170.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 2.8 mt -66.54 -39.32 88.5 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 113.69 -3.052 . . . . 0.0 106.299 -172.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 -84.22 -17.26 40.44 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 115.587 -2.149 . . . . 0.0 114.119 -176.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 39.9 tp -65.72 -54.5 26.49 Favored 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 125.01 1.444 . . . . 0.0 108.379 161.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 1.7 mmt -68.1 -39.52 82.81 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.101 -1.428 . . . . 0.0 108.43 -168.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 37.3 mt -119.59 137.32 53.93 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 -165.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 8.0 p -73.85 153.75 89.07 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-N 114.057 -1.429 . . . . 0.0 112.757 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -48.99 -37.15 36.66 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 124.97 3.78 . . . . 0.0 120.496 -174.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.365 24.5 m-20 -72.39 -23.16 61.07 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 115.069 -2.396 . . . . 0.0 111.189 176.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -85.1 -32.03 23.03 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 15.7 mtm180 -75.8 -37.1 59.46 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.597 1.559 . . . . 0.0 110.6 173.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -54.83 -47.21 74.4 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 129.401 3.081 . . . . 0.0 107.76 170.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.46 -46.18 80.86 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -178.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.71 -42.76 95.05 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 116.141 -1.885 . . . . 0.0 113.4 174.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.76 -27.07 65.97 Favored Glycine 0 C--N 1.338 0.643 0 CA-C-N 120.307 1.412 . . . . 0.0 116.063 167.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 95.7 m -82.99 -35.48 25.84 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 117.052 -3.617 . . . . 0.0 110.94 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -60.71 -33.39 72.81 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 116.841 -3.662 . . . . 0.0 108.519 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 43.9 t -64.27 -36.11 76.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 123.738 2.972 . . . . 0.0 114.124 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -80.56 -32.28 36.66 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 115.973 -1.965 . . . . 0.0 114.52 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 82.7 mt -49.0 -48.75 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 116.612 -1.661 . . . . 0.0 113.568 160.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 75.3 t -68.99 -43.77 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 O-C-N 124.578 1.174 . . . . 0.0 109.835 -178.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -59.13 -40.02 84.16 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -67.04 -25.86 66.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 116.213 -1.851 . . . . 0.0 112.35 175.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 mt -72.96 -13.35 61.22 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 122.152 2.251 . . . . 0.0 112.169 173.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 85.5 mt -111.85 -18.96 12.57 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 117.393 -1.289 . . . . 0.0 113.759 176.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 ttm105 -69.85 -47.49 62.46 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 162.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 44.55 66.02 1.54 Allowed Glycine 0 CA--C 1.52 0.381 0 C-N-CA 126.285 1.898 . . . . 0.0 110.156 -173.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -130.67 -29.78 1.91 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.023 0.929 . . . . 0.0 112.282 164.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 22.2 mmt -81.02 69.35 7.6 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 125.213 2.435 . . . . 0.0 108.342 165.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 89.6 p -79.16 145.68 33.55 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.593 1.957 . . . . 0.0 111.243 -162.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 56.55 -88.17 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.125 -2.307 . . . . 0.0 115.927 156.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -72.54 -33.46 66.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 169.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -64.66 -42.72 95.2 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.94 -41.09 77.62 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.58 1.8 . . . . 0.0 112.517 174.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 58.1 mtmt -77.71 -37.31 49.77 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 125.09 1.493 . . . . 0.0 112.088 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -83.34 -56.3 3.84 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 121.692 2.042 . . . . 0.0 111.441 -177.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -93.95 -38.69 11.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 125.126 1.516 . . . . 0.0 113.128 -162.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -90.21 -24.06 21.1 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.258 -1.353 . . . . 0.0 108.152 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 74.58 -153.76 46.38 Favored Glycine 0 C--N 1.335 0.52 0 O-C-N 118.356 -2.715 . . . . 0.0 118.187 141.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -34.83 -65.02 0.23 Allowed 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 129.228 3.011 . . . . 0.0 113.71 -165.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.73 -1.7 2.9 Favored Glycine 0 C--N 1.339 0.701 0 O-C-N 126.412 2.32 . . . . 0.0 116.851 -174.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 2.2 tt -47.53 -34.69 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 122.549 3.175 . . . . 0.0 111.181 164.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -91.63 -20.78 21.26 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 119.388 -2.07 . . . . 0.0 110.266 -169.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 81.9 m -65.55 -46.2 80.46 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.349 1.86 . . . . 0.0 110.695 163.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 mm -73.9 -33.89 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 125.347 1.459 . . . . 0.0 111.361 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 16.3 p -119.72 9.61 11.45 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 118.775 2.88 . . . . 0.0 118.775 -174.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 17.8 mtp85 -123.85 173.47 8.16 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 153.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.63 152.98 29.72 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-O 116.633 -2.204 . . . . 0.0 113.498 -154.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 9.6 p -61.44 -29.6 70.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -165.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -128.6 45.05 2.85 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 123.878 1.799 . . . . 0.0 112.18 -177.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 1.7 p -69.24 177.73 2.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 119.808 -1.808 . . . . 0.0 109.382 -178.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 tp -66.22 -24.05 66.54 Favored 'General case' 0 N--CA 1.451 -0.379 1 O-C-N 116.108 -4.12 . . . . 0.0 114.731 176.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -67.72 -7.81 30.24 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 118.394 2.739 . . . . 0.0 118.394 159.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -133.93 11.95 3.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 115.382 -2.247 . . . . 0.0 113.245 -168.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 92' ' ' ALA . . . . . 0.428 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 30.35 99.32 0.03 OUTLIER Pre-proline 0 N--CA 1.452 -0.343 0 N-CA-C 116.558 2.058 . . . . 0.0 116.558 134.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 93' ' ' PRO . . . . . 0.428 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.346 0.3 OUTLIER 39.33 43.98 0.0 OUTLIER 'Cis proline' 0 N--CA 1.445 -1.341 0 O-C-N 117.147 -2.08 . . . . 0.0 109.902 26.339 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.94 -21.11 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 O-C-N 119.508 -1.995 . . . . 0.0 111.26 170.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.304 0.0 OUTLIER -91.15 -26.16 19.23 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 125.462 1.726 . . . . 0.0 112.201 -171.414 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.21 -51.7 55.14 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 131.064 3.745 . . . . 0.0 108.495 162.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -58.94 -48.8 80.2 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 126.128 1.771 . . . . 0.0 113.802 -174.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -63.56 -29.14 70.44 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 125.423 1.702 . . . . 0.0 115.399 170.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 70.6 t90 -83.37 -27.31 29.76 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 121.335 1.88 . . . . 0.0 111.652 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 25.7 mt -69.59 -34.8 74.65 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.179 -3.451 . . . . 0.0 110.498 171.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -67.64 -20.52 65.34 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 116.812 -1.566 . . . . 0.0 112.769 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -104.74 -9.88 17.82 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 126.556 2.41 . . . . 0.0 116.765 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.439 3.2 t -106.74 -26.61 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-O 125.698 2.666 . . . . 0.0 116.141 171.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 36.0 mt -104.83 -19.24 13.96 Favored 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 116.611 -3.806 . . . . 0.0 114.545 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 5.1 mp -110.73 44.7 1.23 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.771 1.628 . . . . 0.0 110.495 153.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -62.83 167.71 4.44 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 117.835 2.532 . . . . 0.0 117.835 169.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.9 m -52.4 -42.23 63.85 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 119.314 -2.116 . . . . 0.0 115.08 -170.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.247 0.945 0 C-N-CA 128.612 2.765 . . . . 0.0 118.104 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 117.905 -1.045 . . . . 0.0 112.308 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.97 -1.93 53.8 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 112.683 -3.607 . . . . 0.0 115.435 -159.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . 0.254 36.4 tt0 -89.32 -19.44 25.28 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 128.973 2.909 . . . . 0.0 110.488 171.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -79.49 7.73 7.61 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 117.628 2.455 . . . . 0.0 117.628 162.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.31 142.1 39.23 Favored Pre-proline 0 N--CA 1.447 -0.621 0 C-N-CA 128.342 2.657 . . . . 0.0 111.995 178.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -101.4 13.32 0.41 Allowed 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 123.71 2.94 . . . . 0.0 110.311 176.038 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -143.94 154.55 43.43 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.213 2.205 . . . . 0.0 113.791 170.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.0 t -152.77 132.65 13.28 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 129.764 3.225 . . . . 0.0 112.543 168.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.06 -15.78 63.35 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 116.687 -1.625 . . . . 0.0 111.682 175.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.46 -43.26 10.98 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 121.999 2.181 . . . . 0.0 111.228 -172.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 14.3 tpt -69.12 -27.56 65.68 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.473 1.909 . . . . 0.0 109.286 167.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.32 -22.78 61.13 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 120.428 3.492 . . . . 0.0 120.428 167.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -69.78 -37.51 76.37 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 120.985 -1.072 . . . . 0.0 112.292 157.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -66.78 -37.25 84.22 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 116.645 -3.784 . . . . 0.0 109.414 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -76.97 -3.81 40.83 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 130.747 3.619 . . . . 0.0 116.683 169.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -83.0 -50.31 8.67 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 116.412 -2.115 . . . . 0.0 110.334 163.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -41.76 -41.19 2.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 119.37 3.1 . . . . 0.0 119.37 161.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -65.17 -36.9 85.66 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.032 1.333 . . . . 0.0 113.694 174.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 9.2 t-105 -72.44 -45.57 59.01 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 117.61 -1.186 . . . . 0.0 112.807 170.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.32 -27.52 67.4 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 117.696 -1.145 . . . . 0.0 113.002 178.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . 0.313 12.1 ttt-85 -60.24 -23.22 63.9 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 130.756 3.622 . . . . 0.0 115.329 169.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.252 61.6 t80 -79.79 -43.95 21.54 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 115.427 -2.509 . . . . 0.0 109.684 165.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 68.8 t -69.51 -35.99 69.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -168.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -60.96 -37.01 80.89 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 165.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.9 tp -72.61 -30.41 64.32 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.257 1.023 . . . . 0.0 112.298 -177.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 48.5 tp -82.28 -31.76 29.91 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 128.047 2.539 . . . . 0.0 106.056 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -62.73 -44.35 96.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 121.996 2.18 . . . . 0.0 108.261 175.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -68.39 -36.29 78.94 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 127.475 3.512 . . . . 0.0 109.65 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.83 -40.93 95.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 116.535 -3.853 . . . . 0.0 117.477 175.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -68.84 -33.48 73.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 120.544 1.52 . . . . 0.0 113.044 173.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -71.96 -21.24 61.62 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 117.161 -3.462 . . . . 0.0 116.39 170.082 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -101.26 11.72 38.81 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 114.04 -2.886 . . . . 0.0 114.512 168.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 48.67 42.94 20.27 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 125.225 1.578 . . . . 0.0 113.142 -175.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -114.28 -1.66 13.53 Favored 'General case' 0 N--CA 1.45 -0.458 1 C-N-CA 133.538 4.735 . . . . 0.0 113.314 176.072 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -56.81 -43.08 80.62 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 122.683 2.492 . . . . 0.0 112.951 -178.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.444 HD23 ' HA ' ' A' ' 36' ' ' LEU . 12.5 mt -64.17 -63.45 3.82 Favored Pre-proline 0 N--CA 1.447 -0.584 0 O-C-N 120.549 -1.344 . . . . 0.0 109.841 -175.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -70.17 -11.58 30.56 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 CA-C-O 115.462 -1.974 . . . . 0.0 112.716 -174.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.6 tp -70.52 -63.25 1.13 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 129.254 3.021 . . . . 0.0 105.105 167.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 37.0 mt -58.86 -34.5 71.67 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 119.571 -1.956 . . . . 0.0 114.537 -175.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -51.71 -50.76 59.88 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.479 1.112 . . . . 0.0 112.299 164.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.8 tt -64.32 -47.18 80.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 126.584 1.954 . . . . 0.0 109.869 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 65.9 mmm -83.86 -17.95 39.17 Favored 'General case' 0 N--CA 1.453 -0.295 1 CA-C-O 111.306 -4.188 . . . . 0.0 116.49 -167.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 mt -133.5 138.77 46.28 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 124.201 3.182 . . . . 0.0 108.444 170.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.9 p -73.5 155.5 89.41 Favored Pre-proline 0 N--CA 1.448 -0.544 0 CA-C-N 114.359 -1.291 . . . . 0.0 111.011 177.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -59.45 -29.24 89.55 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 CA-C-O 114.905 -2.206 . . . . 0.0 117.212 -170.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.49 -23.61 53.76 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 122.748 2.522 . . . . 0.0 107.372 178.059 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -81.26 -27.63 35.08 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 116.74 -3.725 . . . . 0.0 113.221 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.8 mtm-85 -69.73 -57.13 5.5 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 117.904 -2.998 . . . . 0.0 108.373 178.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . 0.275 24.4 tt0 -61.84 -27.18 68.59 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.365 1.866 . . . . 0.0 111.889 177.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.75 -38.05 70.44 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.62 2.368 . . . . 0.0 110.269 174.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.9 mt -70.62 -27.71 64.29 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 120.823 1.647 . . . . 0.0 115.199 166.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.5 -38.02 95.69 Favored Glycine 0 C--N 1.335 0.501 0 CA-C-N 122.094 2.225 . . . . 0.0 111.299 167.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.0 m -68.91 -39.87 79.42 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 119.614 3.19 . . . . 0.0 119.614 171.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -54.93 -24.13 22.21 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 114.829 -2.51 . . . . 0.0 115.724 163.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.3 t -60.93 -38.66 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 122.397 2.362 . . . . 0.0 113.17 164.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -77.74 -29.67 51.23 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 114.983 -2.436 . . . . 0.0 114.378 171.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 66.8 mt -74.74 -24.57 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 122.48 2.4 . . . . 0.0 112.556 172.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 4.3 t -71.12 -51.77 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 C-N-CA 124.789 1.236 . . . . 0.0 110.986 159.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -50.51 -67.99 0.21 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.067 1.747 . . . . 0.0 111.922 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -71.79 -34.93 69.82 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.611 2.365 . . . . 0.0 110.541 -165.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.66 -39.45 91.42 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 118.022 2.601 . . . . 0.0 118.022 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.89 -37.14 72.98 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.751 2.02 . . . . 0.0 113.877 177.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 34.8 ttm105 -66.76 -44.6 80.97 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 165.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.7 18.02 55.49 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 110.014 -3.266 . . . . 0.0 113.372 155.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.257 47.9 mm-40 -88.18 -27.22 21.98 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 120.595 2.198 . . . . 0.0 107.025 -179.084 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 57.3 mtt -91.91 124.95 36.4 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 125.098 1.499 . . . . 0.0 112.603 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.8 p -73.07 164.63 26.41 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.024 1.73 . . . . 0.0 112.589 166.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.404 ' HB3' HG23 ' A' ' 79' ' ' ILE . 54.3 mt-30 -59.4 -40.06 85.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 123.967 0.792 . . . . 0.0 112.999 166.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 42.2 tpt85 -57.63 -27.37 62.73 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 173.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -87.1 -34.99 18.93 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 117.063 2.245 . . . . 0.0 117.063 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 92.0 mt -58.6 -26.16 63.38 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 118.806 -2.434 . . . . 0.0 115.592 167.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -42.28 -44.67 3.92 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 115.663 1.727 . . . . 0.0 115.663 157.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -83.37 -46.12 12.93 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 174.141 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -62.53 -46.77 86.87 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 125.458 1.503 . . . . 0.0 111.148 -169.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.9 mt -119.09 9.21 11.73 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 111.787 -2.46 . . . . 0.0 109.042 -169.096 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.79 12.1 74.17 Favored Glycine 0 C--N 1.337 0.596 0 N-CA-C 117.985 1.954 . . . . 0.0 117.985 174.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -97.2 141.59 30.14 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 118.875 2.917 . . . . 0.0 118.875 -157.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.03 123.17 21.04 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-O 116.656 -2.191 . . . . 0.0 110.422 168.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.404 HG23 ' HB3' ' A' ' 68' ' ' GLN . 72.0 mt -53.88 -35.08 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 118.719 1.259 . . . . 0.0 112.387 -162.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.2 -14.36 61.78 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 119.308 -2.12 . . . . 0.0 114.491 -171.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 78.0 p -74.56 -44.6 50.2 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.9 mm -68.93 -29.23 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-O 115.091 -2.385 . . . . 0.0 107.453 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 99.0 m -60.89 -32.15 71.62 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 120.908 1.686 . . . . 0.0 114.009 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -69.69 -46.26 66.43 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.919 -1.113 . . . . 0.0 113.114 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.15 -26.97 65.05 Favored Glycine 0 CA--C 1.525 0.712 0 O-C-N 119.739 -1.851 . . . . 0.0 110.29 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.2 m -64.64 -38.93 92.68 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.854 0.862 . . . . 0.0 110.161 169.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -77.34 -30.03 53.72 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 118.697 -2.502 . . . . 0.0 110.757 175.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.7 m -67.43 -40.14 85.46 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 122.362 2.346 . . . . 0.0 112.938 170.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.4 tp -64.4 -41.7 96.5 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 117.626 2.454 . . . . 0.0 117.626 168.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -57.8 -39.53 77.79 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 119.756 -1.84 . . . . 0.0 111.04 165.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.71 3.59 44.2 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 121.422 3.86 . . . . 0.0 121.422 175.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.44 153.36 85.8 Favored Pre-proline 0 N--CA 1.449 -0.482 0 O-C-N 126.336 2.272 . . . . 0.0 108.782 178.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -67.12 148.57 81.28 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 N-CA-C 109.303 -1.076 . . . . 0.0 109.303 -175.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.14 -30.79 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 117.852 -1.071 . . . . 0.0 111.692 -163.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 16.1 pm0 -76.86 -7.96 56.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.267 2.227 . . . . 0.0 111.392 -177.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 49.3 tp -87.34 -46.85 9.29 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 124.794 1.309 . . . . 0.0 112.944 168.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 54.5 mtm-85 -56.86 -35.28 68.7 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 119.251 -2.156 . . . . 0.0 110.493 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -66.94 -20.61 65.93 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 116.844 -3.66 . . . . 0.0 117.69 171.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -90.27 -42.94 10.7 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 118.061 -2.9 . . . . 0.0 106.715 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.66 -20.45 64.83 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 126.12 1.768 . . . . 0.0 114.683 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -70.21 -48.53 56.69 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.861 -3.024 . . . . 0.0 108.677 170.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -71.44 -32.23 68.12 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.239 -175.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 80.8 t -81.37 -59.75 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-O 113.464 -3.16 . . . . 0.0 110.959 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.6 mt -96.28 -29.69 13.86 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 127.367 2.917 . . . . 0.0 113.268 -172.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 11.7 mt -107.46 -22.9 12.38 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 114.735 -2.786 . . . . 0.0 110.84 -159.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -59.51 -22.93 62.34 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 125.319 2.485 . . . . 0.0 115.19 -175.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 85.9 p -66.24 -27.73 68.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 111.855 -2.43 . . . . 0.0 117.442 -173.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.252 1.209 0 O-C-N 117.229 -3.419 . . . . 0.0 116.919 176.676 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.6 tmm? . . . . . 0 N--CA 1.473 0.717 0 CA-C-O 118.048 -0.977 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.49 -24.56 63.7 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 127.556 2.342 . . . . 0.0 116.618 -165.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -100.96 -10.31 20.7 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 124.823 2.249 . . . . 0.0 114.601 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -82.5 -50.35 8.93 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 118.31 -2.744 . . . . 0.0 113.786 172.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 34.9 m -88.15 125.21 64.83 Favored Pre-proline 0 N--CA 1.449 -0.475 0 C-N-CA 127.678 2.391 . . . . 0.0 109.433 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -67.63 -19.91 47.47 Favored 'Trans proline' 0 N--CA 1.448 -1.183 0 N-CA-C 121.368 3.565 . . . . 0.0 121.368 172.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . 0.292 78.2 t80 -104.6 133.96 48.57 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 127.499 2.32 . . . . 0.0 108.383 167.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 14.3 t -161.43 124.93 3.24 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 119.382 -2.074 . . . . 0.0 110.886 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.79 -45.45 74.33 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.185 2.594 . . . . 0.0 110.043 174.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.76 -28.82 69.71 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 118.244 2.683 . . . . 0.0 118.244 174.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.86 -30.27 28.74 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.289 1.836 . . . . 0.0 108.097 172.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.77 -17.9 65.1 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 163.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -85.02 -46.14 11.47 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.508 1.123 . . . . 0.0 112.615 171.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 36.5 tp60 -63.77 -28.78 70.11 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 118.392 -0.813 . . . . 0.0 111.863 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.448 ' HD3' ' HA ' ' B' ' 15' ' ' ARG . 25.9 mmt180 -85.41 -16.21 40.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.774 -1.829 . . . . 0.0 113.793 173.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -80.69 -33.46 35.4 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 119.182 -2.199 . . . . 0.0 108.433 172.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -78.03 -13.52 59.84 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 118.185 -2.822 . . . . 0.0 110.852 175.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -72.91 -39.0 66.68 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 126.183 1.793 . . . . 0.0 113.321 160.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -62.05 -35.94 80.12 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.37 -2.081 . . . . 0.0 111.005 173.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 93.9 mt -70.01 -26.78 64.23 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 128.425 2.69 . . . . 0.0 113.963 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -54.0 -59.97 3.94 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 115.685 -2.102 . . . . 0.0 110.336 165.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -44.33 -45.74 8.94 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.011 2.187 . . . . 0.0 112.949 166.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 39.8 t -65.29 -48.42 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 -176.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.14 -33.74 73.93 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 117.427 -3.296 . . . . 0.0 113.5 172.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 48.6 tp -61.53 -47.03 87.44 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 177.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.261 65.3 tp -66.96 -39.56 87.27 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.308 -3.37 . . . . 0.0 116.066 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -56.3 -44.8 80.24 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 120.423 -1.423 . . . . 0.0 110.079 173.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -71.87 -30.08 65.04 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . 0.299 . . -68.14 -42.33 80.29 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 113.475 -3.155 . . . . 0.0 114.938 168.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -70.27 -10.59 59.38 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 116.617 2.081 . . . . 0.0 116.617 170.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -84.35 -13.3 52.72 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.845 1.258 . . . . 0.0 112.865 168.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -121.63 6.79 9.99 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 122.513 1.149 . . . . 0.0 112.747 176.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.294 1.7 m-20 57.04 30.12 17.66 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 119.429 -2.045 . . . . 0.0 115.496 -176.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 50.4 mt -102.3 14.21 32.57 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 128.886 2.874 . . . . 0.0 110.127 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -64.93 -38.57 91.39 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 114.583 -2.627 . . . . 0.0 117.764 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.26 34.0 tp -67.59 -55.1 15.33 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 126.007 2.067 . . . . 0.0 109.569 -175.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.31 -14.45 22.91 Favored 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 123.794 2.996 . . . . 0.0 114.025 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 40.4 tp -73.93 -41.74 61.61 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 119.405 -2.059 . . . . 0.0 112.511 163.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 46.3 mt -75.9 -25.57 56.18 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.917 -1.992 . . . . 0.0 115.144 175.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -67.76 -41.26 83.61 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.855 1.262 . . . . 0.0 110.345 163.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 26.7 tp -62.3 -46.38 89.02 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 117.671 -3.143 . . . . 0.0 107.283 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 23.7 mmt -77.57 -17.22 58.08 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.602 -2.561 . . . . 0.0 116.975 -169.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 mt -134.01 138.12 45.19 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 118.634 -2.541 . . . . 0.0 108.059 -175.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 64.8 p -89.01 164.98 29.05 Favored Pre-proline 0 N--CA 1.45 -0.467 0 C-N-CA 127.58 2.352 . . . . 0.0 109.607 -171.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -60.66 -27.99 85.78 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 124.215 3.277 . . . . 0.0 117.311 -172.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -76.49 -25.8 54.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 119.67 -1.894 . . . . 0.0 112.052 173.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -92.5 -33.7 14.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 116.628 -3.795 . . . . 0.0 110.168 -169.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 mtm-85 -70.88 -40.96 71.94 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 115.354 -2.26 . . . . 0.0 111.808 176.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -67.27 -30.78 70.76 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 119.891 1.223 . . . . 0.0 111.335 170.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.85 -34.08 60.05 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 120.003 -1.686 . . . . 0.0 115.044 177.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 28.3 mt -62.7 -44.59 95.83 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 118.694 -2.504 . . . . 0.0 110.635 166.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -42.65 -52.43 5.44 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-N 122.295 2.316 . . . . 0.0 114.411 163.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 6.2 m -74.74 -37.86 62.4 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.503 -0.848 . . . . 0.0 111.262 -170.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.42 ' HA ' HD12 ' B' ' 57' ' ' ILE . 89.7 mtt180 -57.48 -35.94 70.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 113.11 -3.329 . . . . 0.0 113.597 168.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 62.5 t -65.7 -35.25 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 114.241 -2.984 . . . . 0.0 106.749 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 48.6 mtp180 -74.98 -22.37 58.59 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 116.973 -1.489 . . . . 0.0 114.788 177.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.42 HD12 ' HA ' ' B' ' 54' ' ' ARG . 31.6 mt -70.17 -47.59 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 119.789 1.177 . . . . 0.0 108.767 173.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.283 47.1 t -73.84 -25.26 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 118.099 -2.876 . . . . 0.0 109.362 -175.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -64.34 -49.45 71.65 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 115.496 1.665 . . . . 0.0 115.496 166.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -64.68 -33.9 77.03 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 127.435 2.959 . . . . 0.0 110.858 175.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 52.1 mt -63.01 -21.22 66.0 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 122.567 2.44 . . . . 0.0 116.74 169.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 39.0 mt -89.05 -38.74 14.15 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 116.9 -1.524 . . . . 0.0 112.173 167.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.281 26.2 ttm105 -55.02 -53.13 59.67 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 123.964 1.84 . . . . 0.0 112.879 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.61 45.91 33.91 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-O 114.666 -3.297 . . . . 0.0 116.034 -172.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -118.26 -44.95 2.66 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 121.107 2.453 . . . . 0.0 115.018 -173.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 50.7 mtt -70.34 148.36 48.55 Favored 'General case' 0 N--CA 1.447 -0.586 2 O-C-N 113.286 -5.884 . . . . 0.0 114.43 179.372 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 73.0 p -74.96 161.36 29.57 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 128.063 2.545 . . . . 0.0 115.452 158.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -55.02 -24.42 24.46 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.557 0.694 . . . . 0.0 112.119 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 67.0 ttt-85 -77.1 -39.59 48.97 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 127.553 2.341 . . . . 0.0 110.61 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -70.68 -45.44 65.05 Favored 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 127.229 2.831 . . . . 0.0 108.229 174.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 44.7 mt -49.72 -41.02 42.49 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 117.451 2.389 . . . . 0.0 117.451 173.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 17.7 tptp -62.32 -43.91 97.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.479 2.311 . . . . 0.0 116.491 171.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -114.95 -24.09 8.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 126.02 1.728 . . . . 0.0 113.104 -158.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -105.7 -13.89 15.42 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 125.121 1.368 . . . . 0.0 113.862 175.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 57.4 mt -137.62 -3.6 1.87 Allowed 'General case' 0 N--CA 1.446 -0.628 1 O-C-N 116.044 -4.16 . . . . 0.0 108.398 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 84.46 2.75 88.89 Favored Glycine 0 C--N 1.336 0.561 0 O-C-N 120.033 -1.667 . . . . 0.0 113.902 164.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.54 133.76 52.24 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.602 -3.293 . . . . 0.0 118.306 -172.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.59 177.6 39.09 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 127.978 2.704 . . . . 0.0 114.471 174.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 40.6 mm -70.19 -35.86 65.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 O-C-N 118.071 -3.017 . . . . 0.0 111.513 -161.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.35 -36.62 81.77 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 113.894 -2.955 . . . . 0.0 113.127 170.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 74.9 m -54.89 -54.3 44.27 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 127.898 3.249 . . . . 0.0 114.1 172.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 20.4 mm -79.62 -37.05 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 112.527 -2.124 . . . . 0.0 112.391 -170.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 18.6 m -55.4 -47.39 75.96 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 116.154 -1.879 . . . . 0.0 109.724 168.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -55.68 -53.67 53.64 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 123.13 2.695 . . . . 0.0 116.198 173.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -49.24 -31.68 12.65 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 116.042 1.177 . . . . 0.0 116.042 166.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 60.4 p -81.83 -36.31 28.44 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.377 -2.249 . . . . 0.0 114.026 173.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -62.49 -30.48 71.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 115.847 -2.025 . . . . 0.0 114.778 167.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 50.7 m -66.84 -32.04 73.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 122.2 2.273 . . . . 0.0 112.079 171.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 5.7 mt -73.82 -35.27 64.84 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 115.68 -2.105 . . . . 0.0 112.409 168.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -66.82 -36.19 81.79 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 121.011 1.732 . . . . 0.0 114.635 164.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.24 -28.26 67.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 118.086 -2.884 . . . . 0.0 108.4 175.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.76 145.82 97.32 Favored Pre-proline 0 N--CA 1.446 -0.647 0 CA-C-N 123.811 3.005 . . . . 0.0 111.306 -170.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -72.9 153.89 53.16 Favored 'Trans proline' 0 N--CA 1.449 -1.122 0 C-N-CA 124.397 3.398 . . . . 0.0 111.526 173.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 16.7 m -64.47 -19.07 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 O-C-N 118.434 -2.666 . . . . 0.0 116.192 -177.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -77.18 -16.07 59.25 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.356 1.462 . . . . 0.0 113.738 173.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 18.0 tp -90.85 -47.57 7.53 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 118.209 -2.807 . . . . 0.0 114.248 161.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.1 mtp85 -57.75 -48.06 80.71 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 116.2 -1.857 . . . . 0.0 114.404 -176.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -78.82 -12.07 60.01 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 127.088 2.743 . . . . 0.0 115.063 177.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -76.69 -45.0 31.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.563 1.145 . . . . 0.0 109.744 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 11.4 mt -62.08 -42.95 99.74 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 118.726 -2.484 . . . . 0.0 113.528 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -58.95 -31.53 68.8 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 115.689 -2.404 . . . . 0.0 115.257 -178.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -92.74 -27.38 17.26 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 128.521 2.728 . . . . 0.0 118.156 -171.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.39 -42.05 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 O-C-N 119.086 -2.259 . . . . 0.0 110.351 168.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 75.9 mt -77.49 -77.04 0.16 Allowed 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 123.574 0.546 . . . . 0.0 112.125 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 13.3 mt -77.35 -24.83 50.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.204 1.401 . . . . 0.0 110.77 -153.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -61.03 -22.46 64.58 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 123.641 2.928 . . . . 0.0 110.896 171.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 49.5 m -110.85 8.93 22.45 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 129.588 3.155 . . . . 0.0 115.305 -177.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 26.5 t70 . . . . . 0 C--O 1.25 1.095 0 N-CA-C 116.102 1.89 . . . . 0.0 116.102 178.413 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 19.8 ttt . . . . . 0 N--CA 1.471 0.604 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.53 159.13 25.21 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 122.451 1.12 . . . . 0.0 110.419 -173.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -152.82 155.3 36.85 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.453 2.301 . . . . 0.0 107.745 -167.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -154.32 111.42 3.38 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -164.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 81.5 p -101.02 159.03 30.64 Favored Pre-proline 0 N--CA 1.444 -0.736 0 O-C-N 118.992 -2.318 . . . . 0.0 109.042 -175.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -63.5 -28.93 70.75 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 CA-C-O 115.851 -1.812 . . . . 0.0 112.977 -167.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -153.67 142.63 21.19 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 127.827 3.205 . . . . 0.0 111.957 176.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 44.5 t -133.81 118.77 18.41 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 125.665 2.65 . . . . 0.0 107.092 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.79 -20.2 60.54 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.482 -2.011 . . . . 0.0 109.333 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.19 -26.91 32.94 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 121.752 2.069 . . . . 0.0 112.84 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 17.9 mtt -70.1 -31.94 69.74 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 121.104 3.742 . . . . 0.0 121.104 151.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.84 -40.25 83.68 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 126.147 1.779 . . . . 0.0 112.352 163.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -71.72 -37.7 70.59 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 116.369 -2.132 . . . . 0.0 112.898 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -63.15 -29.76 71.05 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.911 1.284 . . . . 0.0 112.033 173.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . 0.28 0.0 OUTLIER -66.15 -39.3 89.71 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 118.36 -2.713 . . . . 0.0 112.826 163.037 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -68.16 -38.49 82.16 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 115.417 -2.23 . . . . 0.0 113.375 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.255 31.5 mm-40 -67.53 -37.47 82.79 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 172.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -61.19 -40.51 94.21 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 115.734 -2.079 . . . . 0.0 113.697 169.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 19' ' ' TRP . . . . . 0.498 ' CZ2' HD13 ' D' ' 39' ' ' LEU . 24.8 t-105 -63.89 -46.09 86.41 Favored 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 129.713 4.383 . . . . 0.0 113.519 177.015 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.44 -30.98 70.92 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 113.022 -1.899 . . . . 0.0 109.795 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -67.93 -27.67 66.83 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 118.557 -2.589 . . . . 0.0 115.484 172.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -61.21 -41.91 97.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 119.887 -1.758 . . . . 0.0 114.889 156.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 83.6 t -70.59 -41.76 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 C-N-CA 128.474 2.71 . . . . 0.0 112.0 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.61 -44.83 89.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 117.84 -1.076 . . . . 0.0 113.884 169.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 34.1 tp -56.79 -48.85 76.99 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 120.376 1.444 . . . . 0.0 111.651 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 25.9 tp -63.98 -34.8 78.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.394 1.878 . . . . 0.0 111.668 176.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -60.76 -39.0 87.12 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 118.224 -2.798 . . . . 0.0 114.348 -178.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -76.85 -19.13 57.86 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 125.529 1.768 . . . . 0.0 115.272 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 -22.1 35.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.148 -2.22 . . . . 0.0 113.877 -172.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -56.83 -46.64 81.57 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 116.363 -3.96 . . . . 0.0 104.534 170.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -58.67 -35.62 72.86 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 117.041 -3.537 . . . . 0.0 112.065 -170.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -106.26 9.04 32.16 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 117.425 2.38 . . . . 0.0 117.425 174.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.41 7.7 m-20 49.47 39.41 16.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 119.094 -2.254 . . . . 0.0 113.095 177.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 33.9 mt -86.43 -0.35 55.81 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.669 2.388 . . . . 0.0 110.937 160.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -53.65 -51.04 64.39 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 121.19 1.814 . . . . 0.0 109.374 -169.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 mt -62.05 -52.88 64.33 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-O 115.856 -2.021 . . . . 0.0 114.676 174.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . 0.282 70.5 Cg_exo -43.36 -47.11 9.28 Favored 'Trans proline' 0 N--CA 1.45 -1.054 1 C-N-CA 127.458 5.438 . . . . 0.0 116.259 166.567 . . . . . . . . 3 2 . 1 . 012 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 tp -64.99 -37.4 87.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 116.987 2.217 . . . . 0.0 116.987 171.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.292 33.0 mt -77.43 -25.14 50.43 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 127.545 3.028 . . . . 0.0 110.921 177.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -59.31 -44.54 92.55 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 117.733 -1.127 . . . . 0.0 108.779 166.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 41' ' ' LEU . . . . . 0.422 HD22 HD21 ' D' ' 96' ' ' LEU . 64.1 tp -75.71 -46.35 31.59 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.989 2.515 . . . . 0.0 111.506 -169.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 84.7 mmm -88.77 -14.77 36.32 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.912 -1.117 . . . . 0.0 113.187 -163.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mp -125.48 164.9 19.46 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 122.536 1.16 . . . . 0.0 109.092 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 69.7 p -97.22 169.37 8.74 Favored Pre-proline 0 N--CA 1.448 -0.564 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 175.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -54.51 -45.8 38.27 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.685 2.257 . . . . 0.0 113.668 174.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -42.92 97.19 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.542 1.937 . . . . 0.0 111.63 177.091 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -59.52 -32.18 70.07 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.417 1.487 . . . . 0.0 114.047 179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 95.9 mtm-85 -88.02 -34.93 17.84 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 127.665 2.386 . . . . 0.0 112.733 177.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -60.33 -41.18 93.01 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 117.092 2.256 . . . . 0.0 117.092 162.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.12 -53.92 15.01 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 119.425 -2.047 . . . . 0.0 115.303 169.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 26.3 mt -75.71 -32.66 60.16 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 126.371 2.295 . . . . 0.0 115.863 -174.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.9 -33.08 86.07 Favored Glycine 0 N--CA 1.448 -0.521 0 O-C-N 120.363 -1.46 . . . . 0.0 110.153 166.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 27.4 m -80.7 -47.26 14.26 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.85 0.825 . . . . 0.0 111.743 -178.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.304 89.0 mtt180 -53.39 -24.43 12.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 167.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 39.8 t -68.24 -38.87 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 O-C-N 117.078 -3.514 . . . . 0.0 113.157 169.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 33.9 mtp180 -81.53 -1.7 47.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 123.772 0.829 . . . . 0.0 109.001 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 57' ' ' ILE . . . . . 0.425 HG23 HD23 ' C' ' 75' ' ' LEU . 79.9 mt -95.17 -52.05 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 O-C-N 119.678 -1.889 . . . . 0.0 108.495 170.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 37.4 t -46.64 -52.58 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 C-N-CA 128.282 2.633 . . . . 0.0 116.949 166.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -56.04 -47.46 77.81 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 122.25 1.024 . . . . 0.0 112.223 173.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -72.53 -18.62 61.63 Favored 'General case' 0 N--CA 1.452 -0.364 1 O-C-N 115.175 -4.703 . . . . 0.0 113.083 -171.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 60.3 mt -87.5 -31.76 19.79 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 118.384 -2.698 . . . . 0.0 108.313 173.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 24.3 mt -68.55 -10.81 58.14 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 118.507 -2.621 . . . . 0.0 114.358 160.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttm105 -104.32 -43.02 5.32 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 125.302 1.626 . . . . 0.0 113.084 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.11 2.16 60.89 Favored Glycine 0 C--N 1.336 0.583 0 O-C-N 119.238 -2.164 . . . . 0.0 112.497 158.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -89.26 -17.41 29.07 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 120.977 -1.308 . . . . 0.0 114.351 -166.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 10.7 mmt -56.08 125.89 23.57 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.409 1.483 . . . . 0.0 114.589 177.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . 0.285 55.4 p -78.14 166.64 22.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.932 2.02 . . . . 0.0 110.233 169.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -51.03 -29.88 13.89 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 116.555 2.057 . . . . 0.0 116.555 169.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 -65.74 -44.17 86.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 125.557 2.598 . . . . 0.0 107.788 172.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -75.56 -39.21 58.5 Favored 'General case' 0 N--CA 1.452 -0.336 1 O-C-N 116.027 -4.171 . . . . 0.0 111.572 -174.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 96.8 mt -56.76 -6.59 0.34 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 118.637 2.828 . . . . 0.0 118.637 166.068 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -112.1 -65.07 1.21 Allowed 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 125.551 1.782 . . . . 0.0 109.912 171.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -85.53 -9.73 56.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 112.96 -3.4 . . . . 0.0 115.892 -169.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -105.74 -45.81 4.3 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 128.71 2.804 . . . . 0.0 114.752 173.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 75' ' ' LEU . . . . . 0.425 HD23 HG23 ' C' ' 57' ' ' ILE . 5.2 mp -86.51 -12.06 49.92 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 116.865 -1.54 . . . . 0.0 111.659 177.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 58.51 -133.56 52.68 Favored Glycine 0 C--N 1.338 0.641 0 CA-C-N 120.6 1.545 . . . . 0.0 110.848 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.72 -23.78 9.99 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 126.687 2.051 . . . . 0.0 110.756 -162.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.07 -13.19 6.41 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 127.404 2.43 . . . . 0.0 117.382 167.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 19.2 tt -58.3 -39.63 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 1 O-C-N 116.181 -4.129 . . . . 0.0 115.501 175.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.91 -56.13 11.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 116.919 -1.515 . . . . 0.0 111.975 168.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . 0.337 28.3 m -55.57 -37.98 68.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 125.977 2.048 . . . . 0.0 113.889 -179.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 6.5 mm -70.58 -23.54 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-O 115.105 -2.378 . . . . 0.0 115.509 170.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 52.9 p -122.51 -17.86 6.85 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 129.71 3.204 . . . . 0.0 114.925 -164.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 74.3 mtp85 -104.05 149.44 25.18 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.883 3.673 . . . . 0.0 112.283 171.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 98.28 153.45 28.66 Favored Glycine 0 C--N 1.337 0.6 0 CA-C-N 121.216 1.826 . . . . 0.0 109.498 -176.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 4.3 m -75.66 9.92 2.02 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 128.522 2.729 . . . . 0.0 117.045 176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -118.89 -2.64 10.83 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.684 1.593 . . . . 0.0 115.072 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 80.1 p -45.75 166.84 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.01 1.324 . . . . 0.0 114.43 172.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 42.7 tp -56.37 -35.76 68.05 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.618 2.451 . . . . 0.0 117.618 -164.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -90.15 -25.2 20.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 126.785 2.034 . . . . 0.0 113.033 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.94 -12.66 59.36 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 125.581 1.801 . . . . 0.0 111.801 174.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.24 161.23 5.56 Favored Pre-proline 0 N--CA 1.45 -0.457 0 C-N-CA 128.625 2.77 . . . . 0.0 113.701 174.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -68.76 143.78 57.14 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 125.08 3.853 . . . . 0.0 112.411 177.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 81.0 t -54.47 -39.73 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 124.921 1.288 . . . . 0.0 114.439 -173.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 15.6 pm0 -63.85 -33.94 76.8 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 112.511 -3.614 . . . . 0.0 113.523 173.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 32.7 tp -71.16 -43.95 66.48 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 127.558 3.036 . . . . 0.0 116.261 172.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -63.69 -39.5 94.48 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 115.488 -2.196 . . . . 0.0 110.231 -174.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -81.69 -32.75 31.59 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 116.532 -1.699 . . . . 0.0 110.635 172.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.3 t90 -67.17 -42.93 83.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 122.598 2.454 . . . . 0.0 112.645 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 22.6 mt -66.5 -16.69 64.33 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 123.604 2.911 . . . . 0.0 114.116 172.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -78.8 -18.89 53.36 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.133 1.773 . . . . 0.0 111.507 172.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -100.18 -41.98 6.88 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 120.173 -1.579 . . . . 0.0 108.963 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 48.9 t -72.12 -62.05 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.492 1 C-N-CA 131.822 4.049 . . . . 0.0 114.54 176.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . 0.26 38.9 mt -77.65 -18.03 57.13 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 124.414 3.279 . . . . 0.0 109.796 -171.475 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 90.4 mt -117.66 50.84 1.09 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 121.039 1.745 . . . . 0.0 114.817 -169.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.257 17.3 pttp -88.42 124.49 34.01 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.605 3.066 . . . . 0.0 112.591 -157.597 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 17.2 m -125.02 3.87 7.99 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 127.404 2.94 . . . . 0.0 110.583 176.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 58.0 t0 . . . . . 0 C--O 1.252 1.226 0 CA-C-O 115.529 -2.177 . . . . 0.0 110.903 169.44 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.469 0.501 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.91 149.08 27.87 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -166.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -128.35 137.31 51.86 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.289 1.435 . . . . 0.0 110.781 171.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -127.34 143.09 51.28 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 127.48 2.312 . . . . 0.0 111.275 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 5' ' ' SER . . . . . 0.451 ' HB2' ' HD2' ' D' ' 6' ' ' PRO . 78.0 p -95.33 153.01 39.72 Favored Pre-proline 0 N--CA 1.451 -0.381 0 C-N-CA 128.564 2.746 . . . . 0.0 110.277 173.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 6' ' ' PRO . . . . . 0.451 ' HD2' ' HB2' ' D' ' 5' ' ' SER . 68.8 Cg_endo -57.86 -30.8 90.72 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 122.935 2.423 . . . . 0.0 113.12 -175.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -148.57 142.91 26.23 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 129.189 2.995 . . . . 0.0 106.914 164.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 26.6 t -76.46 128.26 34.44 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 125.743 2.687 . . . . 0.0 112.263 -173.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.74 -20.86 37.75 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 118.075 -2.891 . . . . 0.0 114.288 165.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -83.76 -33.09 25.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 120.737 -1.227 . . . . 0.0 112.797 172.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 16.6 mmt -66.68 -42.81 85.94 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 118.404 -2.685 . . . . 0.0 112.531 173.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.9 -39.48 62.77 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 169.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -65.15 -55.31 19.41 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.471 -2.018 . . . . 0.0 107.466 176.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -50.92 -44.56 60.19 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.918 2.087 . . . . 0.0 109.331 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -11.25 47.8 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 124.425 3.284 . . . . 0.0 110.816 173.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -95.91 -19.28 19.67 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.974 -2.329 . . . . 0.0 108.754 168.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -86.36 -33.24 20.6 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.318 -3.364 . . . . 0.0 114.273 176.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -67.29 -33.0 74.37 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 126.637 3.113 . . . . 0.0 111.908 173.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -62.99 -51.14 67.99 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 112.782 -2.008 . . . . 0.0 112.682 168.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.64 -16.97 62.87 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.116 -2.24 . . . . 0.0 111.717 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 49.2 ttt-85 -84.1 -6.46 59.41 Favored 'General case' 0 N--CA 1.449 -0.523 1 O-C-N 116.083 -4.135 . . . . 0.0 118.628 161.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -76.06 -41.28 51.13 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 119.28 -2.137 . . . . 0.0 113.207 149.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 99.3 t -66.42 -39.66 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 O-C-N 121.189 -0.945 . . . . 0.0 113.413 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -64.78 -39.63 93.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 124.652 2.168 . . . . 0.0 114.674 174.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 63.5 tp -67.38 -40.59 85.73 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 118.878 -2.389 . . . . 0.0 115.117 173.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 39.6 tp -74.14 -41.6 61.29 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.31 1.844 . . . . 0.0 110.293 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -51.79 -57.81 8.24 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 163.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -63.0 -31.74 72.94 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 117.465 -1.255 . . . . 0.0 110.728 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.82 -38.0 80.77 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 120.839 1.654 . . . . 0.0 114.726 167.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -72.62 -14.82 61.69 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 130.43 3.492 . . . . 0.0 109.958 170.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . 0.315 47.8 mt-30 -87.48 -14.9 39.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 118.697 -2.502 . . . . 0.0 109.554 176.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 32' ' ' ASN . . . . . 0.418 ' ND2' HD12 ' D' ' 34' ' ' LEU 0.39 47.2 p30 -128.76 5.46 5.52 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 129.166 2.986 . . . . 0.0 115.911 179.303 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 62.66 25.49 15.15 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 124.439 2.066 . . . . 0.0 112.826 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 34' ' ' LEU . . . . . 0.418 HD12 ' ND2' ' D' ' 32' ' ' ASN . 44.2 mt -88.37 -8.0 55.76 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.279 -2.763 . . . . 0.0 114.927 170.472 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -49.03 -57.56 6.35 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 127.967 2.507 . . . . 0.0 115.382 -173.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.321 3.1 mt -53.18 -52.87 61.83 Favored Pre-proline 0 N--CA 1.447 -0.582 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 177.485 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -62.63 -15.27 45.13 Favored 'Trans proline' 0 N--CA 1.446 -1.317 0 C-N-CA 122.322 2.015 . . . . 0.0 113.406 176.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 47.0 tp -77.46 -43.54 32.0 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 125.592 3.814 . . . . 0.0 111.386 164.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 39' ' ' LEU . . . . . 0.498 HD13 ' CZ2' ' C' ' 19' ' ' TRP . 25.2 mt -57.94 -45.09 87.17 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 125.413 3.733 . . . . 0.0 111.844 171.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -73.03 -23.32 60.58 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 119.572 -0.851 . . . . 0.0 111.831 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 19.2 tp -78.69 -27.6 45.07 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.347 -2.095 . . . . 0.0 111.059 170.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 13.2 mmt -89.24 -41.09 12.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 119.602 -1.936 . . . . 0.0 114.444 -174.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt -117.03 147.26 42.49 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 125.847 2.736 . . . . 0.0 112.798 -171.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 30.4 p -74.09 156.27 87.83 Favored Pre-proline 0 N--CA 1.45 -0.443 0 C-N-CA 128.721 2.808 . . . . 0.0 108.675 172.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -44.57 -44.01 13.94 Favored 'Trans proline' 0 N--CA 1.451 -1.024 1 C-N-CA 126.967 5.111 . . . . 0.0 122.168 173.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.265 18.9 m-20 -71.21 -22.44 62.01 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 120.376 3.473 . . . . 0.0 120.376 170.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -75.71 -36.54 59.97 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 126.143 2.152 . . . . 0.0 112.864 164.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 25.5 mtm180 -67.46 -43.7 80.44 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 126.205 2.191 . . . . 0.0 109.306 171.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -70.01 -35.84 74.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -170.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.28 -32.87 73.33 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 174.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 51' ' ' LEU . . . . . 0.426 ' HA ' HD23 ' D' ' 51' ' ' LEU . 23.9 mt -77.79 -49.12 14.98 Favored 'General case' 0 N--CA 1.45 -0.451 1 O-C-N 115.388 -4.57 . . . . 0.0 114.113 -176.695 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -51.44 -37.25 39.84 Favored Glycine 0 C--N 1.335 0.507 0 CA-C-O 122.637 1.132 . . . . 0.0 113.906 164.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 86.9 m -72.33 -42.27 65.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 118.017 -3.049 . . . . 0.0 108.582 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -55.3 -23.15 21.87 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 121.579 3.918 . . . . 0.0 121.579 170.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 24.4 t -64.48 -33.5 63.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 172.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -89.02 -20.77 23.97 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 172.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 57' ' ' ILE . . . . . 0.414 HD13 HG21 ' D' ' 57' ' ' ILE . 17.9 mt -54.19 -49.65 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 118.748 -2.47 . . . . 0.0 111.506 158.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 58' ' ' VAL . . . . . 0.536 HG22 HD12 ' D' ' 82' ' ' ILE . 65.0 t -68.24 -47.57 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 CA-C-O 117.028 -1.463 . . . . 0.0 109.63 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -51.12 -48.32 61.77 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 119.446 3.128 . . . . 0.0 119.446 170.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -65.42 -24.79 67.29 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.074 2.25 . . . . 0.0 117.074 172.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 59.3 mt -68.27 -13.44 62.26 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 121.859 2.118 . . . . 0.0 113.178 168.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 80.0 mt -104.6 -36.49 7.47 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 114.914 -2.47 . . . . 0.0 105.005 -177.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -81.4 -39.08 25.52 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.643 2.377 . . . . 0.0 113.083 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 53.01 41.67 59.92 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 120.168 2.827 . . . . 0.0 120.168 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -119.62 -1.91 10.55 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 117.806 -3.173 . . . . 0.0 116.231 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 8.5 mmt -129.86 39.51 3.69 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 128.702 2.801 . . . . 0.0 118.105 169.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 26.1 p -81.01 -179.95 7.58 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 110.235 -3.166 . . . . 0.0 117.532 -168.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 68' ' ' GLN . . . . . 0.518 ' O ' ' HE2' ' D' ' 72' ' ' LYS . 6.0 tp-100 63.05 -105.43 0.16 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 169.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -63.84 -43.01 97.45 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.331 1.452 . . . . 0.0 110.92 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -86.81 -16.09 37.26 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 116.876 2.176 . . . . 0.0 116.876 -171.081 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.42 -31.85 58.14 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.652 1.215 . . . . 0.0 109.664 176.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 72' ' ' LYS . . . . . 0.518 ' HE2' ' O ' ' D' ' 68' ' ' GLN 0.303 38.6 mtmt -72.09 -45.97 58.58 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 114.58 -1.191 . . . . 0.0 113.052 166.255 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -86.49 -25.81 24.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 124.299 2.0 . . . . 0.0 115.582 -163.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -122.39 -45.44 2.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 120.775 -1.203 . . . . 0.0 111.695 -171.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -69.46 -42.51 74.79 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.15 -2.844 . . . . 0.0 110.08 166.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.47 -167.22 18.86 Favored Glycine 0 C--N 1.339 0.742 0 CA-C-N 125.694 3.861 . . . . 0.0 122.273 155.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.71 -19.83 64.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.569 -1.548 . . . . 0.0 114.578 -164.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.45 -17.23 5.85 Favored Glycine 0 N--CA 1.446 -0.644 0 O-C-N 119.278 -2.139 . . . . 0.0 118.261 166.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 10.0 tt -52.5 -33.06 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 125.752 1.621 . . . . 0.0 108.032 -177.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -86.28 -12.48 49.39 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.736 2.414 . . . . 0.0 111.522 -173.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.3 m -79.75 -25.06 41.17 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 124.999 2.333 . . . . 0.0 114.004 165.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 82' ' ' ILE . . . . . 0.536 HD12 HG22 ' D' ' 58' ' ' VAL . 26.1 mm -100.11 -31.45 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 130.219 3.408 . . . . 0.0 115.215 -163.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 81.6 p -117.21 -2.73 11.58 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 126.348 2.28 . . . . 0.0 114.776 174.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.354 28.5 mtp85 -121.29 175.1 6.31 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 122.447 1.118 . . . . 0.0 112.872 167.361 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.99 160.96 27.67 Favored Glycine 0 N--CA 1.445 -0.706 0 O-C-N 118.054 -2.904 . . . . 0.0 114.165 -155.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 77.5 p -71.62 -42.01 68.17 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 118.759 -2.613 . . . . 0.0 112.968 -147.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -118.75 63.92 0.77 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.476 2.71 . . . . 0.0 106.652 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . 0.266 3.1 p -73.46 -175.46 1.97 Allowed 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 117.424 2.379 . . . . 0.0 117.424 173.574 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.27 5.5 tp -54.76 -32.95 60.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 113.187 -3.292 . . . . 0.0 111.446 162.298 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -72.44 -2.14 18.36 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.005 2.691 . . . . 0.0 114.03 174.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -124.28 -23.72 4.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 116.359 -1.781 . . . . 0.0 113.76 -171.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . 0.292 . . 63.3 94.37 0.05 OUTLIER Pre-proline 0 N--CA 1.447 -0.576 0 CA-C-N 121.671 2.032 . . . . 0.0 112.226 148.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.324 32.1 Cg_exo 33.81 32.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 129.216 0.923 . . . . 0.0 114.351 36.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 88.0 t -56.51 -17.74 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 C-N-CA 127.988 2.515 . . . . 0.0 110.022 176.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.285 0.1 OUTLIER -92.31 -49.36 6.2 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 117.984 -2.948 . . . . 0.0 112.899 -173.739 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' D' D ' 96' ' ' LEU . . . . . 0.422 HD21 HD22 ' C' ' 41' ' ' LEU . 54.2 tp -38.38 -53.16 1.53 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 128.138 3.399 . . . . 0.0 109.531 150.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 31.7 ttp180 -65.87 -50.99 62.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 122.977 1.37 . . . . 0.0 111.856 -167.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.99 -28.05 15.55 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.137 -1.392 . . . . 0.0 113.726 170.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 45.6 t90 -85.61 -43.51 13.41 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -177.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.52 -38.86 69.79 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 125.614 1.821 . . . . 0.0 108.974 166.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -72.67 -14.82 61.67 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.873 1.321 . . . . 0.0 112.826 -177.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -94.2 -46.05 7.25 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.983 -2.323 . . . . 0.0 111.724 169.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 97.7 t -68.0 -27.92 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 O-C-N 119.345 -2.097 . . . . 0.0 113.869 177.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 82.6 mt -108.78 -18.87 13.6 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 122.055 2.207 . . . . 0.0 114.369 -171.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 4.6 mp -105.96 23.81 13.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.094 -2.879 . . . . 0.0 108.506 168.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 16.8 pttp -61.19 169.13 2.23 Favored 'General case' 0 N--CA 1.448 -0.534 1 C-N-CA 132.419 4.288 . . . . 0.0 113.342 -172.59 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 45.5 m -49.73 -45.56 49.4 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 110.654 -2.975 . . . . 0.0 114.557 -170.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 113.362 -3.208 . . . . 0.0 116.089 177.354 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -49.79 -46.09 50.48 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 120.585 -1.322 . . . . 0.0 113.92 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -74.67 -14.58 60.76 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -175.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -107.44 1.66 23.71 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.588 2.755 . . . . 0.0 111.703 178.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 29.2 m -132.61 103.54 13.43 Favored Pre-proline 0 N--CA 1.447 -0.583 0 O-C-N 116.993 -3.567 . . . . 0.0 110.4 -174.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -56.13 -25.44 54.95 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 N-CA-C 120.388 3.188 . . . . 0.0 120.388 158.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -131.65 135.28 46.79 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 119.176 -2.203 . . . . 0.0 112.035 -167.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.3 t -149.09 138.8 21.86 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 104.727 -2.323 . . . . 0.0 104.727 158.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.24 -20.41 41.84 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 112.186 -3.769 . . . . 0.0 113.477 169.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -90.36 -20.18 23.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 122.457 2.389 . . . . 0.0 110.165 -174.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . 0.253 16.5 tpt -84.72 -43.09 14.63 Favored 'General case' 0 N--CA 1.45 -0.434 1 O-C-N 115.739 -4.35 . . . . 0.0 106.509 176.604 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -27.93 65.11 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 111.933 -3.889 . . . . 0.0 112.391 166.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -73.64 -38.75 64.91 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 126.517 2.386 . . . . 0.0 111.116 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -59.98 -42.14 93.52 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 127.163 2.79 . . . . 0.0 111.147 171.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -68.65 -34.39 75.64 Favored 'General case' 0 N--CA 1.448 -0.555 1 O-C-N 115.75 -4.344 . . . . 0.0 114.096 170.141 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.6 t60 -64.86 -32.58 74.35 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 121.993 2.179 . . . . 0.0 114.6 171.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -67.36 -35.72 79.93 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 174.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -75.28 -30.08 60.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.262 -2.149 . . . . 0.0 109.104 -175.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -76.45 -40.52 50.27 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 119.707 1.139 . . . . 0.0 111.096 172.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 20' ' ' LEU . 51.3 mt -71.96 -15.81 62.08 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.476 -1.39 . . . . 0.0 109.68 -171.639 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.2 ttt180 -54.03 -57.39 11.23 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 120.162 -1.586 . . . . 0.0 113.582 167.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.591 ' CE1' HD22 ' A' ' 26' ' ' LEU . 77.5 t80 -49.89 -35.15 22.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 120.41 1.459 . . . . 0.0 114.427 168.065 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.0 t -67.42 -51.83 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 121.225 -0.922 . . . . 0.0 112.533 -175.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -71.46 -23.72 61.88 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 125.435 2.541 . . . . 0.0 110.787 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.0 tp -75.13 -43.58 51.83 Favored 'General case' 0 N--CA 1.451 -0.41 1 O-C-N 114.244 -5.285 . . . . 0.0 108.307 173.28 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.591 HD22 ' CE1' ' A' ' 22' ' ' PHE . 20.9 tp -64.66 -31.03 72.07 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 116.639 -1.648 . . . . 0.0 110.103 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -57.01 -58.07 9.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 127.599 3.062 . . . . 0.0 109.13 173.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -60.57 -37.79 82.45 Favored 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 117.496 -3.253 . . . . 0.0 108.432 175.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.87 -41.31 83.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.716 -3.115 . . . . 0.0 113.569 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.487 ' CE1' ' HB2' ' B' ' 27' ' ' LYS . 16.9 m-85 -61.44 -35.99 79.13 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 124.708 3.413 . . . . 0.0 112.186 172.034 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.316 84.6 mt-30 -62.78 -16.65 58.93 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 119.448 -2.033 . . . . 0.0 115.139 173.276 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -124.38 18.84 8.95 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 127.627 2.371 . . . . 0.0 116.52 -176.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 41.32 33.24 0.25 Allowed 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 -165.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.1 mt -91.11 -5.8 54.6 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.577 2.751 . . . . 0.0 114.005 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -68.54 -41.42 79.86 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 113.405 -3.188 . . . . 0.0 113.923 -167.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 36' ' ' LEU 0.28 39.9 mt -61.9 -50.77 79.65 Favored Pre-proline 0 N--CA 1.448 -0.542 0 O-C-N 126.3 2.25 . . . . 0.0 112.593 165.285 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . 0.261 84.8 Cg_exo -51.25 -39.73 61.91 Favored 'Trans proline' 0 N--CA 1.451 -1.004 1 C-N-CA 127.94 5.76 . . . . 0.0 113.256 174.811 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.4 tp -81.39 -36.23 29.79 Favored 'General case' 0 N--CA 1.449 -0.522 1 O-C-N 115.153 -4.717 . . . . 0.0 111.643 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.9 mt -74.5 -30.54 61.85 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 126.14 1.776 . . . . 0.0 115.517 -177.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -66.75 -30.05 70.17 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 125.972 2.045 . . . . 0.0 113.625 163.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tt -69.72 -48.15 60.59 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 127.614 2.366 . . . . 0.0 111.019 173.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 80.4 mmm -91.44 -11.42 37.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.124 -2.86 . . . . 0.0 115.243 -162.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.8 mt -130.34 136.62 49.3 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 128.04 2.536 . . . . 0.0 110.714 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.2 p -94.49 157.97 36.36 Favored Pre-proline 0 N--CA 1.448 -0.555 0 O-C-N 119.154 -2.216 . . . . 0.0 112.393 176.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -47.89 -39.79 32.12 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.566 2.177 . . . . 0.0 116.135 -169.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . 0.288 5.3 p-10 -72.77 -18.89 61.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 129.121 2.968 . . . . 0.0 112.528 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -97.01 -32.53 11.95 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.884 1.274 . . . . 0.0 108.356 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.2 mtm-85 -69.54 -44.37 71.1 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 119.919 -1.738 . . . . 0.0 112.763 173.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -68.82 -14.56 63.1 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 112.043 -3.837 . . . . 0.0 112.158 166.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.45 -46.99 62.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 123.553 2.888 . . . . 0.0 113.035 164.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.06 -42.2 73.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 118.834 -2.416 . . . . 0.0 110.551 -173.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.26 -42.58 82.89 Favored Glycine 0 C--N 1.333 0.405 0 O-C-N 117.113 -3.492 . . . . 0.0 114.484 167.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.5 m -68.82 -33.15 73.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 124.064 1.887 . . . . 0.0 112.861 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.21 -24.12 67.04 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 116.746 2.128 . . . . 0.0 116.746 178.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.332 5.0 t -61.99 -39.6 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-O 117.171 -1.395 . . . . 0.0 108.138 172.085 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -70.53 -31.79 69.0 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 121.257 1.844 . . . . 0.0 113.687 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 95.3 mt -64.14 -48.92 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 117.126 -1.416 . . . . 0.0 107.895 176.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.1 t -61.89 -41.56 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-O 115.776 -2.059 . . . . 0.0 112.637 170.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -58.4 -53.2 61.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 123.372 2.806 . . . . 0.0 112.023 174.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -67.15 -26.4 66.65 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.316 76.6 mt -81.93 -35.87 28.66 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.101 2.96 . . . . 0.0 112.151 173.033 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 tp -72.12 -45.75 59.33 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 114.418 -2.706 . . . . 0.0 113.292 171.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -53.24 -55.66 22.69 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 120.61 1.55 . . . . 0.0 110.375 163.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.81 -0.8 89.39 Favored Glycine 0 C--N 1.333 0.391 0 CA-C-O 116.561 -2.244 . . . . 0.0 114.503 171.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -75.39 -4.92 42.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 120.437 3.495 . . . . 0.0 120.437 -176.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 94.6 mtp -106.2 155.83 19.07 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 129.252 3.021 . . . . 0.0 113.901 167.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 60.4 p -83.63 156.67 22.58 Favored 'General case' 0 N--CA 1.447 -0.615 0 O-C-N 124.476 1.11 . . . . 0.0 112.647 164.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -42.82 -39.8 2.64 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 120.573 -1.33 . . . . 0.0 111.429 166.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.8 tpt85 -79.77 -23.49 42.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 115.656 -2.116 . . . . 0.0 110.96 -175.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -76.12 -31.93 58.91 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 121.954 2.161 . . . . 0.0 112.99 168.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.8 mt -68.14 -31.39 70.94 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 124.39 2.043 . . . . 0.0 114.863 175.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -50.94 -54.39 24.66 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 117.55 -3.219 . . . . 0.0 108.83 174.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -59.2 -38.04 78.91 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.923 1.082 . . . . 0.0 113.923 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -70.56 -32.6 70.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 119.448 -2.033 . . . . 0.0 110.307 -177.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 74.3 mt -119.44 -26.45 5.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -156.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 81.77 -28.29 3.21 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 120.469 2.948 . . . . 0.0 120.469 174.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.6 163.83 25.89 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 120.226 -1.749 . . . . 0.0 110.058 -173.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.28 140.85 34.59 Favored Glycine 0 C--N 1.339 0.702 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -177.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.346 89.1 mt -53.07 -27.38 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-O 116.104 -1.903 . . . . 0.0 111.757 -178.237 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.42 -36.15 53.7 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 120.163 1.347 . . . . 0.0 111.064 175.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 56.5 p -80.9 -23.88 38.66 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 119.614 -1.929 . . . . 0.0 110.922 -173.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 50.0 mm -78.81 -42.5 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 C-N-CA 127.529 2.332 . . . . 0.0 108.999 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.4 m -67.89 -33.95 75.71 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.837 1.255 . . . . 0.0 108.477 177.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.1 ttt180 -61.55 -46.65 89.0 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 121.796 -0.565 . . . . 0.0 110.762 172.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.28 -26.82 74.27 Favored Glycine 0 C--N 1.334 0.426 0 CA-C-O 117.065 -1.964 . . . . 0.0 113.487 175.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 58.1 m -63.54 -40.29 96.62 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.261 1.825 . . . . 0.0 110.789 174.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -68.88 -43.86 74.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 116.988 -1.482 . . . . 0.0 113.96 169.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.0 m -63.26 -25.87 68.52 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 127.21 2.204 . . . . 0.0 106.666 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.0 tp -85.44 -32.35 22.35 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 117.117 -3.489 . . . . 0.0 115.901 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -78.28 -38.0 43.61 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.875 2.07 . . . . 0.0 109.069 -173.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.56 -13.03 60.34 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 129.743 3.217 . . . . 0.0 116.132 167.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.82 126.72 92.25 Favored Pre-proline 0 N--CA 1.449 -0.48 0 C-N-CA 131.088 3.755 . . . . 0.0 107.771 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -59.93 152.48 64.12 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 O-C-N 128.209 3.742 . . . . 0.0 115.298 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -34.88 67.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 CA-C-O 116.395 -1.764 . . . . 0.0 111.086 -173.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 95' ' ' GLU . 8.6 pm0 -71.83 -18.07 62.1 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 122.174 2.261 . . . . 0.0 111.896 -178.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 13.6 tp -85.52 -36.35 20.56 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 58.2 mtm-85 -82.41 -35.06 28.0 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 117.545 -3.222 . . . . 0.0 115.934 -171.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -69.58 -6.06 28.59 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.095 1.758 . . . . 0.0 114.148 165.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 40.3 t90 -98.97 -48.34 4.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 117.996 2.591 . . . . 0.0 117.996 166.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.0 mt -61.59 -32.7 72.82 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 120.015 -1.678 . . . . 0.0 111.589 177.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.93 -22.63 65.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 122.608 2.458 . . . . 0.0 115.992 172.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -93.9 -7.7 42.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 118.799 -2.438 . . . . 0.0 113.381 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 54.1 t -118.95 -25.36 2.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 127.456 2.972 . . . . 0.0 113.905 -175.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 68.5 mt -103.57 -39.34 6.76 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 118.587 -2.571 . . . . 0.0 116.308 167.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.2 mt -88.57 -33.61 17.64 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 119.84 -1.787 . . . . 0.0 115.318 -175.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -66.77 -9.96 42.34 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.448 -1.263 . . . . 0.0 113.73 -166.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.5 p -71.54 -24.01 61.87 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 118.703 2.853 . . . . 0.0 118.703 166.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.357 1.4 m-20 . . . . . 0 C--O 1.248 1.018 0 O-C-N 119.217 -2.177 . . . . 0.0 109.537 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.1 -46.52 80.73 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 118.048 -2.907 . . . . 0.0 112.282 -165.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -76.32 7.6 4.18 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 113.57 -1.65 . . . . 0.0 111.035 176.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 61.7 tp60 -122.28 -48.08 2.1 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 117.425 -3.297 . . . . 0.0 109.865 -171.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 40.6 m -81.57 135.41 49.67 Favored Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-O 117.14 -1.409 . . . . 0.0 111.493 -170.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -55.39 -30.43 72.97 Favored 'Trans proline' 0 N--CA 1.448 -1.185 0 C-N-CA 123.349 2.699 . . . . 0.0 113.394 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -109.06 133.35 53.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 118.136 -2.853 . . . . 0.0 112.231 164.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.2 t -134.2 144.09 48.25 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.602 1.334 . . . . 0.0 114.602 161.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.18 -30.14 67.2 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.438 -2.038 . . . . 0.0 112.147 165.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.307 . . -61.42 -49.32 77.32 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 126.275 1.83 . . . . 0.0 108.96 170.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 16.5 mmt -74.85 -28.22 60.58 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -174.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.19 75.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 168.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.8 -39.52 66.62 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.787 2.835 . . . . 0.0 114.537 165.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 8.9 tp60 -57.47 -44.03 84.52 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 119.938 -1.726 . . . . 0.0 112.313 171.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 51.7 mmt-85 -74.42 -29.0 61.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 120.926 1.694 . . . . 0.0 112.336 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -75.27 -39.64 59.57 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 117.991 -2.943 . . . . 0.0 113.943 170.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -64.72 -38.81 92.27 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 129.216 3.006 . . . . 0.0 109.384 169.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -70.19 -36.67 74.78 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 119.108 -2.245 . . . . 0.0 111.591 178.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -63.65 -50.15 70.42 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 116.567 -1.683 . . . . 0.0 109.105 170.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 82.6 mt -64.66 -14.2 57.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 122.131 2.241 . . . . 0.0 113.525 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -56.41 -54.17 48.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 128.56 2.744 . . . . 0.0 108.33 171.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -65.39 -52.24 54.91 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.528 0.731 . . . . 0.0 111.692 -178.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . 0.256 4.2 t -44.19 -48.98 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 126.221 1.808 . . . . 0.0 111.642 178.134 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -73.44 -41.8 62.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 128.448 3.592 . . . . 0.0 109.282 -171.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 33.8 tp -64.53 -43.7 93.17 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.37 176.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 41.1 tp -65.02 -32.88 74.82 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 120.694 -1.254 . . . . 0.0 114.008 171.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.487 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 57.7 tttt -64.14 -41.48 97.18 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.486 -2.009 . . . . 0.0 112.43 171.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -58.35 -39.15 78.75 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 123.015 2.643 . . . . 0.0 112.811 166.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.8 -33.4 62.22 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.539 -1.35 . . . . 0.0 113.281 -176.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -54.75 -47.7 73.54 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.94 2.096 . . . . 0.0 112.732 169.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -70.77 -6.31 36.65 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.286 1.834 . . . . 0.0 114.426 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -119.86 23.64 10.97 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.556 1.942 . . . . 0.0 113.004 170.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 34.79 48.18 0.3 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 128.372 2.669 . . . . 0.0 110.277 -173.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 33.9 mt -121.63 16.61 11.16 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.445 -1.252 . . . . 0.0 113.098 174.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -71.8 -37.95 70.31 Favored 'General case' 0 N--CA 1.452 -0.357 1 O-C-N 115.444 -4.535 . . . . 0.0 111.144 -176.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 43.0 tp -62.13 -55.75 37.71 Favored Pre-proline 0 N--CA 1.449 -0.518 0 CA-C-O 114.587 -2.625 . . . . 0.0 111.454 177.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -65.23 -20.52 62.51 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 CA-C-N 122.707 2.002 . . . . 0.0 111.696 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 27.7 tp -79.1 -32.85 44.76 Favored 'General case' 0 N--CA 1.451 -0.417 1 CA-C-O 111.56 -4.067 . . . . 0.0 113.047 172.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 59.1 mt -71.08 -32.87 69.64 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 125.603 1.814 . . . . 0.0 107.756 173.104 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -80.31 -10.2 59.75 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 117.38 2.363 . . . . 0.0 117.38 176.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.3 tp -91.58 -33.42 15.14 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 118.097 -2.877 . . . . 0.0 111.31 160.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 16.2 mmt -85.0 -18.18 35.24 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 128.548 3.655 . . . . 0.0 116.226 -175.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 6.2 mp -126.97 147.77 50.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.21 1.804 . . . . 0.0 112.312 176.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 18.5 p -75.82 165.52 52.63 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-O 112.305 -3.712 . . . . 0.0 116.44 176.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -58.65 -14.57 22.07 Favored 'Trans proline' 0 N--CA 1.45 -1.042 0 O-C-N 126.371 2.774 . . . . 0.0 116.385 174.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -90.19 -46.37 8.48 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 126.195 1.798 . . . . 0.0 113.218 175.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -67.43 -26.59 66.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 117.115 -1.421 . . . . 0.0 114.448 -178.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -60.12 -42.55 94.99 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 125.656 1.848 . . . . 0.0 110.81 172.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -65.35 -27.75 68.8 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 112.141 -2.3 . . . . 0.0 116.148 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.5 -45.97 12.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 118.256 -2.778 . . . . 0.0 110.748 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.99 -34.22 77.28 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.511 -1.993 . . . . 0.0 110.176 -179.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.79 -23.78 72.59 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 118.361 2.104 . . . . 0.0 118.361 170.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 74.7 m -87.9 -25.6 23.16 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.799 2.04 . . . . 0.0 112.803 174.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 42.4 mtt180 -64.5 -24.99 67.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 117.711 2.485 . . . . 0.0 117.711 161.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.02 -41.97 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 120.179 1.354 . . . . 0.0 107.671 175.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 -59.61 -43.84 93.64 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 112.897 -3.43 . . . . 0.0 110.502 176.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 56.5 mt -61.57 -47.76 91.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 123.116 2.689 . . . . 0.0 107.129 -177.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.298 69.2 t -62.18 -33.31 58.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 120.156 1.344 . . . . 0.0 111.766 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -69.45 -43.23 73.7 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 118.654 -2.529 . . . . 0.0 113.176 173.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -72.4 -36.82 68.74 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 119.417 -2.052 . . . . 0.0 114.118 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 12.7 mt -52.18 -28.06 16.79 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.352 0.596 . . . . 0.0 112.568 165.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 23.4 mt -92.18 -21.94 20.1 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 117.831 -3.043 . . . . 0.0 118.381 174.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' ARG . . . . . 0.429 HH21 ' CG ' ' B' ' 108' ' ' ASP . 5.1 ttm105 -88.89 -43.58 11.08 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.833 2.053 . . . . 0.0 105.516 -166.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.99 49.95 31.74 Favored Glycine 0 CA--C 1.524 0.632 0 CA-C-O 117.422 -1.765 . . . . 0.0 116.294 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -116.75 -36.13 3.98 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 119.811 1.805 . . . . 0.0 108.746 -177.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 27.0 mtt -73.33 139.56 46.13 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 126.357 2.98 . . . . 0.0 111.43 -175.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -81.79 170.65 15.46 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 118.973 -2.329 . . . . 0.0 109.438 163.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -59.97 -17.43 38.1 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 117.135 -3.478 . . . . 0.0 110.446 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 48.1 ttt-85 -82.04 -48.39 11.47 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.676 2.39 . . . . 0.0 106.94 -173.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -71.24 -49.28 44.94 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 114.157 -2.83 . . . . 0.0 112.162 178.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 83.0 mt -47.66 -43.27 26.1 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 121.296 1.862 . . . . 0.0 109.279 173.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -61.14 -20.11 62.31 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 119.271 -2.143 . . . . 0.0 113.229 178.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -118.21 -54.22 2.31 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 124.907 3.503 . . . . 0.0 116.785 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.03 -24.56 64.61 Favored 'General case' 0 N--CA 1.446 -0.653 1 C-N-CA 132.142 4.177 . . . . 0.0 113.371 -177.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 60.0 mt -131.28 -3.96 3.86 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 113.274 -1.784 . . . . 0.0 113.258 172.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.9 21.28 67.45 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 126.558 2.028 . . . . 0.0 116.603 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.55 110.85 22.43 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 118.608 -2.701 . . . . 0.0 108.959 -163.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.19 176.53 48.7 Favored Glycine 0 CA--C 1.523 0.565 0 O-C-N 118.811 -2.431 . . . . 0.0 117.289 168.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 14.4 mm -53.51 -48.32 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.725 0 CA-C-O 117.751 -1.118 . . . . 0.0 111.869 -166.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.82 -33.98 69.18 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 122.059 2.209 . . . . 0.0 112.977 -177.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 54.1 m -75.93 -48.52 20.9 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.38 3.072 . . . . 0.0 111.213 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 18.9 mm -53.96 -35.94 29.65 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 O-C-N 118.366 -2.709 . . . . 0.0 108.385 167.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 5.3 m -75.64 -27.61 58.46 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 117.17 -1.395 . . . . 0.0 112.917 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -63.69 -48.89 75.31 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 122.7 2.5 . . . . 0.0 110.321 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -76.94 -32.07 50.89 Favored Glycine 0 CA--C 1.525 0.682 0 CA-C-O 118.132 -1.371 . . . . 0.0 112.701 -167.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 89.1 p -68.46 -40.58 81.01 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -61.45 -41.46 97.24 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 118.826 -2.421 . . . . 0.0 110.185 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.6 m -77.94 -24.69 48.12 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 112.391 -3.671 . . . . 0.0 110.127 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.57 -36.66 44.22 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 127.113 2.758 . . . . 0.0 116.917 170.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -60.71 -45.44 94.22 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 125.26 2.457 . . . . 0.0 111.46 169.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . 0.31 . . -71.2 -17.21 62.53 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 118.222 -2.799 . . . . 0.0 117.62 173.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' B' ' 93' ' ' PRO . . . -72.56 160.17 83.49 Favored Pre-proline 0 N--CA 1.45 -0.451 0 O-C-N 119.906 -1.746 . . . . 0.0 112.548 172.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 93' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' B' ' 92' ' ' ALA . 86.0 Cg_exo -67.32 155.75 69.17 Favored 'Trans proline' 0 N--CA 1.447 -1.222 1 C-N-CA 127.942 5.761 . . . . 0.0 118.436 175.165 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.277 12.9 m -65.81 -36.3 77.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 119.262 0.937 . . . . 0.0 113.452 -177.351 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.332 7.8 pm0 -59.57 -27.75 66.52 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 -177.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 24.7 tp -83.16 -46.6 12.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.569 1.548 . . . . 0.0 109.41 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 64.8 mtp85 -57.47 -27.3 62.37 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 175.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -99.32 -8.75 24.47 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 174.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -75.01 -62.59 1.5 Allowed 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 127.968 2.507 . . . . 0.0 105.78 168.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 83.2 mt -57.77 -31.74 66.81 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 131.391 3.876 . . . . 0.0 109.029 -169.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -69.62 -43.13 73.34 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 124.267 3.212 . . . . 0.0 111.326 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -71.85 -48.15 48.08 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 124.871 2.272 . . . . 0.0 108.565 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 65.2 t -60.31 -50.03 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 113.481 -1.691 . . . . 0.0 111.455 -170.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 13.5 mt -76.16 -54.56 6.63 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 127.862 3.696 . . . . 0.0 115.399 176.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 60.6 mt -76.6 -36.6 57.42 Favored 'General case' 0 N--CA 1.45 -0.44 1 O-C-N 114.431 -5.168 . . . . 0.0 116.907 -165.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -80.19 -5.88 56.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 112.518 -3.611 . . . . 0.0 108.408 177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 70.6 m -105.73 -10.25 16.85 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 128.398 2.679 . . . . 0.0 109.701 -178.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 108' ' ' ASP . . . . . 0.429 ' CG ' HH21 ' B' ' 63' ' ' ARG . 9.8 t70 . . . . . 0 C--O 1.25 1.11 0 C-N-CA 129.834 3.253 . . . . 0.0 115.346 -173.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 15.7 mtt . . . . . 0 N--CA 1.472 0.639 0 CA-C-O 123.816 1.769 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.42 147.4 30.99 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 112.587 -2.097 . . . . 0.0 114.747 -178.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -140.67 156.91 46.11 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.854 2.461 . . . . 0.0 113.204 165.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -122.21 164.8 17.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.995 1.718 . . . . 0.0 108.885 175.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 42.9 p -127.99 153.97 78.38 Favored Pre-proline 0 N--CA 1.451 -0.398 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.94 -38.21 93.07 Favored 'Trans proline' 0 N--CA 1.447 -1.261 0 O-C-N 125.69 2.416 . . . . 0.0 116.976 172.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -149.82 148.59 29.36 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 124.72 2.2 . . . . 0.0 110.605 175.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.1 t -145.46 133.79 21.78 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.286 -2.759 . . . . 0.0 114.556 170.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.64 -26.43 59.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 112.95 -3.405 . . . . 0.0 107.806 175.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.33 -34.63 78.77 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 125.853 3.933 . . . . 0.0 110.044 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 18.4 mtt -82.32 -34.48 28.55 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 125.338 1.649 . . . . 0.0 114.84 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.62 -38.82 82.36 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 125.576 1.551 . . . . 0.0 114.337 164.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -67.29 -33.13 74.65 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.619 1.568 . . . . 0.0 112.659 167.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -59.08 -40.98 86.93 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 119.206 -2.184 . . . . 0.0 111.46 167.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -21.52 65.1 Favored 'General case' 0 N--CA 1.449 -0.506 1 O-C-N 114.635 -5.041 . . . . 0.0 117.792 169.949 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -76.82 -46.56 24.4 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 120.888 -1.132 . . . . 0.0 113.205 177.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -53.92 -23.15 11.91 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 119.191 3.034 . . . . 0.0 119.191 159.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -81.75 -45.13 16.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 127.329 2.251 . . . . 0.0 106.375 171.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 23.8 t-105 -66.9 -37.11 83.75 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 118.072 -2.893 . . . . 0.0 112.406 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 20' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' C' ' 20' ' ' LEU . 1.9 mp -73.03 -27.6 61.86 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 127.11 2.756 . . . . 0.0 111.281 -176.129 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 27.1 ttt180 -75.38 -35.23 61.12 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 119.33 -2.106 . . . . 0.0 113.151 172.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -61.06 -42.38 98.38 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 169.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.368 76.0 t -54.81 -61.99 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 CA-C-O 117.097 -1.43 . . . . 0.0 108.921 167.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -53.24 -43.35 67.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 117.834 2.531 . . . . 0.0 117.834 178.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 60.9 tp -45.17 -55.07 6.11 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 127.721 2.408 . . . . 0.0 112.268 176.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 25.6 tp -67.25 -27.01 66.86 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 119.641 -1.912 . . . . 0.0 114.825 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -56.43 -50.56 71.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 119.398 -2.064 . . . . 0.0 110.302 166.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -68.65 -8.73 44.94 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 119.821 -1.799 . . . . 0.0 112.086 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.17 -20.77 17.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 -178.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -76.0 -22.89 55.34 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-O 125.796 2.712 . . . . 0.0 115.123 164.005 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . 0.305 45.7 tt0 -62.07 -16.37 51.66 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 129.598 3.159 . . . . 0.0 116.582 169.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -147.24 6.01 0.85 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.263 3.6 m-20 59.16 29.98 19.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 118.228 2.677 . . . . 0.0 118.228 -173.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 96.9 mt -82.31 7.52 13.72 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 118.679 -2.513 . . . . 0.0 114.536 162.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 7.0 p-80 -59.33 -44.99 92.56 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 119.121 3.008 . . . . 0.0 119.121 173.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.323 6.5 mt -60.25 -55.44 45.29 Favored Pre-proline 0 N--CA 1.452 -0.352 0 O-C-N 125.085 1.491 . . . . 0.0 110.312 175.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -54.35 -50.62 12.86 Favored 'Trans proline' 0 N--CA 1.445 -1.329 0 C-N-CA 123.488 2.792 . . . . 0.0 113.12 174.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 56.6 tp -55.4 -30.53 60.58 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 173.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.387 15.3 mt -94.92 -18.48 21.08 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 122.496 2.407 . . . . 0.0 114.187 177.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -67.24 -26.18 66.46 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.596 -1.192 . . . . 0.0 111.635 161.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 19.9 tp -77.5 -52.54 8.9 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.638 2.375 . . . . 0.0 114.708 170.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 49.2 mmm -78.72 -15.8 58.01 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 117.117 -1.421 . . . . 0.0 113.752 -164.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 7.8 mp -121.29 144.45 48.62 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 130.669 3.588 . . . . 0.0 113.523 -175.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 55.7 p -75.42 157.13 84.94 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-N 122.26 2.3 . . . . 0.0 113.356 164.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -57.88 -34.1 97.88 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 CA-C-N 121.52 1.578 . . . . 0.0 110.872 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.74 -41.18 94.84 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.868 172.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -67.83 -31.49 71.38 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.652 1.181 . . . . 0.0 112.309 176.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 48' ' ' ARG . . . . . 0.433 ' HD2' ' CE2' ' D' ' 19' ' ' TRP . 85.8 mtm-85 -69.75 -44.08 70.94 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.067 2.147 . . . . 0.0 110.888 175.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . 0.254 40.5 tt0 -68.89 -22.65 64.17 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 127.967 2.507 . . . . 0.0 114.34 168.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.51 -28.76 64.13 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 121.62 2.009 . . . . 0.0 110.704 173.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 57.2 mt -74.75 -46.11 39.47 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 118.424 2.75 . . . . 0.0 118.424 177.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.49 -43.8 36.26 Favored Glycine 0 CA--C 1.526 0.766 0 O-C-N 126.482 2.364 . . . . 0.0 110.532 169.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 99.6 m -59.59 -55.92 28.45 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.576 1.95 . . . . 0.0 109.958 178.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -57.69 -42.03 82.86 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 115.5 -2.19 . . . . 0.0 113.504 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 50.2 t -58.59 -36.02 57.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 CA-C-N 124.464 3.302 . . . . 0.0 114.671 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -80.82 -30.91 35.73 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 113.536 -1.666 . . . . 0.0 110.788 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 57' ' ' ILE . . . . . 0.417 HG12 ' HG ' ' C' ' 75' ' ' LEU 0.325 7.9 mt -60.16 -51.67 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 1 O-C-N 115.6 -4.438 . . . . 0.0 110.755 165.039 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . 0.267 62.5 t -49.08 -55.81 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 C-N-CA 125.488 1.515 . . . . 0.0 113.484 174.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -49.05 -45.71 43.31 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.338 1.855 . . . . 0.0 114.672 174.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . 0.265 29.9 mm-40 -78.83 -11.01 59.98 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 123.179 1.466 . . . . 0.0 114.882 -174.677 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 46.2 mt -101.53 -4.5 26.63 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 115.21 -2.329 . . . . 0.0 108.847 168.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.53 -39.95 11.08 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 114.362 -2.732 . . . . 0.0 113.222 166.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 7.9 ttm105 -67.38 -31.62 71.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 126.139 2.15 . . . . 0.0 113.664 167.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.84 17.23 73.12 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-N 113.71 -1.587 . . . . 0.0 116.746 171.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -97.94 -2.02 41.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 121.644 2.722 . . . . 0.0 112.03 -160.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 19.1 mmt -79.38 136.7 37.05 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 124.851 1.344 . . . . 0.0 108.547 -177.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 65.7 p -90.33 174.8 7.38 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 129.274 3.029 . . . . 0.0 113.001 166.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -57.93 -40.49 80.56 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -173.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 39.0 ttp-105 -57.17 -46.25 82.97 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 126.155 1.782 . . . . 0.0 109.417 173.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -80.42 -22.29 41.34 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 119.724 -1.86 . . . . 0.0 111.279 -170.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 16.3 mt -73.25 -21.14 60.69 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.038 -2.914 . . . . 0.0 110.799 172.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -89.06 -54.64 4.02 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.894 -2.379 . . . . 0.0 112.382 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -72.55 -49.04 35.32 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 125.191 1.557 . . . . 0.0 111.835 -172.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -73.31 -38.87 65.69 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 115.909 -1.996 . . . . 0.0 115.993 177.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 75' ' ' LEU . . . . . 0.417 ' HG ' HG12 ' C' ' 57' ' ' ILE . 8.0 mp -97.0 -30.86 12.83 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 120.77 3.618 . . . . 0.0 120.77 -171.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.18 -160.37 31.38 Favored Glycine 0 C--N 1.337 0.608 0 CA-C-O 124.021 1.901 . . . . 0.0 114.844 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.84 -21.58 59.18 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 116.998 2.221 . . . . 0.0 116.998 -175.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.53 -12.71 9.83 Favored Glycine 0 CA--C 1.522 0.531 0 C-N-CA 128.858 3.123 . . . . 0.0 117.204 173.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 16.8 tt -54.11 -38.09 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 161.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.86 -46.35 89.58 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 113.915 -2.945 . . . . 0.0 110.858 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 40.6 m -50.68 -32.54 19.57 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 129.603 3.161 . . . . 0.0 115.669 166.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.298 52.0 mm -89.18 -10.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 119.441 -2.037 . . . . 0.0 114.073 177.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 39.8 p -136.67 5.1 2.87 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 118.285 -1.366 . . . . 0.0 114.215 -161.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 52.5 mtp85 -126.43 158.98 34.58 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 123.433 1.587 . . . . 0.0 110.723 169.104 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.64 163.37 31.36 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-O 117.155 -1.914 . . . . 0.0 115.118 -178.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . 0.317 20.0 m -67.55 -12.88 61.39 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 127.334 2.432 . . . . 0.0 117.048 -167.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . 0.268 63.2 m-80 -99.83 -1.81 36.59 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 112.013 -2.358 . . . . 0.0 114.153 -179.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 52.7 p -70.06 167.0 18.58 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 121.101 1.773 . . . . 0.0 110.395 -174.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 27.2 tp -56.45 -29.53 61.78 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -161.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 45.3 mttt -99.54 -4.8 30.39 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 118.786 -2.446 . . . . 0.0 116.164 170.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.33 -23.9 22.14 Favored 'General case' 0 N--CA 1.452 -0.355 1 O-C-N 115.536 -4.478 . . . . 0.0 115.38 166.426 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.45 156.61 30.06 Favored Pre-proline 0 N--CA 1.449 -0.514 0 C-N-CA 124.849 1.26 . . . . 0.0 112.938 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -63.72 147.26 92.65 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 O-C-N 116.667 -2.333 . . . . 0.0 110.584 -177.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 68.3 t -62.58 -31.08 50.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 127.751 2.421 . . . . 0.0 111.671 -172.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . 0.275 22.6 pm0 -65.24 -28.27 69.24 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.566 1.547 . . . . 0.0 114.213 175.108 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 96' ' ' LEU . . . . . 0.44 HD22 ' HB2' ' D' ' 37' ' ' PRO . 13.7 tp -82.97 -42.5 17.52 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.395 -0.812 . . . . 0.0 108.891 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 -61.1 -54.39 45.2 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 127.927 2.491 . . . . 0.0 110.566 -175.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -52.71 -53.5 46.82 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 127.787 3.18 . . . . 0.0 112.665 172.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 66.9 t90 -64.08 -39.17 93.48 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -177.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 100' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' C' ' 100' ' ' LEU . 13.3 mt -60.1 -39.28 85.59 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 116.948 -1.901 . . . . 0.0 114.642 172.571 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -64.23 -30.64 71.69 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.271 1.028 . . . . 0.0 112.711 175.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -67.86 -37.52 81.95 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 128.724 2.81 . . . . 0.0 116.751 173.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 61.6 t -86.42 -51.17 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 129.757 3.223 . . . . 0.0 113.315 -176.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 70.4 mt -77.76 -19.12 55.67 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 113.852 -2.975 . . . . 0.0 108.13 -174.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 35.1 mt -124.5 49.3 1.83 Allowed 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 122.564 2.438 . . . . 0.0 111.224 176.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 4.5 pttp -74.32 155.13 38.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 114.908 -2.472 . . . . 0.0 116.142 -172.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 27.6 m -132.88 -32.99 1.2 Allowed 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 128.03 3.331 . . . . 0.0 111.838 -166.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 35.3 t70 . . . . . 0 C--O 1.251 1.134 0 O-C-N 118.403 -2.686 . . . . 0.0 117.983 -163.935 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 14.6 ttt . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 116.346 -1.787 . . . . 0.0 109.876 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.56 152.29 36.55 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 127.644 2.378 . . . . 0.0 112.075 -176.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -122.89 159.79 27.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 111.059 -2.791 . . . . 0.0 109.689 164.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -142.06 142.14 32.83 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 126.619 1.968 . . . . 0.0 115.909 158.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 55.0 p -83.62 157.49 64.2 Favored Pre-proline 0 N--CA 1.447 -0.596 0 O-C-N 116.712 -3.742 . . . . 0.0 110.84 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -63.62 -20.7 69.7 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 115.089 -2.807 . . . . 0.0 111.405 169.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -161.29 137.43 8.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 172.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 18.1 t -78.72 132.91 37.15 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 126.896 2.623 . . . . 0.0 111.602 -167.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.02 -34.54 74.99 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 116.615 -1.659 . . . . 0.0 114.209 169.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.69 -38.99 57.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 125.277 2.465 . . . . 0.0 114.722 166.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 12.8 mmt -81.91 -22.95 36.52 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 115.635 -2.126 . . . . 0.0 114.879 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.56 -17.93 57.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 118.59 2.811 . . . . 0.0 118.59 165.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . 0.336 40.0 tp10 -76.97 -45.04 28.94 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 116.96 -1.495 . . . . 0.0 110.622 156.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -65.64 -31.66 72.81 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 117.687 2.477 . . . . 0.0 117.687 -173.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.95 -21.05 63.3 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 176.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -86.1 -24.09 26.41 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 165.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -81.66 -30.33 32.77 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.206 -1.559 . . . . 0.0 108.677 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -70.76 -22.41 62.4 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 117.901 -3.0 . . . . 0.0 111.881 169.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 19' ' ' TRP . . . . . 0.433 ' CE2' ' HD2' ' C' ' 48' ' ' ARG . 6.7 t-105 -87.39 -48.44 7.97 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 114.806 -2.521 . . . . 0.0 110.932 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 46.3 mt -57.13 -34.27 68.21 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 126.925 2.09 . . . . 0.0 109.504 167.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -63.11 -35.54 80.61 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 116.729 -3.732 . . . . 0.0 114.377 169.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -69.68 -36.71 76.22 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 121.255 1.843 . . . . 0.0 110.037 167.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 97.9 t -68.46 -35.86 72.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-N 122.455 2.389 . . . . 0.0 110.739 -177.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.91 -42.35 94.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 128.188 2.595 . . . . 0.0 114.158 168.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 25' ' ' LEU . . . . . 0.457 ' HA ' HD12 ' D' ' 25' ' ' LEU . 57.5 tp -65.89 -47.8 73.62 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 116.27 -1.824 . . . . 0.0 109.236 177.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 39.5 tp -64.44 -38.31 90.59 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 125.537 1.773 . . . . 0.0 114.844 177.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -49.67 -58.06 6.02 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 123.846 0.858 . . . . 0.0 111.878 166.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -74.41 -12.87 60.63 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.133 -1.413 . . . . 0.0 113.127 -176.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.396 . . -77.08 -27.41 54.24 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.691 2.478 . . . . 0.0 117.691 157.538 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -68.0 -29.99 69.14 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.362 -3.336 . . . . 0.0 113.101 171.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -73.21 -36.95 66.58 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 129.187 2.995 . . . . 0.0 116.254 -172.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 40.7 p30 -105.92 9.91 32.55 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 125.259 1.599 . . . . 0.0 113.571 171.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 64.95 30.7 11.81 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 131.391 3.876 . . . . 0.0 115.287 -176.114 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 34.9 mt -96.39 12.91 29.57 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 118.713 -2.492 . . . . 0.0 116.228 174.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -53.77 51.67 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 128.07 2.548 . . . . 0.0 110.15 178.173 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.27 1.1 mt -63.1 -50.88 73.88 Favored Pre-proline 0 N--CA 1.448 -0.534 0 O-C-N 121.246 -0.909 . . . . 0.0 111.679 -171.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 37' ' ' PRO . . . . . 0.44 ' HB2' HD22 ' C' ' 96' ' ' LEU . 35.9 Cg_exo -53.09 -27.35 36.31 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 N-CA-C 118.606 2.502 . . . . 0.0 118.606 166.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 27.2 tp -83.45 -43.2 16.09 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 120.084 1.311 . . . . 0.0 111.971 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 93.1 mt -62.35 -37.36 85.37 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 119.991 1.269 . . . . 0.0 110.425 170.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -81.9 -30.72 31.78 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 116.734 -1.603 . . . . 0.0 113.769 -174.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 13.8 tp -58.52 -58.64 7.64 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 129.389 3.076 . . . . 0.0 111.166 157.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.9 mmt -56.04 -35.97 67.5 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.167 2.187 . . . . 0.0 112.677 -178.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 70.0 mt -121.7 124.98 45.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 117.576 -3.202 . . . . 0.0 106.365 -161.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 44' ' ' THR . . . . . 0.436 ' HB ' ' HD2' ' D' ' 45' ' ' PRO . 81.4 p -60.42 153.49 59.56 Favored Pre-proline 0 N--CA 1.453 -0.313 0 C-N-CA 127.665 2.386 . . . . 0.0 109.927 162.388 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 45' ' ' PRO . . . . . 0.436 ' HD2' ' HB ' ' D' ' 44' ' ' THR . 61.7 Cg_endo -74.61 -27.12 11.09 Favored 'Trans proline' 0 N--CA 1.449 -1.133 0 CA-C-O 116.606 -1.498 . . . . 0.0 115.513 -158.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -15.08 63.04 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 113.988 -2.91 . . . . 0.0 114.711 165.362 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -76.99 -29.72 55.63 Favored 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 125.544 1.777 . . . . 0.0 115.294 167.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 28.9 mtm-85 -77.06 -37.97 53.58 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.833 1.653 . . . . 0.0 112.022 175.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -56.82 -41.44 77.8 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 123.728 1.728 . . . . 0.0 114.414 166.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.319 . . -64.32 -42.22 96.42 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.76 -1.838 . . . . 0.0 113.877 175.514 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 20.0 mt -72.05 -38.72 69.43 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.12 -28.58 73.79 Favored Glycine 0 C--N 1.336 0.545 0 CA-C-N 120.034 1.288 . . . . 0.0 110.724 167.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 91.2 m -70.5 -23.08 62.6 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 119.164 -2.374 . . . . 0.0 110.928 170.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -81.6 -23.86 36.8 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 116.622 -3.799 . . . . 0.0 110.329 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 69.5 t -58.33 -39.14 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 120.594 1.543 . . . . 0.0 113.859 164.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -84.4 -19.44 33.53 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.839 -1.788 . . . . 0.0 115.747 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 80.4 mt -66.8 -51.57 54.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 C-N-CA 127.315 2.246 . . . . 0.0 110.353 160.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . 0.278 67.9 t -55.7 -52.35 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 O-C-N 126.352 2.282 . . . . 0.0 109.099 169.452 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -56.2 -42.55 77.36 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 120.065 1.302 . . . . 0.0 112.289 -168.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -76.16 -35.33 59.23 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 119.007 2.965 . . . . 0.0 119.007 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 54.4 mt -53.66 -37.32 63.03 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 115.562 -2.161 . . . . 0.0 113.22 167.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 94.1 mt -80.74 -36.2 32.36 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 127.984 2.514 . . . . 0.0 107.358 177.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -68.53 -50.49 51.58 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 122.488 2.404 . . . . 0.0 110.261 -177.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.63 48.15 8.2 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-O 114.933 -3.148 . . . . 0.0 106.651 161.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -130.74 -54.5 1.07 Allowed 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 126.385 1.874 . . . . 0.0 107.081 179.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 15.7 mmt -80.28 49.91 1.19 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.766 2.426 . . . . 0.0 108.679 -176.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 23.6 p -82.4 -166.02 1.17 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 119.977 3.325 . . . . 0.0 119.977 -175.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 50.59 -95.47 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 126.124 1.77 . . . . 0.0 113.761 169.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -70.58 -39.14 74.03 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 117.498 -3.251 . . . . 0.0 113.025 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -79.01 -38.71 35.96 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 112.885 -1.961 . . . . 0.0 110.656 -161.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . 0.3 3.8 mt -56.65 -34.76 67.62 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.415 170.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -78.45 -29.85 47.14 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 177.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -116.65 -16.81 10.68 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 128.177 2.591 . . . . 0.0 116.207 -162.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . 0.27 15.8 tp10 -122.14 -44.93 2.26 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 130.971 3.708 . . . . 0.0 107.821 -173.099 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -82.17 -47.15 12.85 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 113.282 -3.247 . . . . 0.0 114.879 165.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 99.53 -164.14 19.93 Favored Glycine 0 CA--C 1.523 0.592 0 CA-C-N 121.144 1.793 . . . . 0.0 113.415 155.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.69 -22.49 66.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 125.808 1.534 . . . . 0.0 113.947 -159.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.94 -15.81 22.26 Favored Glycine 0 C--N 1.337 0.6 1 CA-C-O 112.483 -4.509 . . . . 0.0 112.099 171.503 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 10.0 tt -49.8 -22.11 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 1 CA-C-N 124.211 4.006 . . . . 0.0 114.926 172.38 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -102.19 -15.21 16.73 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 131.356 3.862 . . . . 0.0 112.649 -171.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 57.1 m -64.78 -32.4 74.07 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 116.264 -1.827 . . . . 0.0 113.341 153.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 28.0 mm -98.18 -23.55 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 126.817 2.047 . . . . 0.0 113.388 -173.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 44.8 p -118.17 0.56 11.79 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 118.836 -2.415 . . . . 0.0 115.118 177.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -120.22 -177.53 3.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.308 1.843 . . . . 0.0 108.083 154.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.14 166.3 35.51 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-O 117.183 -1.898 . . . . 0.0 112.127 -144.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 53.3 p -77.83 -32.31 52.13 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 118.872 2.916 . . . . 0.0 118.872 -166.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -131.57 101.71 5.61 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.014 -1.448 . . . . 0.0 112.485 161.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 69.1 p -101.33 -177.28 3.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 124.273 1.987 . . . . 0.0 112.433 -172.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 tp -63.34 -22.5 66.91 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.165 -1.38 . . . . 0.0 113.371 168.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 46.5 tttt -75.17 -15.48 60.57 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.453 -2.03 . . . . 0.0 111.306 170.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -110.1 -15.36 14.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 115.874 -2.013 . . . . 0.0 115.263 -170.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 38.68 92.43 0.05 OUTLIER Pre-proline 0 N--CA 1.45 -0.45 0 O-C-N 126.539 2.399 . . . . 0.0 115.886 172.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 93' ' ' PRO . . . . . 0.449 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.365 15.2 Cg_exo 24.43 38.49 0.0 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.342 0 CA-C-O 116.319 -1.617 . . . . 0.0 115.948 50.694 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 15.4 t -51.8 -33.34 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 126.137 1.775 . . . . 0.0 107.45 -176.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 95' ' ' GLU . . . . . 0.449 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.332 0.0 OUTLIER -76.38 -43.27 41.36 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -174.36 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 14.7 tp -59.51 -46.85 87.66 Favored 'General case' 0 N--CA 1.447 -0.606 1 O-C-N 129.263 4.102 . . . . 0.0 105.805 174.201 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 45.2 ttp180 -65.94 -55.1 18.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.62 0.768 . . . . 0.0 110.43 -171.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -45.22 -37.64 4.76 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 126.638 2.461 . . . . 0.0 113.564 173.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . 0.272 90.4 t90 -74.03 -52.67 11.99 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 172.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 97.0 mt -51.39 -29.65 16.39 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 118.519 -2.613 . . . . 0.0 112.579 169.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -82.73 -16.22 48.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 120.049 -1.657 . . . . 0.0 110.933 -175.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -116.38 6.07 13.61 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 117.0 -3.562 . . . . 0.0 115.875 175.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 44.1 t -109.88 -38.14 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 128.122 2.569 . . . . 0.0 108.87 170.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 31.3 mt -99.34 -20.62 16.42 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 121.965 2.166 . . . . 0.0 112.198 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 4.3 mp -116.6 44.49 2.01 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 126.928 3.251 . . . . 0.0 112.677 171.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 17.1 pttp -71.64 -179.89 2.78 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 112.136 -2.302 . . . . 0.0 113.704 -174.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 69.2 m -50.97 -31.8 18.99 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.619 -1.173 . . . . 0.0 112.636 -173.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 . . . . . 0 C--O 1.251 1.157 1 O-C-N 116.297 -4.002 . . . . 0.0 114.487 -175.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.3 mmt . . . . . 0 N--CA 1.472 0.63 0 CA-C-O 116.101 -1.904 . . . . 0.0 114.123 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -43.7 -33.4 1.23 Allowed 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 119.82 3.267 . . . . 0.0 119.82 -174.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -88.05 -35.82 17.32 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -178.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -69.12 -58.85 3.52 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 127.086 2.154 . . . . 0.0 113.959 170.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . 0.277 36.9 m -86.52 119.99 71.75 Favored Pre-proline 0 N--CA 1.453 -0.307 0 CA-C-N 111.422 -2.626 . . . . 0.0 114.858 -175.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . 0.297 41.8 Cg_endo -75.93 6.64 3.66 Favored 'Trans proline' 0 N--CA 1.448 -1.165 1 C-N-CA 125.833 4.356 . . . . 0.0 120.066 -176.487 . . . . . . . . 3 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -152.96 156.8 39.57 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 129.423 3.089 . . . . 0.0 112.725 -171.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.1 p -154.28 153.11 31.13 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 125.352 2.501 . . . . 0.0 105.497 153.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . 0.352 . . -66.65 -43.88 83.41 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 113.136 -3.316 . . . . 0.0 114.146 176.174 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.29 -31.31 43.25 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 113.865 -2.969 . . . . 0.0 111.723 167.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 16.9 tpt -85.26 -30.41 23.83 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 120.944 1.702 . . . . 0.0 108.247 177.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.07 -37.0 85.44 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 118.426 -1.31 . . . . 0.0 113.583 174.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -62.91 -39.29 94.09 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 118.981 -2.324 . . . . 0.0 112.884 171.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -72.04 -30.43 65.17 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.134 -1.394 . . . . 0.0 112.473 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 37.4 mmt-85 -75.16 -28.08 59.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 162.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -64.95 -42.33 94.71 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 117.036 -1.459 . . . . 0.0 110.543 171.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -79.68 -18.15 52.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 125.049 1.468 . . . . 0.0 112.276 -175.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -74.28 -36.55 63.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.734 2.814 . . . . 0.0 107.334 173.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.44 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG . 11.1 t-105 -71.17 -62.08 1.53 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 124.914 2.292 . . . . 0.0 110.697 172.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.3 mt -57.05 -13.81 3.17 Favored 'General case' 0 N--CA 1.447 -0.604 1 O-C-N 115.535 -4.478 . . . . 0.0 117.422 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -52.37 -44.95 65.55 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 118.732 -2.48 . . . . 0.0 113.798 160.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -72.4 -35.66 68.45 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 118.034 -2.916 . . . . 0.0 114.221 179.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.557 HG21 HD13 ' B' ' 36' ' ' LEU . 92.8 t -62.65 -34.72 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 124.141 1.924 . . . . 0.0 110.226 176.415 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -76.5 -31.49 57.75 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.47 -2.643 . . . . 0.0 114.352 171.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 27.3 tp -68.13 -66.23 0.59 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.695 1.198 . . . . 0.0 111.588 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.0 tp -46.37 -29.45 1.69 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 117.514 2.413 . . . . 0.0 117.514 167.027 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -62.8 -49.39 75.12 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 116.329 -3.982 . . . . 0.0 110.924 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -70.94 -17.86 62.66 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 116.501 -1.714 . . . . 0.0 112.563 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . 0.301 . . -84.28 -28.68 26.99 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 114.482 1.289 . . . . 0.0 114.482 176.748 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -56.33 -49.67 73.69 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.094 1.758 . . . . 0.0 110.435 163.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -62.08 -7.16 3.61 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 118.404 2.742 . . . . 0.0 118.404 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -126.66 8.66 6.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 129.625 3.17 . . . . 0.0 112.29 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 42.41 21.64 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 118.282 2.697 . . . . 0.0 118.282 -168.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 mt -84.06 2.86 37.19 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.466 1.906 . . . . 0.0 111.898 172.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -66.35 -45.38 80.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 -178.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.1 mt -64.57 -40.47 50.1 Favored Pre-proline 0 N--CA 1.451 -0.423 0 C-N-CA 116.44 -2.104 . . . . 0.0 112.333 174.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -60.69 -39.65 61.77 Favored 'Trans proline' 0 N--CA 1.449 -1.119 1 C-N-CA 126.791 4.994 . . . . 0.0 112.584 178.4 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.9 tp -63.32 -47.66 81.31 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 125.427 2.537 . . . . 0.0 114.925 169.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 62.5 mt -70.41 -37.31 74.43 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 118.384 -2.698 . . . . 0.0 112.105 -169.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -68.34 -9.42 47.81 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 119.836 -1.79 . . . . 0.0 114.035 171.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.293 1.0 OUTLIER -86.34 -56.56 3.38 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 118.263 -2.773 . . . . 0.0 106.89 178.902 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.3 mmt -66.17 -22.77 66.37 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.367 48.5 mt -123.56 131.28 53.58 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.276 2.63 . . . . 0.0 112.946 -170.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.8 p -87.56 152.74 52.41 Favored Pre-proline 0 N--CA 1.447 -0.575 0 CA-C-O 117.229 -1.367 . . . . 0.0 111.899 177.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -49.69 -48.24 19.96 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 123.709 2.939 . . . . 0.0 118.619 -175.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -65.66 -35.77 81.74 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 116.693 -1.622 . . . . 0.0 110.365 175.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -60.69 -40.14 91.06 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 123.887 3.04 . . . . 0.0 112.71 169.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 46.0 mtm-85 -65.86 -54.36 27.66 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -50.45 -45.76 56.23 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.391 1.476 . . . . 0.0 108.377 170.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.37 -33.97 77.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 117.638 -3.164 . . . . 0.0 109.983 -178.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.409 HD23 ' HD2' ' A' ' 54' ' ' ARG . 12.8 mt -75.75 -27.5 58.11 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 125.262 1.602 . . . . 0.0 113.554 176.17 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -64.27 -47.14 87.79 Favored Glycine 0 CA--C 1.521 0.447 0 CA-C-O 115.436 -2.869 . . . . 0.0 108.229 172.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 m -57.79 -36.31 72.01 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 120.419 2.11 . . . . 0.0 114.321 174.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.409 ' HD2' HD23 ' A' ' 51' ' ' LEU . 82.2 mtt180 -59.54 -19.85 51.36 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 117.4 2.37 . . . . 0.0 117.4 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.9 t -64.86 -45.74 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 CA-C-O 117.25 -1.357 . . . . 0.0 113.932 167.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 46.6 ttt180 -71.35 -26.57 62.87 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 125.759 1.912 . . . . 0.0 116.142 171.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.304 34.5 mt -61.66 -53.34 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 128.047 3.342 . . . . 0.0 115.679 165.679 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.0 t -67.55 -30.76 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 O-C-N 126.558 2.411 . . . . 0.0 110.544 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -50.97 -55.16 18.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 116.397 -3.939 . . . . 0.0 115.369 172.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.447 ' HA ' ' OE1' ' A' ' 60' ' ' GLU . 22.5 mm-40 -76.05 -29.28 57.97 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.158 1.783 . . . . 0.0 106.393 -174.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -80.56 -18.61 47.86 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 113.087 -3.34 . . . . 0.0 112.077 178.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.5 tp -87.18 -35.47 18.56 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 113.131 -3.319 . . . . 0.0 109.18 167.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -66.66 -45.41 79.0 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 123.294 2.77 . . . . 0.0 109.448 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.65 20.42 44.21 Favored Glycine 0 CA--C 1.525 0.673 0 CA-C-O 125.689 2.827 . . . . 0.0 113.183 158.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -105.06 -43.46 5.04 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.919 1.688 . . . . 0.0 113.531 -170.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 24.6 mtp -79.49 145.32 33.3 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.796 -3.065 . . . . 0.0 109.448 178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.55 165.17 21.38 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 126.091 2.12 . . . . 0.0 113.494 170.554 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -67.68 -27.99 67.31 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 126.481 2.363 . . . . 0.0 108.662 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -78.45 -33.34 48.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.823 1.249 . . . . 0.0 113.542 173.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -67.24 -40.32 86.28 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 124.223 1.963 . . . . 0.0 109.533 172.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.4 mt -68.68 -22.38 64.38 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 118.51 -2.619 . . . . 0.0 110.822 -175.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -61.6 -46.05 91.48 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 116.816 -1.564 . . . . 0.0 114.852 167.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -60.73 -15.72 32.25 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 120.22 1.373 . . . . 0.0 113.27 172.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -91.05 -50.8 5.66 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 124.937 2.303 . . . . 0.0 113.821 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.6 mt -100.4 -20.26 15.89 Favored 'General case' 0 N--CA 1.451 -0.381 1 N-CA-C 121.895 4.035 . . . . 0.0 121.895 -172.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 61.07 -4.85 0.25 Allowed Glycine 0 CA--C 1.521 0.418 0 N-CA-C 118.608 2.203 . . . . 0.0 118.608 -164.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.71 154.08 39.95 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 125.189 2.423 . . . . 0.0 112.827 -178.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.75 136.97 50.75 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 126.45 1.976 . . . . 0.0 117.021 171.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 26.8 mt -74.91 -25.92 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 O-C-N 118.014 -3.051 . . . . 0.0 113.464 -175.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . 0.298 . . -58.3 -33.97 70.05 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 120.159 3.392 . . . . 0.0 120.159 167.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . 0.277 33.4 p -83.12 -26.38 31.05 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 114.582 -2.627 . . . . 0.0 113.971 174.048 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 13.7 mm -68.66 -38.01 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 162.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.2 m -64.91 -44.75 88.53 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 118.633 -2.542 . . . . 0.0 112.856 176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -60.68 -49.13 78.73 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 113.732 -1.576 . . . . 0.0 111.85 172.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -50.17 -38.55 32.9 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 117.071 1.588 . . . . 0.0 117.071 171.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.4 m -63.58 -41.79 98.34 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 128.877 2.871 . . . . 0.0 114.347 174.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 49.4 m-20 -77.67 -38.98 46.41 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.065 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 70.3 m -54.51 -33.24 59.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 126.426 1.89 . . . . 0.0 114.247 166.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 89' ' ' LEU . 37.3 tp -69.89 -49.27 53.87 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.862 1.665 . . . . 0.0 111.857 172.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -56.28 -37.82 70.37 Favored 'General case' 0 N--CA 1.446 -0.658 0 O-C-N 117.157 -3.464 . . . . 0.0 107.728 172.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.89 5.05 26.77 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 121.434 1.925 . . . . 0.0 114.579 -173.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.86 147.65 94.27 Favored Pre-proline 0 N--CA 1.452 -0.367 0 C-N-CA 127.959 2.504 . . . . 0.0 113.131 166.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -59.43 150.14 77.15 Favored 'Trans proline' 0 N--CA 1.446 -1.285 0 C-N-CA 125.094 3.863 . . . . 0.0 112.925 165.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.2 m -59.1 -36.91 65.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 O-C-N 126.116 2.135 . . . . 0.0 105.725 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -73.88 -37.89 64.57 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 123.498 2.863 . . . . 0.0 109.584 -168.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 21.8 tp -61.12 -43.82 98.3 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 117.365 -3.334 . . . . 0.0 111.479 168.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 50.7 mtm-85 -67.31 -40.01 85.98 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 121.477 1.944 . . . . 0.0 113.322 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.37 -43.12 83.3 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 126.842 2.057 . . . . 0.0 115.266 166.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -63.39 -53.56 50.59 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 116.299 -1.81 . . . . 0.0 115.831 164.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 51.4 mt -59.72 -25.05 64.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 127.44 2.296 . . . . 0.0 112.488 -177.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -67.73 -35.23 78.38 Favored 'General case' 0 N--CA 1.452 -0.332 1 O-C-N 116.257 -4.027 . . . . 0.0 111.895 170.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -80.11 -24.72 40.32 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 120.529 -1.357 . . . . 0.0 111.83 178.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.4 t -66.72 -61.04 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 O-C-N 117.314 -3.366 . . . . 0.0 114.291 164.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.2 mt -87.5 -31.66 19.84 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 117.375 2.361 . . . . 0.0 117.375 -166.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 24.4 mt -109.14 -4.64 16.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 -163.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.8 tttt -87.73 -33.8 18.58 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -164.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 17.0 p -78.07 -26.06 47.99 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 116.94 2.2 . . . . 0.0 116.94 -171.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.15 0 CA-C-O 124.045 1.878 . . . . 0.0 113.474 -178.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.683 0 CA-C-O 116.082 -1.913 . . . . 0.0 107.966 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.62 -23.49 56.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 114.815 -2.517 . . . . 0.0 114.547 -142.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -98.75 5.32 47.63 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 123.892 3.042 . . . . 0.0 109.447 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . 0.337 27.0 tp60 -113.66 -55.35 2.52 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.476 1.91 . . . . 0.0 107.895 -172.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 61.0 m -67.86 123.64 87.52 Favored Pre-proline 0 N--CA 1.451 -0.411 0 O-C-N 126.556 2.41 . . . . 0.0 110.515 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_exo -75.94 -21.69 13.93 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 124.304 3.336 . . . . 0.0 110.261 -170.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -101.59 136.87 40.71 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.853 1.206 . . . . 0.0 110.598 158.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 26.3 t -165.43 136.25 3.82 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 130.216 3.406 . . . . 0.0 115.637 171.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.99 -29.43 64.22 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 112.418 -2.174 . . . . 0.0 114.027 171.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.16 -36.45 77.39 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 118.744 -1.182 . . . . 0.0 109.262 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -34.72 67.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 117.182 2.29 . . . . 0.0 117.182 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.02 -45.23 91.24 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 123.41 1.576 . . . . 0.0 109.711 173.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . 0.302 48.3 tp10 -61.73 -38.09 86.65 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.501 2.72 . . . . 0.0 110.628 174.438 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -70.3 -42.36 72.1 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 122.232 2.287 . . . . 0.0 109.39 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -80.8 -2.81 48.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 115.004 -2.427 . . . . 0.0 112.266 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -82.58 -44.97 15.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 119.933 3.308 . . . . 0.0 119.933 152.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -65.14 -21.38 66.78 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 170.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -64.95 -37.04 86.33 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 117.88 2.548 . . . . 0.0 117.88 161.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 15.9 t-105 -68.44 -41.42 80.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 117.143 -1.408 . . . . 0.0 108.815 -177.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 59.7 mt -65.92 -27.79 68.45 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 127.346 2.904 . . . . 0.0 110.739 -176.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -63.31 -31.66 72.88 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 125.251 1.595 . . . . 0.0 114.677 -178.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -74.48 -49.36 22.5 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 124.814 1.321 . . . . 0.0 109.847 171.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.18 -37.41 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.774 1.63 . . . . 0.0 108.48 -173.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.45 -35.01 63.32 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 127.846 2.458 . . . . 0.0 113.601 175.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 16.8 tp -57.79 -50.09 74.42 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 116.879 -3.638 . . . . 0.0 110.597 166.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' B' ' 29' ' ' ALA . 22.4 tp -63.52 -45.45 90.54 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.844 178.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -56.73 -44.94 82.13 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.812 2.045 . . . . 0.0 113.419 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -66.55 -43.94 83.73 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 172.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' B' ' 26' ' ' LEU . . . -50.44 -49.35 55.18 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 119.214 -2.179 . . . . 0.0 114.238 173.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 30' ' ' TYR . . . . . 0.404 ' C ' ' H ' ' B' ' 32' ' ' ASN . 1.6 m-85 -64.65 -37.69 88.45 Favored 'General case' 0 N--CA 1.45 -0.457 1 CA-C-O 111.37 -4.157 . . . . 0.0 105.206 -176.166 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -57.26 -4.94 0.24 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 123.639 2.927 . . . . 0.0 116.47 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 32' ' ' ASN . . . . . 0.404 ' H ' ' C ' ' B' ' 30' ' ' TYR . 49.0 m-80 -141.48 3.18 1.69 Allowed 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 129.002 2.921 . . . . 0.0 114.61 -167.304 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 65.79 19.43 11.35 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 129.503 3.121 . . . . 0.0 118.298 170.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 26.2 mt -87.81 0.69 55.45 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 113.367 -1.742 . . . . 0.0 114.843 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -59.19 -40.92 87.24 Favored 'General case' 0 N--CA 1.45 -0.425 1 O-C-N 115.573 -4.454 . . . . 0.0 113.286 -170.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.557 HD13 HG21 ' A' ' 23' ' ' VAL . 29.4 tp -66.89 -47.61 53.46 Favored Pre-proline 0 N--CA 1.451 -0.41 0 CA-C-O 113.51 -3.138 . . . . 0.0 110.109 -178.236 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.22 -49.07 18.27 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 124.934 3.756 . . . . 0.0 116.567 167.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 21.8 tp -56.08 -40.78 74.13 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 119.201 3.037 . . . . 0.0 119.201 168.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 82.4 mt -73.61 -16.55 61.23 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 113.986 -2.912 . . . . 0.0 109.338 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . 0.344 33.6 m-20 -78.8 -40.46 32.95 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 123.025 2.648 . . . . 0.0 110.945 169.11 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 56.4 tp -65.88 -30.13 70.69 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 117.336 2.347 . . . . 0.0 117.336 169.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.2 mmt -105.82 -8.27 17.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 121.535 1.97 . . . . 0.0 109.039 -169.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 19.5 mt -134.94 135.23 41.34 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 120.501 1.5 . . . . 0.0 109.298 176.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 59.0 p -75.42 159.32 82.21 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-O 114.037 -2.887 . . . . 0.0 112.879 170.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -67.97 -20.56 44.64 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 CA-C-O 113.025 -2.99 . . . . 0.0 112.885 -172.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.78 -35.65 73.13 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 128.153 3.408 . . . . 0.0 112.372 166.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -86.8 -36.57 18.46 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 126.078 2.111 . . . . 0.0 112.28 -176.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' ARG . . . . . 0.44 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 16.3 mtm-85 -68.19 -30.21 69.25 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.069 -1.423 . . . . 0.0 114.157 170.222 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -71.38 -25.91 62.56 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 114.651 -2.595 . . . . 0.0 114.135 167.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.81 -53.02 62.41 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 124.592 2.139 . . . . 0.0 114.915 158.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.292 30.7 mt -62.12 -42.78 99.57 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 116.63 -1.653 . . . . 0.0 114.849 -175.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.32 -31.67 79.69 Favored Glycine 0 CA--C 1.522 0.519 0 C-N-CA 118.096 -2.002 . . . . 0.0 113.798 174.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . 0.258 25.8 m -64.01 -45.05 90.67 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.638 2.375 . . . . 0.0 111.303 170.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -73.08 -27.51 61.76 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 118.891 -2.38 . . . . 0.0 112.385 -171.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 23.8 t -56.85 -38.28 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 1 O-C-N 115.01 -4.807 . . . . 0.0 112.889 163.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -76.97 -33.06 57.66 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 120.656 1.571 . . . . 0.0 110.38 -176.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 45.0 mt -64.3 -56.08 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 128.383 2.673 . . . . 0.0 113.536 173.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.267 94.0 t -44.69 -48.16 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 119.136 3.013 . . . . 0.0 119.136 167.385 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -58.75 -54.72 43.89 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 126.99 2.681 . . . . 0.0 110.924 173.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -59.93 -33.29 71.69 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.831 -1.793 . . . . 0.0 109.437 -175.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 42.6 mt -60.89 -42.59 98.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 116.308 -1.805 . . . . 0.0 108.901 178.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 47.8 mt -72.64 -24.55 61.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.753 1.908 . . . . 0.0 114.995 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 31.9 ttm105 -87.08 -50.12 6.85 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.421 -1.276 . . . . 0.0 112.208 -176.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.02 37.91 36.85 Favored Glycine 0 CA--C 1.525 0.687 0 CA-C-N 121.249 1.841 . . . . 0.0 116.865 177.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -113.23 -28.94 7.44 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 118.237 -2.92 . . . . 0.0 114.14 -175.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 24.5 mtt -82.72 131.17 35.21 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 -168.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 29.6 p -62.61 166.25 5.53 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 128.338 2.655 . . . . 0.0 113.066 170.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -72.15 -25.04 61.55 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 123.921 3.055 . . . . 0.0 112.428 -177.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -63.33 -48.06 79.58 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 131.437 3.895 . . . . 0.0 109.202 169.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -67.06 -38.93 86.65 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.409 HD23 HD12 ' B' ' 75' ' ' LEU . 78.0 mt -54.68 -42.05 70.92 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 124.471 1.107 . . . . 0.0 112.133 168.284 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -71.33 -21.51 62.04 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 115.09 -2.386 . . . . 0.0 113.595 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -130.41 -39.37 1.31 Allowed 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 124.758 3.435 . . . . 0.0 110.159 -163.191 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -71.38 -49.39 42.62 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 124.874 2.273 . . . . 0.0 112.091 173.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 75' ' ' LEU . . . . . 0.409 HD12 HD23 ' B' ' 71' ' ' LEU . 16.9 mt -96.53 3.86 52.4 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 112.766 -2.016 . . . . 0.0 115.977 170.13 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 56.79 33.39 63.17 Favored Glycine 0 C--N 1.337 0.593 0 O-C-N 118.037 -2.914 . . . . 0.0 115.387 172.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.71 139.94 52.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 120.952 2.376 . . . . 0.0 115.389 -168.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.23 153.86 36.18 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 127.889 2.661 . . . . 0.0 114.006 169.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . 0.251 23.8 mm -62.85 -23.18 32.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 120.557 2.179 . . . . 0.0 112.148 -172.223 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.67 -41.89 95.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 119.728 -1.857 . . . . 0.0 112.504 167.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -69.16 -19.18 64.0 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 116.722 -3.736 . . . . 0.0 114.188 174.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 mm -81.35 -54.16 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-O 123.969 1.842 . . . . 0.0 113.591 172.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 25.7 m -55.71 -35.17 65.79 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 118.573 -2.579 . . . . 0.0 114.86 174.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -56.81 -50.65 71.74 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 118.746 -2.471 . . . . 0.0 114.409 168.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -57.25 -42.99 93.73 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 128.402 2.905 . . . . 0.0 118.927 173.164 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 4.0 p -72.39 -42.41 65.22 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 175.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -47.57 -37.59 12.64 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 158.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 13.8 m -75.32 -28.75 59.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 120.086 1.312 . . . . 0.0 112.487 -176.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 mt -84.68 -43.73 14.07 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 128.179 2.591 . . . . 0.0 106.448 -178.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 18.5 tttm -54.13 -40.8 67.7 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 121.858 2.117 . . . . 0.0 110.711 176.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.05 4.55 44.77 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 117.606 2.447 . . . . 0.0 117.606 -179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.408 ' HB1' HD23 ' B' ' 96' ' ' LEU . . . -67.07 135.62 93.95 Favored Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 117.539 2.422 . . . . 0.0 117.539 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -51.83 128.76 27.69 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 N-CA-C 106.755 -2.056 . . . . 0.0 106.755 176.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 34.5 m -65.32 -23.21 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -163.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -62.24 -31.58 72.16 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 170.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 96' ' ' LEU . . . . . 0.408 HD23 ' HB1' ' B' ' 92' ' ' ALA . 13.7 tp -80.28 -36.54 34.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 126.588 1.955 . . . . 0.0 112.674 171.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 58.0 mtp85 -61.92 -43.96 97.76 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 177.075 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.69 -37.66 85.19 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.06 1.344 . . . . 0.0 110.415 177.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 79.1 t90 -67.15 -45.62 76.51 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 124.765 2.222 . . . . 0.0 108.906 -172.002 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 70.2 mt -67.98 -27.26 66.43 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 111.835 -3.936 . . . . 0.0 110.378 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -68.99 -37.09 78.53 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 125.191 3.632 . . . . 0.0 109.266 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -82.04 -30.2 31.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.435 2.294 . . . . 0.0 114.852 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 76.9 t -62.17 -55.3 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 O-C-N 121.327 -0.858 . . . . 0.0 108.859 167.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . 0.29 33.2 mt -82.17 -55.2 4.69 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 124.345 2.021 . . . . 0.0 111.73 -156.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 32.1 mt -79.59 -2.78 44.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 118.087 -2.883 . . . . 0.0 114.13 -163.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -123.33 4.03 9.13 Favored 'General case' 0 N--CA 1.454 -0.268 1 C-N-CA 132.765 4.426 . . . . 0.0 110.926 -177.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 16.5 m -114.43 -35.95 4.78 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 115.532 -2.175 . . . . 0.0 110.949 162.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 33.0 t70 . . . . . 0 C--O 1.25 1.091 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 169.395 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . 0.296 61.9 mtp . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.428 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.294 . . -87.78 132.58 34.11 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 126.327 1.851 . . . . 0.0 110.054 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -109.05 132.75 53.81 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 119.513 1.051 . . . . 0.0 110.899 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -103.59 149.85 24.52 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 166.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 5' ' ' SER . . . . . 0.417 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 32.7 p -125.03 150.45 66.61 Favored Pre-proline 0 N--CA 1.45 -0.446 0 O-C-N 126.682 2.489 . . . . 0.0 109.545 177.3 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 6' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' C' ' 5' ' ' SER . 63.6 Cg_exo -66.32 -9.85 25.37 Favored 'Trans proline' 0 N--CA 1.446 -1.282 0 C-N-CA 124.573 3.515 . . . . 0.0 116.388 -174.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -155.08 158.08 38.52 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 118.082 -2.886 . . . . 0.0 107.589 176.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 10.6 t -150.06 121.89 8.14 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 131.311 3.844 . . . . 0.0 112.065 157.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.34 -40.9 78.98 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 116.845 -3.66 . . . . 0.0 114.579 171.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.57 -41.41 73.26 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 120.78 1.627 . . . . 0.0 115.355 172.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 25.3 mtt -56.67 -40.73 76.05 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.651 1.58 . . . . 0.0 108.694 178.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.94 -37.79 79.09 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 119.305 -2.122 . . . . 0.0 112.94 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -68.95 -16.8 63.83 Favored 'General case' 0 N--CA 1.448 -0.541 1 CA-C-O 109.224 -5.179 . . . . 0.0 116.79 165.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -84.66 -31.1 24.35 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 125.04 3.563 . . . . 0.0 110.868 163.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -33.27 75.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 124.677 1.236 . . . . 0.0 113.114 170.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . 0.265 84.7 t60 -78.59 -30.83 46.9 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 126.019 2.075 . . . . 0.0 109.62 -177.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -69.18 -23.93 63.99 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 117.413 -1.715 . . . . 0.0 114.863 171.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -77.6 -32.82 53.82 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 124.502 1.121 . . . . 0.0 111.84 -179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -64.9 -43.04 94.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 130.899 3.68 . . . . 0.0 114.225 165.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mp -66.86 -30.04 70.1 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 116.612 -3.805 . . . . 0.0 110.279 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -74.53 -34.02 62.9 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 124.085 1.898 . . . . 0.0 110.739 -175.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 22' ' ' PHE . . . . . 0.411 ' CE2' HD22 ' D' ' 51' ' ' LEU . 5.4 t80 -59.99 -39.33 85.36 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 115.916 -1.992 . . . . 0.0 112.622 170.019 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 78.7 t -68.55 -46.23 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 C-N-CA 128.284 2.633 . . . . 0.0 110.983 174.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -64.77 -41.54 95.78 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 117.723 2.49 . . . . 0.0 117.723 176.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 45.7 tp -57.11 -40.94 78.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 127.442 3.496 . . . . 0.0 110.689 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 15.8 tp -71.65 -28.39 63.73 Favored 'General case' 0 N--CA 1.447 -0.579 1 O-C-N 115.955 -4.215 . . . . 0.0 116.579 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -63.86 -44.11 94.08 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.129 -1.891 . . . . 0.0 108.728 170.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -71.69 -31.39 66.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 126.834 2.584 . . . . 0.0 111.229 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.42 83.85 Favored 'General case' 0 N--CA 1.443 -0.785 0 O-C-N 119.15 -2.219 . . . . 0.0 115.232 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -58.17 -24.74 60.06 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 126.768 3.175 . . . . 0.0 117.167 169.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -76.51 -22.99 53.73 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 111.821 -2.445 . . . . 0.0 114.092 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 32.7 p-10 -135.55 19.38 3.33 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.237 2.215 . . . . 0.0 112.253 -174.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.263 1.6 m-20 60.92 24.34 14.37 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 117.362 -3.336 . . . . 0.0 115.619 178.042 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 18.4 mt -89.2 4.46 48.56 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.642 171.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . 0.402 32.6 p-80 -53.66 -56.74 14.6 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 117.454 2.39 . . . . 0.0 117.454 175.397 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.73 -57.15 27.55 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-O 115.862 -2.018 . . . . 0.0 105.813 175.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -52.69 -37.56 75.46 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 CA-C-N 124.323 2.58 . . . . 0.0 114.507 175.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 64.4 tp -74.65 -23.28 58.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 122.927 2.603 . . . . 0.0 112.654 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 35.4 mt -90.09 -38.21 13.71 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 119.512 1.051 . . . . 0.0 112.237 174.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -43.93 -38.4 3.4 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.712 1.205 . . . . 0.0 110.446 162.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 57.6 tp -83.43 -40.15 19.68 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 118.42 -2.675 . . . . 0.0 114.004 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 42' ' ' MET . . . . . 0.4 ' SD ' ' HB3' ' D' ' 54' ' ' ARG . 26.1 mmm -96.07 -6.28 38.98 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 119.786 -1.821 . . . . 0.0 112.143 -171.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 10.1 mp -119.24 146.8 44.92 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.044 1.738 . . . . 0.0 108.158 175.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . 0.387 41.6 p -70.2 156.83 91.2 Favored Pre-proline 0 N--CA 1.449 -0.487 0 C-N-CA 127.468 2.307 . . . . 0.0 114.518 158.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -50.25 -31.46 29.39 Favored 'Trans proline' 0 N--CA 1.45 -1.063 0 C-N-CA 124.743 3.629 . . . . 0.0 112.001 165.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.66 -30.6 65.9 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 127.248 2.219 . . . . 0.0 113.419 175.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -82.21 -36.87 26.83 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 120.447 -1.408 . . . . 0.0 108.453 -174.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 48' ' ' ARG . . . . . 0.405 ' HD2' ' CE2' ' D' ' 19' ' ' TRP . 73.1 mtm-85 -66.04 -42.33 89.72 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 115.394 -2.241 . . . . 0.0 112.903 171.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -58.04 -52.42 65.6 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 127.901 3.251 . . . . 0.0 111.271 176.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -41.88 -59.89 1.56 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 128.37 2.668 . . . . 0.0 110.791 169.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 28.7 mt -63.78 -34.42 77.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 119.213 3.042 . . . . 0.0 119.213 178.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.84 -56.47 24.95 Favored Glycine 0 C--N 1.336 0.55 0 O-C-N 126.798 2.561 . . . . 0.0 113.124 170.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . 0.315 17.6 m -45.04 -53.77 7.43 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 159.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 54' ' ' ARG . . . . . 0.419 ' HA ' HD12 ' C' ' 57' ' ' ILE . 95.2 mtt180 -59.7 -33.66 71.89 Favored 'General case' 0 N--CA 1.449 -0.498 1 O-C-N 114.756 -4.965 . . . . 0.0 117.88 172.772 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 17.1 t -57.38 -51.63 67.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 121.19 -0.944 . . . . 0.0 110.612 169.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 45.9 mtp180 -66.52 -26.72 67.29 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 113.396 -3.192 . . . . 0.0 113.593 -174.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 57' ' ' ILE . . . . . 0.419 HD12 ' HA ' ' C' ' 54' ' ' ARG 0.251 77.8 mt -70.42 -27.17 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 105.392 -2.077 . . . . 0.0 105.392 175.284 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 40.1 t -78.84 -39.7 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 122.369 2.35 . . . . 0.0 112.335 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -49.83 -47.09 51.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 119.042 -2.286 . . . . 0.0 111.366 169.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -75.79 -22.3 56.52 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 115.336 -2.269 . . . . 0.0 116.034 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 63.6 mt -86.39 -15.23 41.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 123.579 2.9 . . . . 0.0 108.255 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 16.7 mt -83.03 -41.71 18.35 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 123.256 2.753 . . . . 0.0 108.824 172.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.5 ttm105 -66.02 -25.93 67.29 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 116.687 2.106 . . . . 0.0 116.687 170.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.77 2.39 0.02 OUTLIER Glycine 0 C--N 1.336 0.548 0 C-N-CA 127.517 2.484 . . . . 0.0 118.469 -178.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -66.06 -39.42 90.08 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 121.815 2.807 . . . . 0.0 110.903 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 16.0 mmt -55.58 123.15 13.08 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 124.659 2.171 . . . . 0.0 113.157 175.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 92.5 p -83.91 -174.96 5.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 112.826 -1.988 . . . . 0.0 111.791 -174.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -67.5 -28.31 67.73 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 122.208 2.276 . . . . 0.0 112.112 -173.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 34.1 ttp-105 -59.48 -64.55 0.9 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 127.63 2.372 . . . . 0.0 113.872 171.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -53.69 -39.94 65.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 128.301 2.64 . . . . 0.0 112.976 176.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 77.2 mt -64.17 -12.22 38.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.375 -1.453 . . . . 0.0 114.706 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -107.08 -48.64 3.43 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.023 2.529 . . . . 0.0 112.783 171.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -88.96 10.9 19.78 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -174.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -137.85 -36.71 0.61 Allowed 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 111.929 -3.891 . . . . 0.0 110.08 166.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 7.8 mp -95.77 0.22 52.11 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 120.477 3.51 . . . . 0.0 120.477 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 44.3 -125.36 5.87 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-O 115.199 -3.0 . . . . 0.0 119.85 171.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.04 -18.85 16.07 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 120.728 2.264 . . . . 0.0 113.149 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.11 -29.3 73.98 Favored Glycine 0 CA--C 1.523 0.57 0 O-C-N 117.299 -3.375 . . . . 0.0 109.656 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tt -43.81 -34.81 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 117.733 2.494 . . . . 0.0 117.733 162.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.64 -59.22 5.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 121.126 3.75 . . . . 0.0 121.126 173.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 9.1 m -43.62 -47.13 7.51 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 115.341 -2.266 . . . . 0.0 109.849 172.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.259 44.5 mm -60.29 -30.42 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 122.213 2.279 . . . . 0.0 113.203 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 61.0 p -118.34 3.22 11.93 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 119.127 -2.233 . . . . 0.0 114.536 -163.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 67.8 mtp85 -116.76 136.67 52.78 Favored 'General case' 0 N--CA 1.45 -0.428 1 C-N-CA 131.856 4.062 . . . . 0.0 115.039 175.042 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 97.76 161.59 31.05 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-O 115.794 -2.67 . . . . 0.0 113.816 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 66.7 m -56.83 -12.28 1.86 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 113.465 -3.16 . . . . 0.0 117.812 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -103.84 15.01 29.7 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 122.387 2.358 . . . . 0.0 113.698 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 3.0 p -68.05 162.91 23.54 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 116.803 -1.57 . . . . 0.0 114.504 -171.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 17.3 tp -47.01 -42.64 18.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 121.979 2.172 . . . . 0.0 115.791 -172.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -91.16 -10.76 40.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 119.989 3.329 . . . . 0.0 119.989 171.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.72 -28.53 64.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 116.872 -1.537 . . . . 0.0 109.819 167.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.77 162.98 31.8 Favored Pre-proline 0 N--CA 1.453 -0.316 0 C-N-CA 129.526 3.13 . . . . 0.0 117.716 -163.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_exo -55.36 148.14 52.94 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 124.285 3.323 . . . . 0.0 111.957 172.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 18.1 t -71.13 -45.35 72.02 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 CA-C-N 110.139 -3.21 . . . . 0.0 106.991 -169.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 18.7 pm0 -65.77 -28.43 69.02 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 113.788 -3.006 . . . . 0.0 111.672 -179.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 36.6 tp -71.36 -46.27 60.85 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 125.184 2.421 . . . . 0.0 115.57 169.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -63.18 -33.73 76.12 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 112.37 -3.681 . . . . 0.0 110.022 -177.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -83.35 -31.29 26.86 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 127.618 3.074 . . . . 0.0 113.378 173.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 82.0 t90 -63.29 -54.19 40.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 170.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 78.8 mt -55.55 -29.24 58.63 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.513 1.125 . . . . 0.0 109.329 -175.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -71.52 -34.91 70.49 Favored 'General case' 0 N--CA 1.452 -0.34 1 C-N-CA 132.08 4.152 . . . . 0.0 109.825 -178.031 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -75.19 -26.26 58.88 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 111.075 -2.784 . . . . 0.0 113.117 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 54.2 t -97.42 -47.98 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-N 113.145 -1.843 . . . . 0.0 113.142 -176.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 73.4 mt -85.38 -22.7 28.29 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -169.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 64.5 mt -111.36 17.06 20.53 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 119.088 -2.258 . . . . 0.0 112.698 176.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -55.3 132.45 47.95 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 125.941 2.781 . . . . 0.0 116.69 176.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 17.5 m -106.88 -26.63 11.14 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 117.342 -3.349 . . . . 0.0 114.464 173.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 25.2 t0 . . . . . 0 C--O 1.249 1.049 0 N-CA-C 118.207 2.669 . . . . 0.0 118.207 177.134 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 9.5 ttt . . . . . 0 N--CA 1.473 0.716 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . 0.285 . . -154.97 172.57 17.88 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 128.247 2.619 . . . . 0.0 112.755 176.598 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -140.66 157.84 44.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 124.337 2.018 . . . . 0.0 110.723 -167.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -140.72 145.93 37.11 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 128.2 2.6 . . . . 0.0 112.539 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 1.7 p -126.81 161.29 54.26 Favored Pre-proline 0 N--CA 1.449 -0.483 0 C-N-CA 128.089 2.556 . . . . 0.0 115.802 174.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -76.09 -0.04 9.87 Favored 'Trans proline' 0 N--CA 1.444 -1.383 0 CA-C-O 117.587 -1.089 . . . . 0.0 112.615 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -162.89 120.29 1.96 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.184 2.593 . . . . 0.0 110.455 165.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 15.8 p -74.82 149.88 39.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 113.147 -3.421 . . . . 0.0 110.965 -168.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.77 -33.91 73.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 126.299 1.84 . . . . 0.0 115.347 174.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.36 -14.28 59.47 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 124.474 2.083 . . . . 0.0 112.491 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 4.8 mmt -87.15 -36.13 18.22 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 117.804 -3.06 . . . . 0.0 105.81 -175.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.98 -23.25 66.29 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 116.627 -3.796 . . . . 0.0 117.331 168.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -74.35 -40.75 61.95 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 126.927 2.642 . . . . 0.0 116.035 156.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -62.72 -36.92 84.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 119.815 1.189 . . . . 0.0 109.465 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -36.25 77.17 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 115.158 -2.353 . . . . 0.0 113.735 175.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -69.88 -24.87 63.47 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 122.564 2.438 . . . . 0.0 117.412 172.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -82.09 -39.53 23.23 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.342 1.057 . . . . 0.0 108.544 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -62.92 -29.32 70.7 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 169.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 19' ' ' TRP . . . . . 0.405 ' CE2' ' HD2' ' C' ' 48' ' ' ARG . 38.4 t-105 -70.69 -35.84 72.98 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 117.49 -3.256 . . . . 0.0 112.859 166.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 64.4 mt -80.19 -18.36 49.86 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 119.059 -2.276 . . . . 0.0 115.442 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 42.3 ttt180 -69.05 -29.11 67.18 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 126.535 1.934 . . . . 0.0 112.857 162.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -75.09 -48.4 24.03 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 114.409 -2.71 . . . . 0.0 112.347 166.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 46.7 t -56.67 -38.78 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 124.524 3.329 . . . . 0.0 112.272 174.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -73.05 -48.27 37.54 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 125.528 1.768 . . . . 0.0 113.081 173.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 39.0 tp -52.93 -48.61 67.18 Favored 'General case' 0 N--CA 1.448 -0.563 1 O-C-N 115.173 -4.704 . . . . 0.0 109.307 173.663 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.25 -46.7 87.67 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 120.364 1.438 . . . . 0.0 110.507 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -51.61 -46.83 63.74 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 116.123 1.898 . . . . 0.0 116.123 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -66.73 -27.85 67.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 119.109 -2.244 . . . . 0.0 108.578 174.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.307 . . -69.66 -23.91 63.53 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.049 2.94 . . . . 0.0 114.785 173.219 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -76.43 -28.26 56.54 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 120.449 -1.407 . . . . 0.0 111.031 165.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -75.44 -24.28 57.03 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 119.895 -1.753 . . . . 0.0 113.085 -175.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 55.1 p30 -116.33 9.93 14.61 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 121.134 3.753 . . . . 0.0 121.134 164.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 55.59 32.54 19.39 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 116.693 -1.622 . . . . 0.0 115.278 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 60.8 mt -80.78 -1.51 43.21 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 120.411 1.46 . . . . 0.0 112.578 164.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . 0.331 0.0 OUTLIER -38.8 -75.6 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 119.418 3.118 . . . . 0.0 119.418 -179.279 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.292 50.8 mt -46.44 -45.33 44.37 Favored Pre-proline 0 N--CA 1.446 -0.631 0 CA-C-O 113.528 -3.13 . . . . 0.0 115.298 174.222 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -55.0 -37.23 93.86 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 124.538 3.492 . . . . 0.0 114.063 168.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 41.3 tp -75.09 -46.94 31.28 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 176.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 61.8 mt -57.85 -31.23 66.47 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.757 2.023 . . . . 0.0 112.804 171.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -79.0 -40.61 31.05 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 117.0 -3.563 . . . . 0.0 112.31 176.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 54.9 tp -51.01 -55.92 15.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 118.954 -2.341 . . . . 0.0 111.68 164.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 22.2 mmt -83.5 -25.03 31.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 115.943 -1.98 . . . . 0.0 115.401 -172.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 31.9 mt -116.96 141.3 48.42 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 122.173 2.26 . . . . 0.0 113.2 -176.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 44' ' ' THR . . . . . 0.437 ' HB ' ' HD2' ' D' ' 45' ' ' PRO . 46.4 p -70.58 156.03 92.54 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 127.923 2.489 . . . . 0.0 109.347 170.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 45' ' ' PRO . . . . . 0.437 ' HD2' ' HB ' ' D' ' 44' ' ' THR . 17.7 Cg_endo -65.28 -36.69 34.75 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 O-C-N 117.93 -1.668 . . . . 0.0 113.868 -168.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.255 0.1 OUTLIER -69.65 -10.82 59.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.834 -2.416 . . . . 0.0 115.477 173.894 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -78.91 -40.3 32.57 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.508 1.523 . . . . 0.0 108.982 166.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 41.0 mtm-85 -71.14 -36.44 72.09 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 119.164 -2.21 . . . . 0.0 116.829 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.19 -36.19 82.82 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 119.667 -1.896 . . . . 0.0 112.493 167.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.1 -30.38 43.8 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 117.72 -3.113 . . . . 0.0 111.421 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 51' ' ' LEU . . . . . 0.411 HD22 ' CE2' ' C' ' 22' ' ' PHE . 56.4 mt -68.84 -52.7 27.13 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 118.625 -2.547 . . . . 0.0 113.844 167.364 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -48.45 -36.36 17.17 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-O 115.614 -2.77 . . . . 0.0 115.162 164.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 25.6 m -76.13 -26.55 56.46 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 121.087 2.444 . . . . 0.0 113.516 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 54' ' ' ARG . . . . . 0.4 ' HB3' ' SD ' ' C' ' 42' ' ' MET . 72.9 mtt180 -66.22 -34.36 77.84 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 116.928 -1.51 . . . . 0.0 109.354 171.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . 0.255 42.8 t -44.71 -49.09 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-O 126.471 3.034 . . . . 0.0 115.562 171.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -86.42 -21.98 26.81 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 112.017 -2.356 . . . . 0.0 116.507 -176.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.13 -39.05 84.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 122.35 1.071 . . . . 0.0 112.932 166.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 85.0 t -60.69 -54.44 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 C-N-CA 127.928 2.491 . . . . 0.0 112.415 165.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -67.06 -35.63 80.28 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -178.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -79.24 -18.19 53.32 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 121.922 2.147 . . . . 0.0 112.484 176.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 17.0 mt -63.43 -58.8 5.9 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 117.686 -1.149 . . . . 0.0 109.09 162.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 11.1 mt -63.55 -42.48 98.38 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.242 -2.132 . . . . 0.0 105.242 -171.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -62.46 -41.6 98.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 177.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 59.16 44.53 96.33 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 118.064 1.985 . . . . 0.0 118.064 175.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -132.16 -22.52 2.26 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 121.732 2.766 . . . . 0.0 115.966 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 25.1 mmt -92.49 56.57 2.76 Favored 'General case' 0 N--CA 1.448 -0.566 1 O-C-N 129.433 4.208 . . . . 0.0 108.019 168.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 64.4 p -93.22 176.16 6.5 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 125.603 1.814 . . . . 0.0 112.777 -148.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 51.69 -82.76 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 114.653 -2.594 . . . . 0.0 112.027 168.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -88.43 -24.57 22.99 Favored 'General case' 0 N--CA 1.451 -0.39 1 CA-C-N 126.803 4.365 . . . . 0.0 113.346 -174.051 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -83.79 -44.06 14.77 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 53.0 mt -45.52 -43.01 11.48 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 120.534 3.531 . . . . 0.0 120.534 163.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 30.3 mtmm -79.73 -38.84 32.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 116.564 2.061 . . . . 0.0 116.564 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -112.22 -17.62 12.73 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -162.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -107.21 -50.02 3.16 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.106 1.762 . . . . 0.0 114.398 168.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.56 -27.49 51.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.551 1.541 . . . . 0.0 112.355 170.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 76' ' ' GLY . . . . . 0.412 ' O ' HG22 ' D' ' 79' ' ' ILE . . . 84.92 -157.33 32.16 Favored Glycine 0 CA--C 1.522 0.505 1 O-C-N 113.496 -5.752 . . . . 0.0 118.206 136.372 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.67 -23.42 11.32 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.432 1.893 . . . . 0.0 114.11 -169.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.56 14.13 25.47 Favored Glycine 0 C--N 1.334 0.47 1 O-C-N 115.227 -4.671 . . . . 0.0 114.682 177.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 79' ' ' ILE . . . . . 0.412 HG22 ' O ' ' D' ' 76' ' ' GLY . 14.9 tt -93.59 -15.19 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.826 0 C-N-CA 117.9 -1.52 . . . . 0.0 108.598 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.15 -18.6 42.25 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 130.303 3.441 . . . . 0.0 108.802 176.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 95.7 m -84.62 -34.03 23.19 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 121.749 -0.594 . . . . 0.0 110.256 175.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 18.6 mm -87.07 -35.65 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 C-N-CA 127.421 2.288 . . . . 0.0 111.764 -178.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 11.5 p -118.39 4.46 11.82 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 116.879 -1.534 . . . . 0.0 114.386 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 33.1 mtp85 -119.66 -169.68 1.81 Allowed 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 120.453 1.479 . . . . 0.0 112.246 151.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.17 171.04 40.17 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.936 -159.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 90.4 p -71.43 -35.2 70.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 120.155 3.391 . . . . 0.0 120.155 -164.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -130.35 72.36 1.49 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 126.209 2.909 . . . . 0.0 104.678 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 6.5 p -88.26 -177.96 5.8 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 129.66 3.184 . . . . 0.0 111.579 173.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.07 -15.5 61.5 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 117.528 -3.232 . . . . 0.0 113.629 167.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -70.63 -25.81 63.19 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 161.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -78.96 -34.68 44.14 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -176.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 56.85 72.64 0.92 Allowed Pre-proline 0 N--CA 1.447 -0.612 0 O-C-N 126.582 2.426 . . . . 0.0 115.48 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 93' ' ' PRO . . . . . 0.595 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.326 0.1 OUTLIER 24.07 33.51 0.0 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.283 0 N-CA-C 116.502 1.693 . . . . 0.0 116.502 45.509 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 63.1 t -59.14 -31.17 45.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 173.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 95' ' ' GLU . . . . . 0.595 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.327 0.0 OUTLIER -67.91 -35.18 78.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.528 -2.607 . . . . 0.0 115.166 176.384 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 30.6 tp -66.89 -53.08 35.79 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 126.754 2.533 . . . . 0.0 107.043 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 23.8 ttp180 -52.28 -38.52 58.54 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 120.967 3.692 . . . . 0.0 120.967 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.18 -24.95 54.75 Favored 'General case' 0 N--CA 1.444 -0.729 0 O-C-N 126.23 2.206 . . . . 0.0 109.979 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 54.8 t90 -87.72 -41.12 13.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 127.693 3.12 . . . . 0.0 110.508 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 29.6 mt -60.61 -32.05 71.2 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 114.934 -2.46 . . . . 0.0 109.655 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -58.89 -44.79 91.26 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 123.013 2.642 . . . . 0.0 114.868 177.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -91.8 -5.35 53.61 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 129.186 2.994 . . . . 0.0 113.743 -173.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 98.8 t -95.44 -41.7 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 O-C-N 118.658 -2.526 . . . . 0.0 112.611 164.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 16.9 mt -97.17 -27.71 14.43 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 121.055 0.455 . . . . 0.0 111.538 -172.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.352 3.3 mp -108.38 54.98 0.65 Allowed 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 121.22 -0.925 . . . . 0.0 112.149 167.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -78.12 176.75 8.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 126.983 3.277 . . . . 0.0 112.789 -173.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 59.7 m -61.72 -27.16 68.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 117.424 2.379 . . . . 0.0 117.424 -172.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 130.831 3.652 . . . . 0.0 110.576 176.454 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 tmt? . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 117.439 -1.267 . . . . 0.0 113.716 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.16 77.59 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 123.821 3.009 . . . . 0.0 113.7 -168.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -72.92 -34.49 66.63 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.787 1.235 . . . . 0.0 112.81 168.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.7 mp0 -80.36 -8.67 59.6 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 120.775 1.625 . . . . 0.0 113.694 -175.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.2 m -76.67 129.19 80.04 Favored Pre-proline 0 N--CA 1.45 -0.447 0 C-N-CA 126.917 2.087 . . . . 0.0 107.644 -161.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.58 -32.36 4.81 Favored 'Trans proline' 0 N--CA 1.448 -1.16 0 CA-C-O 115.798 -1.834 . . . . 0.0 112.281 -169.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -139.38 160.91 38.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.162 2.585 . . . . 0.0 114.91 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 30.6 t -139.13 122.02 16.61 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 122.321 2.328 . . . . 0.0 111.54 163.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.17 -46.21 72.26 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.691 1.71 . . . . 0.0 112.662 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.03 -36.43 84.34 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 115.833 -4.292 . . . . 0.0 117.593 177.191 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.8 tpt -70.23 -37.93 75.12 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 115.95 -1.976 . . . . 0.0 109.594 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.59 -25.6 68.04 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 120.329 1.422 . . . . 0.0 112.433 170.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -75.63 -38.9 58.53 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 117.682 -3.136 . . . . 0.0 109.817 175.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -66.0 -45.43 81.6 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.639 -0.696 . . . . 0.0 109.296 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -63.11 -22.2 66.7 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 128.729 2.811 . . . . 0.0 116.481 169.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -80.71 -48.91 11.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 125.543 1.777 . . . . 0.0 112.046 173.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -65.05 -20.82 66.67 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 125.526 1.53 . . . . 0.0 112.82 172.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -72.13 -48.95 39.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 170.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.42 ' CH2' HD13 ' B' ' 39' ' ' LEU . 0.2 OUTLIER -62.01 -37.16 83.8 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.56 2.744 . . . . 0.0 115.535 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . 0.299 51.9 mt -63.73 -13.77 46.45 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.812 1.645 . . . . 0.0 115.247 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -75.31 -26.65 58.84 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 118.343 -2.723 . . . . 0.0 117.633 173.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -68.25 -26.8 65.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 124.655 1.182 . . . . 0.0 111.446 163.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.7 t -80.6 -23.71 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 122.061 2.21 . . . . 0.0 114.287 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -77.57 -41.3 39.34 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 128.744 2.817 . . . . 0.0 114.892 161.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.0 tp -67.17 -40.97 86.69 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 124.937 1.398 . . . . 0.0 113.02 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.9 tp -70.23 -31.54 69.0 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 119.447 -2.033 . . . . 0.0 113.613 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -71.12 -38.09 72.31 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 127.361 2.913 . . . . 0.0 110.801 178.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -64.68 -37.87 89.06 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 174.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.87 -36.5 82.46 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 120.038 1.29 . . . . 0.0 113.42 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -54.28 -35.26 62.39 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 118.074 2.62 . . . . 0.0 118.074 166.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -74.02 -25.66 60.0 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.208 -2.182 . . . . 0.0 115.539 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -98.81 0.06 43.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 128.541 2.736 . . . . 0.0 113.172 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 39.42 35.69 0.18 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 118.242 2.682 . . . . 0.0 118.242 -155.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.1 mt -89.02 2.41 54.06 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -71.38 -43.8 66.17 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 117.705 -3.122 . . . . 0.0 115.946 -161.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.44 -42.56 5.27 Favored Pre-proline 0 N--CA 1.452 -0.356 0 CA-C-N 121.626 2.012 . . . . 0.0 107.193 -177.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -42.4 -55.61 2.49 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 124.991 3.794 . . . . 0.0 111.895 162.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 52.7 tp -64.88 -33.17 75.37 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 177.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.3 mt -77.86 -30.63 51.0 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 122.136 2.244 . . . . 0.0 110.781 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -65.41 -29.67 70.39 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 122.297 2.317 . . . . 0.0 112.92 165.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.4 tp -67.09 -49.4 65.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 117.451 -3.281 . . . . 0.0 109.689 171.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 32.6 mmt -76.52 -36.11 57.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 126.421 1.889 . . . . 0.0 115.578 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 48.2 mt -111.39 132.91 54.08 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 122.149 2.25 . . . . 0.0 115.153 -175.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.9 p -61.79 166.41 6.09 Favored Pre-proline 0 N--CA 1.448 -0.527 0 CA-C-O 114.393 -2.717 . . . . 0.0 117.573 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -64.86 -23.4 62.31 Favored 'Trans proline' 0 N--CA 1.452 -0.943 0 N-CA-C 119.684 2.917 . . . . 0.0 119.684 -177.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -94.48 -24.2 17.39 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 124.465 1.103 . . . . 0.0 111.533 -174.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -75.31 -22.29 57.79 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 118.416 -1.314 . . . . 0.0 111.124 168.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.3 mtm-85 -72.94 -48.94 32.46 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 114.948 -2.454 . . . . 0.0 109.443 172.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -66.69 -32.05 73.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 127.306 2.879 . . . . 0.0 112.618 175.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.96 -48.77 75.18 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.193 2.269 . . . . 0.0 110.517 167.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.5 mt -65.16 -45.05 86.51 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 116.598 -3.814 . . . . 0.0 113.792 -175.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.16 -36.61 83.05 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 118.779 2.272 . . . . 0.0 118.779 171.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.3 m -67.27 -34.65 77.85 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 119.788 -2.007 . . . . 0.0 114.102 173.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -69.19 -16.92 63.73 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 115.937 1.829 . . . . 0.0 115.937 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 52.3 t -72.34 -38.49 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 126.273 1.829 . . . . 0.0 109.457 167.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 33.5 ttt180 -61.79 -42.62 99.23 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 121.927 2.149 . . . . 0.0 112.045 167.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.1 mt -53.84 -50.97 48.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 3.3 t -76.25 -25.21 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -172.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -70.97 -52.5 19.41 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 116.293 -1.813 . . . . 0.0 106.355 171.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -69.61 -23.48 63.52 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 123.525 2.875 . . . . 0.0 115.282 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.311 80.6 mt -69.48 -49.23 56.75 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 128.553 2.741 . . . . 0.0 116.136 171.022 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 40.7 tp -65.81 -40.2 91.62 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 128.219 2.607 . . . . 0.0 111.407 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -74.97 -48.31 24.91 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.974 2.11 . . . . 0.0 111.302 172.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.6 16.17 75.8 Favored Glycine 0 C--O 1.224 -0.47 0 C-N-CA 124.829 1.204 . . . . 0.0 113.517 167.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -70.83 -44.88 65.6 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.235 -3.509 . . . . 0.0 113.174 173.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 50.9 mtp -79.78 124.45 28.62 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 131.612 3.965 . . . . 0.0 111.212 168.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.5 p -97.21 177.34 5.6 Favored 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 127.215 2.822 . . . . 0.0 112.804 -174.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -54.0 -44.68 71.1 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 118.981 -2.324 . . . . 0.0 114.863 -178.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 50.2 tpt85 -71.43 -29.02 64.39 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 125.747 1.905 . . . . 0.0 107.281 -175.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -73.23 -44.05 60.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 117.199 -1.381 . . . . 0.0 108.967 178.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 36.2 mt -70.13 -10.8 59.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 116.005 -1.95 . . . . 0.0 114.219 -175.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -75.33 -42.16 55.01 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 113.479 -3.153 . . . . 0.0 109.182 171.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -55.05 -31.71 61.34 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 128.436 3.585 . . . . 0.0 117.219 171.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -91.04 -41.33 11.14 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 118.443 -2.66 . . . . 0.0 114.724 -166.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 44.5 mt -109.51 -9.5 14.91 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -176.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 83.38 -29.38 3.59 Favored Glycine 0 C--N 1.339 0.709 0 CA-C-O 115.139 -3.034 . . . . 0.0 116.237 170.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -85.77 -159.18 0.44 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 117.984 2.587 . . . . 0.0 117.984 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.49 154.74 40.67 Favored Glycine 0 C--N 1.337 0.599 0 CA-C-O 116.809 -2.106 . . . . 0.0 111.348 -166.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.3 mt -59.62 -30.04 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-O 116.221 -1.847 . . . . 0.0 111.034 170.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.91 -18.57 65.33 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.628 2.467 . . . . 0.0 115.544 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 44.0 p -60.35 -29.59 69.0 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 118.137 -0.935 . . . . 0.0 111.895 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.9 mm -83.69 -53.67 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 C-N-CA 127.789 2.436 . . . . 0.0 105.153 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.2 m -54.4 -56.27 20.29 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.606 1.962 . . . . 0.0 112.786 -174.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -58.79 -36.34 74.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.77 -37.18 75.73 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 114.05 -1.432 . . . . 0.0 114.533 177.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 5.4 m -63.44 -51.27 66.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 113.447 -1.377 . . . . 0.0 111.122 173.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -62.42 -43.38 98.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 127.028 2.131 . . . . 0.0 111.576 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.9 m -65.65 -26.75 67.94 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 114.635 -2.602 . . . . 0.0 116.916 169.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.452 ' O ' ' HB3' ' A' ' 92' ' ' ALA . 19.7 tp -76.38 -34.15 58.88 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 127.418 2.949 . . . . 0.0 110.433 177.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -61.08 -31.75 71.41 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 118.032 2.604 . . . . 0.0 118.032 161.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -86.66 -4.76 59.22 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 124.284 1.992 . . . . 0.0 113.359 170.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 89' ' ' LEU . . . -58.46 150.53 54.87 Favored Pre-proline 0 N--CA 1.445 -0.684 0 O-C-N 117.934 -2.979 . . . . 0.0 115.636 167.459 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -65.8 158.04 55.82 Favored 'Trans proline' 0 N--CA 1.448 -1.176 1 C-N-CA 125.895 4.397 . . . . 0.0 108.787 162.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.5 m -77.35 -38.54 26.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 O-C-N 122.204 -0.31 . . . . 0.0 111.752 -166.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -59.68 -24.3 63.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 119.561 -1.962 . . . . 0.0 112.33 177.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 16.4 tp -67.02 -55.87 12.55 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 119.903 1.228 . . . . 0.0 113.138 172.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 46.2 mtm-85 -57.1 -45.8 83.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 115.708 1.744 . . . . 0.0 115.708 169.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -63.09 -28.53 70.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.164 -2.835 . . . . 0.0 111.852 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 29.7 t90 -73.49 -44.67 57.32 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 169.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 104' ' ' LEU . 70.7 mt -59.72 -27.89 66.86 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 115.449 -2.215 . . . . 0.0 109.751 174.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -74.3 -24.16 59.2 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 123.599 2.909 . . . . 0.0 115.024 175.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -86.28 -30.0 22.64 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.697 0.799 . . . . 0.0 112.666 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.4 t -84.37 -34.99 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 O-C-N 118.951 -2.343 . . . . 0.0 110.627 173.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 100' ' ' LEU . 27.3 mt -94.02 -45.3 7.65 Favored 'General case' 0 N--CA 1.45 -0.454 1 O-C-N 114.857 -4.902 . . . . 0.0 112.287 -167.07 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 56.8 mt -111.5 0.69 16.58 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 120.799 3.629 . . . . 0.0 120.799 -169.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.254 67.9 tttt -82.18 -43.96 17.03 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 116.473 -3.892 . . . . 0.0 113.748 -165.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 14.4 p -76.58 -32.65 58.28 Favored 'General case' 0 N--CA 1.45 -0.463 1 O-C-N 116.209 -4.057 . . . . 0.0 115.751 -174.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 . . . . . 0 C--O 1.251 1.155 0 O-C-N 123.888 0.742 . . . . 0.0 111.07 -169.4 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tmt? . . . . . 0 N--CA 1.473 0.723 0 CA-C-O 121.678 0.751 . . . . 0.0 108.984 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.04 -51.04 17.07 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 117.015 -3.553 . . . . 0.0 116.503 -150.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -66.41 -18.21 65.23 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 167.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -85.86 -45.73 11.28 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 117.451 2.389 . . . . 0.0 117.451 178.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 66.4 m -76.1 143.44 73.72 Favored Pre-proline 0 N--CA 1.446 -0.666 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -168.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -18.5 22.77 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 C-N-CA 123.889 3.059 . . . . 0.0 113.385 173.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -142.67 162.05 36.47 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 122.123 2.238 . . . . 0.0 110.962 154.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 10.1 t -149.17 140.17 22.93 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 127.342 2.257 . . . . 0.0 111.052 174.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.44 76.7 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 116.917 -3.614 . . . . 0.0 110.511 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.09 -41.77 79.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 123.326 1.536 . . . . 0.0 110.595 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 13.1 mmt -63.01 -40.16 96.93 Favored 'General case' 0 N--CA 1.449 -0.496 1 O-C-N 115.948 -4.22 . . . . 0.0 112.885 176.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.01 -44.83 79.34 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.873 3.269 . . . . 0.0 111.545 -178.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -62.97 -30.93 71.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 120.791 1.632 . . . . 0.0 114.313 168.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -69.94 -36.56 75.39 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 114.555 -2.64 . . . . 0.0 111.314 172.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -72.71 -27.17 61.9 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 115.433 -2.222 . . . . 0.0 113.016 176.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -71.95 -36.6 69.92 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 124.822 3.465 . . . . 0.0 113.505 168.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -67.01 -37.14 83.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 117.103 -1.427 . . . . 0.0 110.302 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -72.84 -24.62 60.91 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 114.308 -2.758 . . . . 0.0 107.741 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 7.1 t-105 -69.5 -51.39 36.27 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 124.512 3.324 . . . . 0.0 108.965 169.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.65 -16.53 49.47 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 126.52 1.928 . . . . 0.0 115.441 177.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -64.03 -48.23 77.13 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.093 1.757 . . . . 0.0 110.733 173.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -56.54 -40.41 75.05 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.213 1.405 . . . . 0.0 113.185 173.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 14.0 t -80.61 -33.93 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 O-C-N 118.968 -2.332 . . . . 0.0 114.659 -178.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -66.78 -39.22 87.75 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.113 0.965 . . . . 0.0 113.067 169.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 25.4 tp -50.62 -63.38 1.14 Allowed 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 118.979 -2.326 . . . . 0.0 107.427 161.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.252 41.8 tp -59.72 -45.83 90.97 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 121.421 1.919 . . . . 0.0 115.244 -172.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -51.93 -43.17 63.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 116.828 2.159 . . . . 0.0 116.828 170.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -67.42 -37.5 83.14 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 116.677 2.103 . . . . 0.0 116.677 170.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.28 -38.37 52.39 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.498 1.919 . . . . 0.0 111.87 173.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -64.31 -48.14 76.76 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 128.176 2.591 . . . . 0.0 113.264 175.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -44.26 -31.86 1.13 Allowed 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 117.631 -3.168 . . . . 0.0 114.523 171.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -108.57 -3.84 17.68 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 129.46 3.104 . . . . 0.0 115.167 -175.086 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.33 4.9 m-20 60.28 10.68 2.48 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 -176.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -69.22 1.19 3.92 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 167.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -64.4 -44.7 90.46 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 115.868 -2.015 . . . . 0.0 114.97 -171.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 65.5 tp -72.58 -36.79 3.91 Favored Pre-proline 0 N--CA 1.447 -0.609 0 CA-C-N 121.631 2.014 . . . . 0.0 112.315 -173.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 0.8 OUTLIER -58.2 -29.35 87.24 Favored 'Trans proline' 0 N--CA 1.445 -1.349 0 N-CA-C 121.537 3.63 . . . . 0.0 121.537 161.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 27.2 tp -72.75 -35.29 67.47 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 172.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 39' ' ' LEU . . . . . 0.42 HD13 ' CH2' ' A' ' 19' ' ' TRP 0.253 60.8 mt -73.61 -22.81 59.91 Favored 'General case' 0 N--CA 1.445 -0.677 1 O-C-N 115.717 -4.364 . . . . 0.0 114.456 176.502 . . . . . . . . 4 3 . 1 . 015 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -70.04 -33.41 71.93 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.836 0.854 . . . . 0.0 108.952 171.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 48.8 tp -84.26 -46.63 11.63 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.077 1.751 . . . . 0.0 106.343 -178.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 15.7 mmt -86.12 -17.41 35.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 123.861 0.726 . . . . 0.0 112.296 -161.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mp -126.34 138.4 53.57 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 120.867 -1.146 . . . . 0.0 112.521 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 46.8 p -78.64 161.52 69.05 Favored Pre-proline 0 N--CA 1.446 -0.626 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -46.68 -45.39 20.04 Favored 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 123.012 2.475 . . . . 0.0 114.261 175.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.48 -36.08 68.7 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 126.626 3.108 . . . . 0.0 117.338 177.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -90.56 -25.17 20.34 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 112.062 -2.336 . . . . 0.0 113.22 -178.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 62.8 mtm-85 -61.09 -35.11 76.11 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 119.421 3.119 . . . . 0.0 119.421 155.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -73.05 -35.65 66.75 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 126.332 2.27 . . . . 0.0 111.826 174.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.35 -53.73 53.85 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 115.442 -2.218 . . . . 0.0 110.358 167.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.282 33.1 mt -63.93 -52.34 60.24 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 121.595 1.998 . . . . 0.0 112.609 178.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.97 -27.12 12.68 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 118.456 2.142 . . . . 0.0 118.456 173.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 32.0 m -80.87 -50.63 9.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 116.132 -1.89 . . . . 0.0 112.806 163.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -53.18 -32.48 48.09 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 122.774 2.534 . . . . 0.0 110.104 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.4 -41.05 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 O-C-N 117.253 -3.404 . . . . 0.0 107.78 176.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -80.92 -26.34 36.83 Favored 'General case' 0 N--CA 1.449 -0.497 1 O-C-N 114.898 -4.876 . . . . 0.0 112.265 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 68.7 mt -65.58 -45.18 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 O-C-N 118.918 -2.364 . . . . 0.0 108.436 173.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 65.6 t -69.66 -36.92 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 O-C-N 117.943 -2.973 . . . . 0.0 108.92 -179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -61.92 -47.34 85.38 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 124.357 2.027 . . . . 0.0 113.834 169.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -74.92 -22.02 58.86 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 116.359 -3.963 . . . . 0.0 111.94 -177.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 79.8 mt -70.3 -14.83 62.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.764 0.826 . . . . 0.0 111.601 167.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 84.2 mt -106.77 -13.81 15.16 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.421 1.088 . . . . 0.0 113.511 177.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 20.4 ttm105 -87.41 -47.57 8.67 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.162 -2.836 . . . . 0.0 111.962 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 65.37 69.9 1.23 Allowed Glycine 0 C--N 1.334 0.465 1 O-C-N 130.018 4.574 . . . . 0.0 115.201 -175.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -139.39 -30.69 0.71 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 119.745 1.773 . . . . 0.0 113.511 176.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 33.2 mtt -81.62 134.67 35.51 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.132 2.271 . . . . 0.0 117.132 -172.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 83.0 p -81.88 168.6 17.76 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 128.574 3.671 . . . . 0.0 112.218 179.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.404 ' HA ' HD12 ' B' ' 71' ' ' LEU . 67.1 mt-30 -64.22 -17.25 63.38 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 121.291 1.859 . . . . 0.0 114.658 -175.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -74.03 -51.11 16.87 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 168.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -75.11 -22.56 58.14 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 116.619 -2.032 . . . . 0.0 115.981 -175.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' B' ' 68' ' ' GLN . 78.5 mt -57.66 -45.48 85.47 Favored 'General case' 0 N--CA 1.451 -0.417 1 CA-C-O 131.311 5.339 . . . . 0.0 111.79 170.101 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -66.33 -28.32 68.58 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 117.958 -2.964 . . . . 0.0 113.021 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -87.29 -75.56 0.4 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 121.614 2.007 . . . . 0.0 116.241 167.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -56.58 -33.56 66.3 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 120.563 3.542 . . . . 0.0 120.563 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 29.5 mt -101.11 -8.75 21.98 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 120.014 1.279 . . . . 0.0 109.726 169.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.54 7.49 40.75 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-O 118.285 -1.286 . . . . 0.0 112.421 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.36 156.89 21.73 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 -174.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.17 158.2 52.17 Favored Glycine 0 C--N 1.334 0.434 0 CA-C-N 110.737 -2.938 . . . . 0.0 113.922 167.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 37.3 mm -71.16 -31.85 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 C-N-CA 124.331 1.052 . . . . 0.0 111.634 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.76 -43.81 90.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 120.368 -1.458 . . . . 0.0 114.169 165.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 3.5 m -54.19 -36.9 63.92 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 113.319 -3.229 . . . . 0.0 111.56 169.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 19.2 mm -73.0 -40.66 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 O-C-N 126.361 2.288 . . . . 0.0 105.265 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 32.2 m -74.85 -33.87 62.19 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 115.586 1.698 . . . . 0.0 115.586 -167.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -49.43 -44.1 45.15 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 114.634 -2.603 . . . . 0.0 112.478 155.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.4 -55.34 15.78 Favored Glycine 0 C--N 1.335 0.479 0 C-N-CA 126.387 1.946 . . . . 0.0 111.789 177.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 2.4 p -50.52 -37.37 38.78 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 123.574 3.687 . . . . 0.0 114.189 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -71.31 -35.69 71.36 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 119.741 -1.85 . . . . 0.0 115.57 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 44.3 m -67.3 -27.96 67.6 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 166.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.91 -42.67 66.44 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.156 1.535 . . . . 0.0 109.977 178.368 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -67.53 -38.91 84.91 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 172.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.14 -4.51 39.15 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 115.423 -2.227 . . . . 0.0 113.229 177.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.41 157.8 55.46 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 120.626 1.557 . . . . 0.0 111.331 -169.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -54.91 132.94 55.05 Favored 'Trans proline' 0 N--CA 1.45 -1.082 1 C-N-CA 125.841 4.361 . . . . 0.0 110.461 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.309 16.6 m -59.8 -26.39 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 116.158 1.91 . . . . 0.0 116.158 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.309 17.5 pm0 -49.57 -52.67 28.53 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 126.681 1.993 . . . . 0.0 114.53 165.666 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 17.4 tp -63.32 -42.82 99.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 124.894 2.283 . . . . 0.0 108.344 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 60.5 mtp85 -63.62 -47.4 81.53 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.855 -1.778 . . . . 0.0 113.858 -175.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -61.37 -37.92 85.14 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 115.584 -2.151 . . . . 0.0 115.009 170.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 16.7 t90 -70.68 -38.13 73.71 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 119.97 1.259 . . . . 0.0 108.519 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 26.1 mt -68.58 -37.49 79.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 119.826 1.194 . . . . 0.0 111.86 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -65.56 -38.71 90.34 Favored 'General case' 0 N--CA 1.445 -0.678 1 O-C-N 115.443 -4.535 . . . . 0.0 114.841 173.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -62.18 -55.21 30.87 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 118.893 -2.379 . . . . 0.0 112.181 164.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.23 -34.5 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 C-N-CA 123.139 0.575 . . . . 0.0 110.015 -164.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 87.9 mt -90.38 -49.72 6.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 118.688 2.847 . . . . 0.0 118.688 -176.04 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 19.1 mt -82.59 -34.31 27.71 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.488 1.613 . . . . 0.0 112.921 -166.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -67.3 -16.69 64.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.971 164.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 48.9 m -103.05 6.12 38.51 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.935 -2.978 . . . . 0.0 118.944 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.312 33.6 t70 . . . . . 0 C--O 1.25 1.084 0 N-CA-C 120.112 3.375 . . . . 0.0 120.112 -169.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . 0.257 6.1 mtt . . . . . 0 N--CA 1.469 0.516 0 CA-C-O 123.926 1.822 . . . . 0.0 106.951 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.94 179.25 7.82 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 125.745 1.618 . . . . 0.0 112.629 179.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -151.28 119.25 6.22 Favored 'General case' 0 N--CA 1.448 -0.529 1 O-C-N 116.115 -4.116 . . . . 0.0 107.519 -171.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -108.3 149.47 28.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.443 -2.036 . . . . 0.0 107.685 171.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 25.0 p -129.94 148.16 68.45 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 103.476 -2.787 . . . . 0.0 103.476 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -53.6 -38.93 84.42 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.071 2.514 . . . . 0.0 118.12 -171.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -145.98 166.27 26.53 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 117.568 -3.208 . . . . 0.0 107.021 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 3.1 t -154.55 132.15 11.35 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 105.143 -2.169 . . . . 0.0 105.143 170.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.35 -41.33 89.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.44 1.496 . . . . 0.0 112.676 168.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.25 86.84 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 119.028 -2.295 . . . . 0.0 111.384 177.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 37.4 mtt -60.61 -35.6 76.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 120.046 -1.659 . . . . 0.0 113.086 171.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.76 -25.2 63.7 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.116 1.366 . . . . 0.0 113.659 168.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -71.02 -26.57 63.17 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 122.679 1.228 . . . . 0.0 109.036 171.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -77.29 -38.61 50.33 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.247 -2.783 . . . . 0.0 108.665 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -37.1 86.32 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 124.193 1.949 . . . . 0.0 112.039 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -62.76 -41.63 99.31 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 112.813 -1.994 . . . . 0.0 105.985 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 -69.95 -24.32 63.33 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 117.828 -3.045 . . . . 0.0 112.346 178.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -62.93 -48.41 79.04 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 126.088 2.851 . . . . 0.0 114.206 169.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 54.9 t-105 -55.58 -42.44 74.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 116.453 -3.904 . . . . 0.0 118.058 160.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 3.8 mp -63.08 -15.16 55.7 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 122.019 2.19 . . . . 0.0 115.975 167.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 43.6 ttt-85 -87.43 -32.55 19.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 122.539 1.162 . . . . 0.0 111.363 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -54.48 -42.65 70.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.449 -3.282 . . . . 0.0 113.112 157.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 17.1 t -78.79 -26.93 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 126.462 1.905 . . . . 0.0 107.115 -171.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -83.02 -29.38 28.94 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.418 0.687 . . . . 0.0 112.627 172.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 33.2 tp -68.26 -47.3 68.09 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 121.078 -1.014 . . . . 0.0 111.03 172.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 67.2 tp -68.36 -32.11 71.96 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -176.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -55.46 -53.37 57.19 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.825 -2.422 . . . . 0.0 109.381 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -68.3 -22.58 64.71 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 125.976 2.048 . . . . 0.0 116.051 174.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.89 -27.34 65.7 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 116.869 -3.645 . . . . 0.0 113.454 -177.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -61.23 -30.95 70.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 117.795 2.517 . . . . 0.0 117.795 167.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -71.91 -22.24 61.51 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 118.345 2.72 . . . . 0.0 118.345 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 51.0 p-10 -114.8 24.19 11.99 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 120.264 -1.522 . . . . 0.0 112.342 161.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.331 18.3 m-20 57.21 24.42 9.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.914 2.486 . . . . 0.0 114.767 173.515 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 mt -85.96 -12.44 50.43 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 173.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -40.39 -56.3 2.05 Favored 'General case' 0 N--CA 1.448 -0.529 1 O-C-N 115.621 -4.425 . . . . 0.0 114.035 174.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 81.0 mt -68.53 -48.13 33.94 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-O 116.802 -1.57 . . . . 0.0 111.925 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . 0.31 30.3 Cg_endo -55.69 -25.32 50.25 Favored 'Trans proline' 0 N--CA 1.449 -1.098 1 C-N-CA 127.279 5.32 . . . . 0.0 115.216 168.666 . . . . . . . . 3 2 . 1 . 015 nuclear build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -73.92 -48.15 32.78 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 123.178 2.717 . . . . 0.0 107.109 172.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 84.8 mt -63.99 -25.34 68.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 125.752 1.907 . . . . 0.0 114.723 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -68.19 -27.79 66.71 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 119.352 0.978 . . . . 0.0 112.809 165.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 14.2 tp -78.59 -55.18 5.39 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 126.634 3.112 . . . . 0.0 110.969 172.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 55.3 mmm -67.76 -18.25 64.81 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 121.679 3.955 . . . . 0.0 121.679 -168.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . 0.269 8.5 mp -131.5 165.37 23.72 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 117.971 -2.956 . . . . 0.0 106.156 -178.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 29.3 p -91.51 154.54 44.29 Favored Pre-proline 0 N--CA 1.449 -0.509 0 C-N-CA 124.935 1.294 . . . . 0.0 112.226 165.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_exo -49.71 -31.26 24.94 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 N-CA-C 115.596 1.345 . . . . 0.0 115.596 167.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.65 -24.92 60.06 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 176.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -76.68 -36.33 57.34 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 120.416 -1.427 . . . . 0.0 113.929 168.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . 0.252 90.3 mtm-85 -57.82 -37.69 74.25 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 115.193 -2.337 . . . . 0.0 109.856 176.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -70.41 -53.34 16.88 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 128.954 3.909 . . . . 0.0 109.319 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . 0.343 . . -44.88 -49.87 10.7 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 116.301 -3.999 . . . . 0.0 117.715 165.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 33.6 mt -63.81 -44.14 94.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 117.102 -1.427 . . . . 0.0 112.817 177.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.45 -26.59 69.65 Favored Glycine 0 CA--C 1.523 0.54 0 O-C-N 126.409 2.318 . . . . 0.0 111.309 -177.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 6.0 m -80.65 -32.95 36.01 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.41 -2.818 . . . . 0.0 114.241 173.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.25 91.1 mtt180 -71.71 -19.77 62.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 115.801 -2.047 . . . . 0.0 113.092 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 55' ' ' VAL . . . . . 0.424 ' HA ' ' HE1' ' D' ' 42' ' ' MET . 23.7 t -69.14 -40.79 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 C-N-CA 128.045 2.538 . . . . 0.0 109.977 162.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -68.75 -37.0 79.09 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 112.158 -3.782 . . . . 0.0 110.507 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 57' ' ' ILE . . . . . 0.492 HG23 HD23 ' C' ' 75' ' ' LEU . 37.7 mt -60.39 -43.11 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 O-C-N 126.576 2.422 . . . . 0.0 109.25 175.05 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 47.4 t -67.48 -42.36 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 120.917 1.69 . . . . 0.0 111.297 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -51.0 -49.31 60.64 Favored 'General case' 0 N--CA 1.449 -0.514 1 C-N-CA 131.707 4.003 . . . . 0.0 114.479 166.623 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -64.56 -38.23 90.28 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 118.193 -2.817 . . . . 0.0 114.479 173.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 20.1 mt -78.23 -30.53 48.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 122.406 2.366 . . . . 0.0 109.642 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 35.1 mt -80.4 -22.21 41.5 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.56 -3.212 . . . . 0.0 114.443 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -66.76 -37.16 84.08 Favored 'General case' 0 N--CA 1.449 -0.494 1 C-N-CA 134.502 5.121 . . . . 0.0 110.218 169.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.25 19.75 64.42 Favored Glycine 0 CA--C 1.521 0.431 0 CA-C-O 116.629 -2.206 . . . . 0.0 114.423 177.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -96.83 -30.76 12.98 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -171.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 18.8 mmt -55.3 142.75 30.68 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 118.003 2.594 . . . . 0.0 118.003 166.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 30.7 p -95.18 170.17 9.58 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 129.543 3.137 . . . . 0.0 109.005 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.57 -35.21 75.52 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 116.19 -1.862 . . . . 0.0 113.014 -172.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 32.8 ttp180 -67.47 -41.73 84.15 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 120.935 1.698 . . . . 0.0 115.456 172.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.11 -35.53 64.15 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 -175.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 24.2 mt -57.99 -21.1 42.98 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.311 3.044 . . . . 0.0 110.341 169.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -106.34 -29.64 9.64 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 123.87 3.032 . . . . 0.0 112.688 175.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -97.78 -37.33 9.9 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 115.539 1.681 . . . . 0.0 115.539 -174.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -90.04 -43.47 10.49 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 119.438 -2.039 . . . . 0.0 109.939 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 75' ' ' LEU . . . . . 0.492 HD23 HG23 ' C' ' 57' ' ' ILE . 10.9 mp -86.04 9.03 18.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-O 124.275 1.988 . . . . 0.0 114.922 173.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 58.97 -142.13 46.62 Favored Glycine 0 C--N 1.337 0.597 1 C-N-CA 130.834 4.064 . . . . 0.0 112.238 161.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.36 -26.8 23.18 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 119.469 -2.195 . . . . 0.0 113.413 164.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.13 2.81 3.68 Favored Glycine 0 CA--C 1.525 0.713 1 CA-C-O 112.586 -4.452 . . . . 0.0 116.41 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tt -66.67 -40.38 86.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 120.748 2.274 . . . . 0.0 115.259 165.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.49 -23.78 52.01 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.474 2.31 . . . . 0.0 115.775 171.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 1.7 m -71.75 -28.32 63.58 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 119.885 -1.76 . . . . 0.0 112.704 169.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 9.2 mm -92.65 -22.91 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 1 O-C-N 115.525 -4.485 . . . . 0.0 117.127 -171.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 73.0 p -123.32 -1.23 8.68 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 118.177 2.658 . . . . 0.0 118.177 -164.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 69.1 mtp85 -125.8 158.93 33.74 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 129.021 2.929 . . . . 0.0 111.575 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 76.96 164.08 19.64 Favored Glycine 0 C--O 1.224 -0.497 0 O-C-N 121.168 -0.957 . . . . 0.0 112.807 -177.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 66.7 m -67.96 -7.98 33.25 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 112.205 -3.76 . . . . 0.0 117.016 -163.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -117.82 18.62 14.01 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 131.078 3.751 . . . . 0.0 112.697 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 17.0 p -68.38 178.19 2.07 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 89' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' C' ' 89' ' ' LEU . 20.4 tp -59.86 -38.59 82.56 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 118.468 -1.293 . . . . 0.0 112.338 -173.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.346 94.1 mttt -101.75 6.41 41.74 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 127.537 2.335 . . . . 0.0 117.027 -176.212 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -120.61 -9.07 9.44 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 125.189 1.396 . . . . 0.0 112.135 167.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.19 160.21 18.13 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-O 125.743 2.687 . . . . 0.0 112.276 164.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -58.57 125.68 19.06 Favored 'Trans proline' 0 N--CA 1.447 -1.217 1 C-N-CA 126.221 4.614 . . . . 0.0 110.5 -177.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 50.7 t -37.64 -41.08 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 125.851 1.66 . . . . 0.0 110.711 178.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.9 pm0 -74.88 -18.3 60.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 116.285 -1.817 . . . . 0.0 110.83 -174.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -81.43 -38.42 26.48 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 122.596 2.453 . . . . 0.0 110.694 165.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 68.0 mtp180 -59.37 -52.42 65.72 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 118.605 -2.559 . . . . 0.0 110.096 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -47.6 -54.23 12.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 126.241 2.213 . . . . 0.0 114.521 166.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -66.12 -42.1 89.66 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.316 -1.311 . . . . 0.0 114.046 -173.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 61.0 mt -61.49 -48.53 80.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.449 1.9 . . . . 0.0 108.984 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -45.67 -41.42 10.37 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 116.721 -3.737 . . . . 0.0 118.823 164.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -73.95 -32.62 63.57 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.607 1.163 . . . . 0.0 109.529 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 38.9 t -88.38 -46.42 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 -175.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 51.0 mt -82.84 -18.55 40.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 117.63 -3.169 . . . . 0.0 113.028 -158.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 35.0 mt -118.33 3.31 11.92 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 120.573 1.533 . . . . 0.0 114.797 -173.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.352 21.6 pttp -48.37 117.28 1.9 Allowed 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 129.771 3.228 . . . . 0.0 111.53 -170.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 3.7 m -112.63 24.78 12.11 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.919 2.888 . . . . 0.0 117.288 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t0 . . . . . 0 C--O 1.252 1.193 0 CA-C-O 115.33 -2.271 . . . . 0.0 111.685 -171.651 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 16.2 ttt . . . . . 0 N--CA 1.472 0.644 0 CA-C-O 115.404 -2.236 . . . . 0.0 109.022 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.46 149.44 49.57 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 120.575 1.534 . . . . 0.0 112.965 -173.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -128.01 128.41 44.94 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 128.233 2.613 . . . . 0.0 108.485 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -99.83 123.06 43.69 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.084 -1.417 . . . . 0.0 111.396 -175.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 98.1 p -98.86 179.8 0.99 Allowed Pre-proline 0 N--CA 1.448 -0.539 0 C-N-CA 125.89 1.676 . . . . 0.0 114.648 162.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -92.24 -23.35 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.927 0 N-CA-C 116.717 1.776 . . . . 0.0 116.717 175.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -151.12 129.56 12.11 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.63 3.172 . . . . 0.0 106.377 -169.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.83 137.64 42.0 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 112.444 -2.162 . . . . 0.0 110.854 176.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.24 -30.98 69.77 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 120.255 -1.528 . . . . 0.0 111.377 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.56 -14.89 59.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 114.897 -2.478 . . . . 0.0 111.695 175.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 7.2 mmt -70.25 -27.37 64.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 121.782 2.083 . . . . 0.0 113.73 169.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.45 -41.66 72.54 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 120.622 -1.299 . . . . 0.0 112.291 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 21.4 tp10 -63.4 -36.22 83.0 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 113.591 -3.1 . . . . 0.0 107.014 170.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -73.92 -34.84 64.51 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 121.533 1.969 . . . . 0.0 107.797 -174.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 15' ' ' ARG . . . . . 0.408 ' HE ' ' HA ' ' D' ' 15' ' ' ARG 0.298 0.0 OUTLIER -65.63 -29.37 69.94 Favored 'General case' 0 N--CA 1.447 -0.62 1 O-C-N 114.432 -5.168 . . . . 0.0 113.728 -176.997 . . . . . . . . 5 4 . 1 . 015 nuclear build full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -77.63 -29.72 51.89 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 167.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -73.87 -28.4 61.55 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 123.003 1.382 . . . . 0.0 111.04 -178.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -89.56 -18.1 27.25 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 120.325 -1.484 . . . . 0.0 107.652 -176.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 -76.06 -47.35 24.99 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 116.914 -1.517 . . . . 0.0 111.251 162.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.48 -35.38 80.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.196 2.295 . . . . 0.0 117.196 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -63.94 -26.31 68.53 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 118.143 -1.423 . . . . 0.0 113.982 170.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -62.85 -53.46 53.79 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 113.844 -2.979 . . . . 0.0 111.142 166.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.62 -35.09 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 121.179 1.809 . . . . 0.0 110.716 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.33 -41.3 81.0 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 170.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 13.4 tp -63.73 -48.66 76.13 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 26' ' ' LEU . . . . . 0.472 HD13 HD21 ' D' ' 39' ' ' LEU . 53.7 tp -51.67 -48.12 63.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 115.36 -2.257 . . . . 0.0 116.402 173.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 19.5 ttpp -59.32 -52.32 66.17 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 125.397 1.685 . . . . 0.0 110.078 174.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -61.62 -33.83 74.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.713 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.75 -38.75 89.97 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 123.674 2.943 . . . . 0.0 114.975 171.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -61.65 -29.89 70.36 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 123.769 1.747 . . . . 0.0 115.535 172.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -81.28 -25.18 36.75 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -177.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . 0.329 54.3 p30 -102.74 3.74 37.24 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 120.56 -1.338 . . . . 0.0 114.011 164.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.254 1.7 m-20 63.72 26.5 14.51 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 128.744 2.818 . . . . 0.0 113.337 177.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 43.9 mt -93.71 16.86 12.94 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 165.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -52.22 -58.42 6.67 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 126.972 2.109 . . . . 0.0 110.152 174.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.415 22.6 mt -41.87 -63.86 0.78 Allowed Pre-proline 0 N--CA 1.448 -0.549 0 C-N-CA 128.05 2.54 . . . . 0.0 110.964 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -58.87 -36.65 96.6 Favored 'Trans proline' 0 N--CA 1.451 -0.992 0 CA-C-O 114.81 -2.246 . . . . 0.0 115.916 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 33.1 tp -56.0 -54.41 45.16 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 125.226 3.648 . . . . 0.0 112.292 171.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 39' ' ' LEU . . . . . 0.472 HD21 HD13 ' D' ' 26' ' ' LEU . 88.6 mt -62.55 -31.63 72.45 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 115.846 -2.026 . . . . 0.0 110.652 176.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -74.71 -28.35 60.76 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 117.236 -1.786 . . . . 0.0 114.474 170.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -74.07 -51.9 14.31 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 118.44 -2.662 . . . . 0.0 108.615 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 42' ' ' MET . . . . . 0.424 ' HE1' ' HA ' ' C' ' 55' ' ' VAL . 24.8 mmt -63.36 -43.63 97.11 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 113.827 -2.987 . . . . 0.0 116.664 173.228 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 61.4 mt -121.26 142.58 49.79 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 124.81 3.459 . . . . 0.0 107.144 -166.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 38.9 p -77.65 159.26 77.19 Favored Pre-proline 0 N--CA 1.444 -0.738 0 C-N-CA 129.848 3.259 . . . . 0.0 115.729 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -41.84 -50.35 5.08 Favored 'Trans proline' 0 N--CA 1.451 -0.99 0 O-C-N 125.052 2.08 . . . . 0.0 114.341 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -73.53 -20.63 60.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 122.285 2.311 . . . . 0.0 116.288 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -70.32 -38.27 74.87 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 123.321 2.782 . . . . 0.0 109.946 170.112 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 26.0 mtm-85 -74.16 -36.6 64.11 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 118.36 2.726 . . . . 0.0 118.36 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.44 -45.62 84.5 Favored 'General case' 0 N--CA 1.447 -0.62 0 O-C-N 128.672 3.732 . . . . 0.0 114.018 161.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.77 -36.68 62.56 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 117.174 2.287 . . . . 0.0 117.174 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 47.4 mt -62.18 -32.02 72.6 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 120.063 -1.648 . . . . 0.0 107.671 171.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.93 -41.69 71.39 Favored Glycine 0 C--N 1.338 0.677 0 O-C-N 119.109 -2.244 . . . . 0.0 112.365 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 24.8 m -62.77 -31.52 72.5 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.05 2.14 . . . . 0.0 112.971 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 54' ' ' ARG . . . . . 0.463 ' HA ' ' HB ' ' D' ' 57' ' ' ILE . 24.3 mtt180 -71.6 -24.68 61.94 Favored 'General case' 0 N--CA 1.448 -0.544 1 O-C-N 116.134 -4.104 . . . . 0.0 111.834 -177.086 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.66 -43.26 98.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 O-C-N 118.694 -2.504 . . . . 0.0 111.044 170.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.357 3.7 ptm180 -81.92 -25.63 34.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 172.452 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 57' ' ' ILE . . . . . 0.463 ' HB ' ' HA ' ' D' ' 54' ' ' ARG . 54.0 mt -67.0 -32.84 59.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 122.024 0.129 . . . . 0.0 110.775 170.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 57.9 t -68.94 -48.25 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.69 165.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -70.15 -27.1 64.27 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 117.721 -1.592 . . . . 0.0 115.095 -174.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -74.96 -7.93 55.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 116.242 -1.837 . . . . 0.0 113.898 165.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.13 -7.75 55.1 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 121.691 2.041 . . . . 0.0 114.288 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 44.0 mt -97.65 -35.75 10.49 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 165.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -75.33 -32.41 60.9 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 112.08 -3.819 . . . . 0.0 111.768 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 47.03 55.4 8.57 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 121.042 3.177 . . . . 0.0 121.042 168.04 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -130.73 -30.19 1.86 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.082 1.353 . . . . 0.0 107.579 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 22.5 mmt -94.88 51.83 1.42 Allowed 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.844 2.458 . . . . 0.0 106.18 172.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 59.1 p -66.34 171.01 5.21 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 112.194 -2.276 . . . . 0.0 115.277 -169.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.303 6.6 tp-100 49.86 -89.28 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.73 1.612 . . . . 0.0 114.774 166.255 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -80.82 -35.14 33.3 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.273 -2.767 . . . . 0.0 110.238 -172.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -78.24 -31.69 49.37 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 126.459 1.904 . . . . 0.0 112.294 -172.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mt -51.67 -31.1 24.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.82 1.648 . . . . 0.0 113.566 168.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -104.63 -38.65 6.65 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 128.055 2.542 . . . . 0.0 108.43 -172.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -111.33 -14.32 13.8 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 121.982 2.174 . . . . 0.0 113.141 -164.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -118.32 -24.66 6.82 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 113.346 -3.216 . . . . 0.0 115.555 167.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 75' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' D' ' 75' ' ' LEU . 2.5 mm? -83.86 -27.55 28.61 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.332 2.333 . . . . 0.0 110.752 162.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 95.13 -175.34 33.44 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 129.64 3.495 . . . . 0.0 115.647 169.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.293 . . -68.64 -10.73 57.9 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 119.887 -1.949 . . . . 0.0 115.803 -164.12 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.39 -23.82 43.35 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 127.415 2.436 . . . . 0.0 111.094 169.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -46.5 -33.56 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 175.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -100.67 -4.56 28.08 Favored 'General case' 0 N--CA 1.45 -0.452 1 O-C-N 116.085 -4.135 . . . . 0.0 114.678 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 53.3 m -67.86 -33.45 74.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 120.19 1.359 . . . . 0.0 109.75 148.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.389 41.1 mm -85.85 -24.32 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 C-N-CA 131.449 3.899 . . . . 0.0 112.597 -168.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 66.7 p -129.55 6.68 5.23 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 112.106 -2.315 . . . . 0.0 115.203 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -134.16 177.21 7.92 Favored 'General case' 0 N--CA 1.452 -0.354 1 O-C-N 114.616 -5.053 . . . . 0.0 108.318 165.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 84.03 157.59 25.92 Favored Glycine 0 C--N 1.337 0.587 0 O-C-N 117.043 -3.536 . . . . 0.0 111.634 -147.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 38.7 p -72.09 -26.78 62.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 118.888 2.922 . . . . 0.0 118.888 -166.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -133.54 85.81 2.24 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 124.925 2.298 . . . . 0.0 109.62 -170.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 88' ' ' SER . . . . . 0.474 ' H ' ' HB3' ' D' ' 91' ' ' ALA . 59.5 p -131.25 -169.28 2.15 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.644 2.778 . . . . 0.0 109.301 175.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.392 5.4 mp -87.85 27.85 1.1 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 124.091 1.9 . . . . 0.0 109.886 -177.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -107.17 10.59 30.0 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 119.879 -1.763 . . . . 0.0 115.006 147.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 91' ' ' ALA . . . . . 0.474 ' HB3' ' H ' ' D' ' 88' ' ' SER . . . -144.65 -3.81 0.79 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 112.414 -3.66 . . . . 0.0 109.818 -162.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 92' ' ' ALA . . . . . 0.498 ' HA ' ' N ' ' D' ' 94' ' ' VAL . . . 66.01 85.85 0.15 Allowed Pre-proline 0 N--CA 1.448 -0.564 0 CA-C-N 124.676 3.398 . . . . 0.0 117.91 169.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.309 0.0 OUTLIER 30.42 23.23 0.0 OUTLIER 'Cis proline' 0 N--CA 1.451 -1.018 0 N-CA-C 121.107 3.464 . . . . 0.0 121.107 17.373 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' D' D ' 94' ' ' VAL . . . . . 0.498 ' N ' ' HA ' ' D' ' 92' ' ' ALA . 15.1 t -65.74 -31.91 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 119.571 1.078 . . . . 0.0 110.526 161.031 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.358 0.0 OUTLIER -78.52 -36.76 44.38 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 128.716 2.806 . . . . 0.0 109.607 -178.769 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . 0.286 16.3 tp -55.96 -57.41 12.2 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.718 168.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 26.4 ttp-105 -49.09 -40.57 32.46 Favored 'General case' 0 N--CA 1.451 -0.381 1 CA-C-O 110.793 -4.432 . . . . 0.0 115.75 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -62.35 -24.12 67.17 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 127.7 3.125 . . . . 0.0 115.183 177.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -98.22 -35.12 10.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.661 -3.149 . . . . 0.0 110.84 175.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 48.0 mt -53.46 -39.74 64.71 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 120.631 1.559 . . . . 0.0 114.839 168.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . 0.297 15.5 tt0 -80.05 -13.13 59.54 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 117.016 -1.874 . . . . 0.0 107.986 -176.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -104.59 4.76 33.18 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 119.244 -2.16 . . . . 0.0 113.611 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 2.5 t -123.49 -27.06 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 114.401 -2.714 . . . . 0.0 113.73 162.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 29.0 mt -92.99 -27.39 17.05 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 123.985 3.084 . . . . 0.0 118.261 166.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.313 74.7 mt -114.66 30.45 7.32 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 122.615 2.462 . . . . 0.0 107.628 172.357 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -61.49 174.71 0.7 Allowed 'General case' 0 N--CA 1.449 -0.481 1 C-N-CA 131.993 4.117 . . . . 0.0 111.626 -174.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 14.6 m -58.13 -38.1 75.89 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 112.776 -2.011 . . . . 0.0 113.655 -169.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.953 2.501 . . . . 0.0 115.423 -174.478 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.1 ttm . . . . . 0 N--CA 1.449 -0.521 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.2 -39.98 84.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.973 1.471 . . . . 0.0 114.973 171.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -74.42 -46.52 39.57 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -54.37 -52.94 60.07 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 118.968 0.804 . . . . 0.0 112.173 176.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -60.2 -37.0 78.92 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 173.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 40.5 t60 -62.71 -48.99 76.86 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 115.321 -2.276 . . . . 0.0 113.762 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -66.78 -36.57 82.71 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 121.127 1.785 . . . . 0.0 113.889 175.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -58.69 -33.47 70.19 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 117.47 -3.269 . . . . 0.0 110.963 169.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -77.74 -40.81 39.86 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 117.881 2.549 . . . . 0.0 117.881 175.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.8 mt -63.08 -17.88 62.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 117.825 2.528 . . . . 0.0 117.825 172.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -62.21 -52.28 64.42 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 115.275 -2.298 . . . . 0.0 109.991 167.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -53.47 -46.14 69.84 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 127.346 2.904 . . . . 0.0 108.358 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.8 t -72.46 -19.86 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 O-C-N 117.056 -3.527 . . . . 0.0 116.767 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -83.77 -39.02 20.57 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 117.516 -3.24 . . . . 0.0 112.543 163.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.4 tp -49.11 -52.28 26.88 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 124.466 2.079 . . . . 0.0 112.838 170.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.8 tp -81.24 -16.5 52.49 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 118.14 -2.85 . . . . 0.0 108.792 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -64.27 -49.85 70.25 Favored 'General case' 0 N--CA 1.449 -0.481 1 CA-C-N 126.014 4.006 . . . . 0.0 108.771 168.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 58.0 m-20 -71.34 -15.08 62.38 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 118.47 -2.644 . . . . 0.0 112.832 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.17 -36.8 61.45 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 115.265 -2.303 . . . . 0.0 115.457 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -63.0 -37.22 86.3 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.217 2.207 . . . . 0.0 116.003 170.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -67.16 -9.54 41.02 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 113.071 -1.877 . . . . 0.0 114.151 171.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -120.71 4.59 10.57 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.723 -2.486 . . . . 0.0 112.6 173.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.322 13.2 m-20 56.93 29.39 16.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 116.385 1.995 . . . . 0.0 116.385 -170.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.7 mt -102.71 0.61 33.26 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 117.802 -3.061 . . . . 0.0 115.3 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 36.5 p-80 -57.24 -45.75 83.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.927 2.091 . . . . 0.0 110.983 173.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.354 77.2 mt -55.44 -51.44 79.95 Favored Pre-proline 0 N--CA 1.445 -0.69 2 O-C-N 115.938 -4.226 . . . . 0.0 113.368 178.064 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -77.73 -37.77 0.83 Allowed 'Trans proline' 0 N--CA 1.449 -1.126 0 CA-C-O 115.634 -1.903 . . . . 0.0 108.95 -176.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.6 tp -58.6 -40.79 84.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 120.035 1.289 . . . . 0.0 113.562 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.62 -36.98 73.76 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 116.031 -1.938 . . . . 0.0 113.376 174.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -62.16 -23.15 66.42 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 119.469 3.137 . . . . 0.0 119.469 166.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.0 tp -74.25 -48.3 29.56 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 125.872 1.982 . . . . 0.0 115.7 166.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 79.0 mmm -77.29 -8.78 58.19 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.384 -1.293 . . . . 0.0 113.692 -167.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 53.2 mt -144.51 128.84 17.86 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 125.245 1.591 . . . . 0.0 113.741 -166.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 62.3 p -71.78 152.38 93.31 Favored Pre-proline 0 N--CA 1.446 -0.644 0 CA-C-O 122.281 1.038 . . . . 0.0 109.528 176.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -62.38 -13.07 30.55 Favored 'Trans proline' 0 N--CA 1.446 -1.297 0 C-N-CA 122.607 2.205 . . . . 0.0 114.398 -174.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.97 -27.17 18.86 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 119.406 -2.059 . . . . 0.0 112.205 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.81 -46.39 78.81 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 158.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 60.8 mtm-85 -63.2 -40.82 98.59 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 117.971 -1.492 . . . . 0.0 111.286 -178.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -62.03 -36.69 82.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 166.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.24 -25.78 66.26 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 117.322 -3.361 . . . . 0.0 113.798 173.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.1 mt -76.81 -40.9 46.42 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 124.956 2.313 . . . . 0.0 115.348 -177.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -47.23 -56.42 7.99 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 110.85 -2.886 . . . . 0.0 117.065 161.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.1 m -71.86 -35.2 69.74 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 112.542 -1.829 . . . . 0.0 114.311 175.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 60.4 mtt180 -61.75 -34.96 76.78 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 121.229 1.831 . . . . 0.0 111.275 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.4 t -59.29 -42.13 86.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 O-C-N 117.126 -3.484 . . . . 0.0 109.241 171.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -72.73 -26.32 61.53 Favored 'General case' 0 N--CA 1.449 -0.492 1 O-C-N 115.461 -4.525 . . . . 0.0 112.033 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 52.7 mt -67.6 -47.04 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 117.126 -1.416 . . . . 0.0 107.696 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.4 t -62.99 -38.57 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-O 116.412 -1.756 . . . . 0.0 112.069 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -61.84 -49.62 75.54 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 125.127 3.603 . . . . 0.0 112.704 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -76.08 -18.07 59.35 Favored 'General case' 0 N--CA 1.448 -0.546 1 CA-C-O 111.047 -4.311 . . . . 0.0 114.18 -173.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.9 mt -77.55 -33.02 54.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 124.944 3.52 . . . . 0.0 111.795 160.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.2 mt -78.1 -26.42 48.03 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 119.566 -0.854 . . . . 0.0 112.189 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -85.42 -30.99 23.13 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 123.682 1.706 . . . . 0.0 114.855 172.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.25 25.32 61.77 Favored Glycine 0 C--N 1.339 0.718 0 O-C-N 117.203 -3.436 . . . . 0.0 115.749 161.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -110.88 -36.46 5.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 120.544 2.172 . . . . 0.0 110.047 -170.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 55.6 mtp -64.08 139.76 58.8 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 174.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 54.0 p -83.83 173.36 11.33 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 111.793 -2.458 . . . . 0.0 111.442 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -70.72 -28.61 64.86 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 177.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.46 ' NH2' HD21 ' A' ' 73' ' ' ASN . 34.7 ttt85 -80.74 -34.79 34.09 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 114.083 -2.865 . . . . 0.0 107.656 175.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -65.37 -42.93 92.2 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 120.71 1.595 . . . . 0.0 108.761 175.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 40.4 mt -68.13 -20.26 64.89 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 123.083 2.674 . . . . 0.0 110.02 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -87.33 -38.82 15.89 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 120.787 1.63 . . . . 0.0 108.659 -177.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.46 HD21 ' NH2' ' A' ' 69' ' ' ARG . 7.5 m120 -77.11 -30.9 55.47 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 117.002 2.223 . . . . 0.0 117.002 174.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -101.59 -37.9 8.18 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 121.265 1.848 . . . . 0.0 112.215 -170.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.8 mt -106.75 -8.55 16.77 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 130.348 3.459 . . . . 0.0 115.22 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 88.28 -15.43 56.33 Favored Glycine 0 CA--C 1.526 0.742 0 O-C-N 120.033 -1.667 . . . . 0.0 114.717 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.48 119.6 16.92 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 126.833 2.053 . . . . 0.0 115.5 -159.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.59 179.15 26.67 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 119.377 2.511 . . . . 0.0 119.377 172.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 76.1 mt -53.15 -47.86 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 117.838 -1.077 . . . . 0.0 108.141 163.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.36 -49.48 72.15 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -176.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.1 m -65.5 -48.84 71.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.814 0.816 . . . . 0.0 110.958 -167.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.6 mm -65.51 -26.8 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 124.663 2.173 . . . . 0.0 114.917 175.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 55.9 m -71.62 -40.3 69.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 119.433 -2.042 . . . . 0.0 111.075 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 60.9 ttt180 -79.17 -31.45 43.9 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 127.799 2.439 . . . . 0.0 106.15 -176.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -58.37 -55.06 32.79 Favored Glycine 0 CA--C 1.521 0.436 0 O-C-N 120.013 -1.679 . . . . 0.0 112.307 165.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.6 m -69.2 -19.61 63.98 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -81.82 -38.92 24.77 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 116.316 -3.99 . . . . 0.0 107.239 174.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.3 m -66.02 -28.61 68.99 Favored 'General case' 0 N--CA 1.451 -0.415 1 O-C-N 116.192 -4.067 . . . . 0.0 116.589 171.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.85 -42.03 22.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 117.55 -3.219 . . . . 0.0 107.997 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -62.85 -27.08 69.09 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 125.328 1.643 . . . . 0.0 114.274 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.56 -17.25 20.59 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 126.043 1.737 . . . . 0.0 112.792 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.57 153.08 11.07 Favored Pre-proline 0 N--CA 1.45 -0.443 0 O-C-N 119.032 -2.293 . . . . 0.0 113.959 165.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -76.42 155.94 36.63 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 N-CA-C 109.279 -1.085 . . . . 0.0 109.279 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.5 m -66.57 -37.32 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-O 126.397 2.999 . . . . 0.0 113.578 -175.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.4 pm0 -62.46 -19.18 63.27 Favored 'General case' 0 N--CA 1.447 -0.598 1 O-C-N 114.939 -4.851 . . . . 0.0 116.947 170.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 50.8 tp -83.08 -38.67 22.18 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 124.378 1.049 . . . . 0.0 111.805 169.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -73.56 -34.29 65.09 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 117.932 -1.507 . . . . 0.0 109.525 -175.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -68.43 -33.43 74.19 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 84.0 t90 -81.7 -26.83 34.31 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.871 2.068 . . . . 0.0 112.711 -176.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 75.6 mt -69.92 -44.97 68.56 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 116.609 -3.807 . . . . 0.0 115.75 164.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -64.34 -2.85 2.42 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 163.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -91.08 -62.94 1.34 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 119.584 -0.847 . . . . 0.0 109.42 154.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 77.9 t -66.98 -35.81 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-O 118.096 -0.954 . . . . 0.0 109.032 -154.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 33.1 mt -96.01 -7.02 37.5 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 117.698 -3.127 . . . . 0.0 110.794 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 50.4 mt -124.32 7.61 8.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 123.452 2.842 . . . . 0.0 111.857 -172.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.286 60.1 tttt . . . . . 0 N--CA 1.444 -0.735 0 O-C-N 117.133 -3.479 . . . . 0.0 114.635 -177.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.448 0 N-CA-C 118.493 2.775 . . . . 0.0 118.493 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 26.2 ttm -76.68 -29.63 56.4 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 113.808 -2.996 . . . . 0.0 109.948 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . 0.295 . . -62.22 -44.15 97.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 123.364 2.802 . . . . 0.0 110.588 170.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -61.6 -56.43 19.99 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 115.976 -1.964 . . . . 0.0 112.45 170.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -45.6 -43.1 11.96 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 171.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . 0.26 39.4 mmt180 -70.13 -42.05 73.11 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 119.246 -2.159 . . . . 0.0 115.706 171.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -57.59 -41.88 82.07 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 117.326 -3.359 . . . . 0.0 112.588 171.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -75.51 -25.21 57.06 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 113.519 -3.134 . . . . 0.0 115.093 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -59.15 -45.58 90.6 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 122.682 2.492 . . . . 0.0 115.574 158.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 53.2 t-105 -64.04 -52.6 58.66 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.586 2.354 . . . . 0.0 116.811 175.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 89.1 mt -56.16 -31.67 63.6 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 117.295 -3.378 . . . . 0.0 111.625 169.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -69.84 -32.08 70.3 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 122.324 2.329 . . . . 0.0 106.748 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -65.24 -48.46 73.21 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 117.317 -1.325 . . . . 0.0 112.669 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 95.9 t -60.2 -49.84 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 CA-C-O 112.362 -3.685 . . . . 0.0 112.259 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -50.58 -45.92 57.54 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 124.892 3.496 . . . . 0.0 114.845 167.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 24.5 tp -56.92 -45.97 82.32 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 27.2 tp -73.44 -26.63 61.02 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 47.2 tttt -73.0 -43.26 62.36 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 116.763 -1.589 . . . . 0.0 110.125 176.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -62.42 -44.01 97.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 164.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.8 70.21 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 119.55 -1.969 . . . . 0.0 112.64 -175.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -68.38 -30.56 69.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.456 -2.652 . . . . 0.0 111.132 171.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -80.92 -4.34 54.6 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.118 -0.989 . . . . 0.0 113.291 174.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . 0.265 1.1 m-80 -124.67 13.27 8.65 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 116.304 -1.808 . . . . 0.0 113.237 170.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 53.76 23.43 3.73 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 117.064 2.246 . . . . 0.0 117.064 -175.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.1 mt -98.72 15.48 25.16 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 126.512 2.382 . . . . 0.0 112.313 172.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -74.4 -41.65 60.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 123.189 2.722 . . . . 0.0 113.534 -168.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 20.5 mt -69.99 -44.98 22.59 Favored Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-O 117.344 -1.312 . . . . 0.0 113.001 176.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.48 -46.21 30.56 Favored 'Trans proline' 0 N--CA 1.452 -0.968 0 CA-C-N 124.257 2.556 . . . . 0.0 113.475 170.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 61.2 tp -56.87 -52.23 65.93 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 127.187 2.195 . . . . 0.0 113.268 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 29.9 mt -60.48 -35.34 75.68 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 116.013 -1.946 . . . . 0.0 115.625 178.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -70.78 -32.3 69.37 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 128.336 2.655 . . . . 0.0 113.39 171.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 57.8 tp -67.55 -36.18 80.47 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 121.903 -0.498 . . . . 0.0 112.107 165.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 96.7 mmm -90.64 -24.77 20.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 121.553 3.909 . . . . 0.0 121.553 -178.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 10.1 mt -125.69 131.63 52.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 114.3 -2.762 . . . . 0.0 109.28 -176.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.252 73.0 p -71.55 153.69 93.54 Favored Pre-proline 0 N--CA 1.447 -0.583 0 O-C-N 128.545 3.653 . . . . 0.0 118.979 175.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_exo -44.87 -45.25 14.0 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.53 2.82 . . . . 0.0 108.568 -175.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -41.45 80.81 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.011 2.069 . . . . 0.0 114.376 -177.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.12 -39.46 90.09 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.084 2.153 . . . . 0.0 110.975 171.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 48.4 mtm-85 -71.38 -41.82 69.2 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.86 1.664 . . . . 0.0 110.891 -177.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.271 37.1 tt0 -68.88 -31.49 70.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 174.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.47 -35.91 73.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.812 -1.089 . . . . 0.0 111.527 172.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -75.06 -33.1 61.67 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 116.505 -3.872 . . . . 0.0 112.899 176.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.75 -29.8 75.26 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 117.453 -2.308 . . . . 0.0 116.32 172.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 99.3 m -80.56 -33.27 36.29 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 126.83 2.135 . . . . 0.0 109.278 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -59.65 -30.7 68.92 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 118.366 2.728 . . . . 0.0 118.366 173.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 9.4 t -65.75 -45.63 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 174.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -70.29 -31.61 69.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.108 -1.425 . . . . 0.0 112.988 177.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 68.5 mt -68.03 -39.67 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 123.311 2.778 . . . . 0.0 109.537 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.388 78.5 t -78.38 -41.07 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 128.057 2.543 . . . . 0.0 112.982 -175.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -48.57 -46.88 39.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 123.384 1.564 . . . . 0.0 109.898 167.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -76.73 -35.73 57.6 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 119.435 -2.041 . . . . 0.0 109.705 -171.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 39.5 mt -67.39 -17.38 64.71 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.801 -1.571 . . . . 0.0 111.945 174.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 70.4 mt -94.19 -29.76 14.95 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 114.429 -2.701 . . . . 0.0 114.428 168.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 26.2 ttm105 -72.23 -37.2 69.24 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 130.286 3.434 . . . . 0.0 109.745 173.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.98 18.59 64.73 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 128.52 2.962 . . . . 0.0 117.919 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -115.71 54.18 0.82 Allowed 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 129.93 3.959 . . . . 0.0 115.351 -171.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 6.8 mtt -144.71 146.62 32.3 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 129.52 3.128 . . . . 0.0 111.956 164.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 91.4 p -81.16 175.57 10.53 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 161.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -64.85 -38.58 91.46 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 119.487 -2.008 . . . . 0.0 112.055 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . 0.41 HH21 ' HD2' ' B' ' 69' ' ' ARG . 20.0 ttt85 -56.01 -54.3 46.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 122.373 1.082 . . . . 0.0 113.235 174.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -58.16 -48.86 78.97 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.486 1.915 . . . . 0.0 112.937 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.41 -34.83 77.52 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 118.338 -2.726 . . . . 0.0 116.995 166.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 tptt -66.63 -36.02 81.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 121.627 2.012 . . . . 0.0 110.507 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -102.35 -45.15 5.18 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 120.876 -1.14 . . . . 0.0 108.997 -162.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -87.36 -34.72 18.71 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -171.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 63.7 mt -109.97 -10.93 14.7 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 117.23 2.308 . . . . 0.0 117.23 173.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.04 21.79 70.08 Favored Glycine 0 CA--C 1.526 0.73 0 C-N-CA 126.837 2.161 . . . . 0.0 111.614 177.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -103.74 96.17 6.52 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 122.423 3.111 . . . . 0.0 111.006 -177.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.37 178.61 41.28 Favored Glycine 0 C--N 1.335 0.489 0 O-C-N 126.127 2.142 . . . . 0.0 110.212 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 19.8 mt -42.12 -54.87 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 114.331 -0.935 . . . . 0.0 111.639 174.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.41 -56.0 11.15 Favored 'General case' 0 N--CA 1.451 -0.378 1 N-CA-C 121.856 4.021 . . . . 0.0 121.856 177.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 17.3 m -58.71 -47.17 85.47 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 173.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 40.7 mm -52.81 -45.61 50.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 124.581 1.152 . . . . 0.0 113.279 166.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 3.5 m -61.94 -36.92 82.83 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 123.962 1.839 . . . . 0.0 112.404 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -84.3 -27.96 27.45 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 117.578 -3.201 . . . . 0.0 109.456 -174.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.17 -38.89 28.53 Favored Glycine 0 C--N 1.334 0.434 0 O-C-N 118.435 -2.666 . . . . 0.0 111.694 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 18.8 m -65.03 -49.41 70.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 129.311 3.044 . . . . 0.0 107.658 175.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -52.55 -50.02 63.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 127.558 2.343 . . . . 0.0 111.313 170.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 13.5 m -66.06 -33.45 75.83 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.961 -1.712 . . . . 0.0 114.246 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 13.4 mt -61.45 -42.56 98.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 123.798 0.839 . . . . 0.0 112.861 167.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 39.3 mttm -65.73 -38.31 88.79 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 125.509 1.755 . . . . 0.0 113.551 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.06 -25.41 62.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.954 1.701 . . . . 0.0 111.875 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.38 165.74 6.46 Favored Pre-proline 0 N--CA 1.45 -0.464 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -69.11 162.1 43.12 Favored 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.788 2.326 . . . . 0.0 112.645 168.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 m -74.67 -30.56 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 O-C-N 119.109 -2.245 . . . . 0.0 111.156 171.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -70.85 -20.02 62.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.481 2.312 . . . . 0.0 111.254 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' B' ' 96' ' ' LEU . 13.3 tp -75.88 -56.46 4.65 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 114.538 -2.649 . . . . 0.0 110.1 167.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 92.9 mtm-85 -56.51 -46.67 80.41 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 121.22 1.827 . . . . 0.0 109.893 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -59.25 -30.35 68.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.729 -176.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 80.5 t90 -96.89 -33.09 11.74 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.066 -2.271 . . . . 0.0 112.488 -173.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.55 -33.38 73.75 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 118.664 -1.214 . . . . 0.0 111.798 166.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.7 -32.49 74.08 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 117.284 2.327 . . . . 0.0 117.284 171.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -75.32 -16.59 60.4 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 112.732 -2.031 . . . . 0.0 115.319 169.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 48.7 t -103.26 -41.14 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 O-C-N 117.069 -3.519 . . . . 0.0 115.416 171.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 88.6 mt -85.07 -35.47 21.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 121.903 2.138 . . . . 0.0 115.266 -168.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 33.2 mt -101.62 -10.34 20.14 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 118.828 -2.42 . . . . 0.0 109.543 -171.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -77.88 -7.69 57.06 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.339 1.855 . . . . 0.0 112.308 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . 0.25 14.4 m -89.36 -17.68 28.38 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.67 2.388 . . . . 0.0 116.549 178.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.27 70.4 m-20 . . . . . 0 C--O 1.248 0.986 0 C-N-CA 129.183 2.993 . . . . 0.0 109.129 171.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 62.4 ttp . . . . . 0 N--CA 1.474 0.751 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.92 168.96 11.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 120.491 1.496 . . . . 0.0 107.051 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -133.4 149.53 51.82 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.499 -2.626 . . . . 0.0 109.789 176.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -157.22 138.71 13.9 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 105.834 -1.913 . . . . 0.0 105.834 -177.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 32.6 p -139.91 171.4 7.94 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 130.62 3.568 . . . . 0.0 111.808 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -50.05 -33.42 34.72 Favored 'Trans proline' 0 N--CA 1.446 -1.278 0 N-CA-C 119.477 2.837 . . . . 0.0 119.477 174.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -151.02 148.06 27.89 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 115.851 -2.023 . . . . 0.0 107.109 -161.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 26.0 t -150.55 131.37 14.13 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.06 -23.66 60.59 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 114.653 -2.594 . . . . 0.0 113.269 167.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.85 -35.04 78.64 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 113.026 -3.369 . . . . 0.0 114.426 169.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 53.9 mtt -68.98 -43.23 75.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 127.178 2.799 . . . . 0.0 108.635 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . 0.254 . . -57.2 -37.62 72.48 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 174.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -64.96 -28.31 69.43 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 117.438 -3.289 . . . . 0.0 116.61 170.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -72.84 -44.94 60.81 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 120.373 -1.454 . . . . 0.0 113.401 170.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -36.15 71.76 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 126.144 1.778 . . . . 0.0 111.994 167.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -61.92 -44.89 95.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 120.251 -1.53 . . . . 0.0 111.234 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -75.52 -22.05 57.45 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 177.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -62.39 -45.22 94.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.838 1.255 . . . . 0.0 111.931 167.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 23.6 t-105 -59.5 -52.71 64.41 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 123.459 1.6 . . . . 0.0 114.423 169.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 15.3 mt -69.14 -24.63 64.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.148 -1.387 . . . . 0.0 112.858 -171.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -78.1 -32.35 50.55 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 117.17 -1.395 . . . . 0.0 113.555 165.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -58.9 -58.77 7.16 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 117.75 -1.58 . . . . 0.0 113.576 168.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.56 -46.42 95.03 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-O 122.452 1.12 . . . . 0.0 110.451 -171.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -58.74 -42.71 89.45 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 -177.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 60.9 tp -67.67 -46.51 72.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 131.389 3.876 . . . . 0.0 107.064 172.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.75 -31.46 72.46 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 128.015 3.322 . . . . 0.0 114.819 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . 0.32 27.3 ttpp -65.21 -41.33 94.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 117.621 2.452 . . . . 0.0 117.621 162.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -58.49 -27.57 64.57 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 124.327 3.239 . . . . 0.0 114.557 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.76 -38.01 86.41 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.757 1.623 . . . . 0.0 113.765 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -60.94 -16.75 46.07 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -82.71 -21.33 34.85 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 34.1 p-10 -126.62 8.03 6.95 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.374 2.0 m-20 73.59 23.18 2.47 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 119.862 -1.774 . . . . 0.0 114.006 175.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.61 5.57 31.18 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 122.026 2.194 . . . . 0.0 114.626 171.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -67.85 -43.48 79.37 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.203 -2.811 . . . . 0.0 116.557 -166.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.295 82.5 mt -72.1 -43.35 10.28 Favored Pre-proline 0 N--CA 1.45 -0.435 0 O-C-N 125.245 1.591 . . . . 0.0 114.139 170.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.61 -32.03 95.86 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 CA-C-O 124.57 1.821 . . . . 0.0 113.627 172.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 19.2 tp -72.39 -33.93 67.55 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.358 -2.714 . . . . 0.0 115.837 172.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 40.4 mt -77.33 -28.27 53.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.93 0.892 . . . . 0.0 109.757 173.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -73.46 -31.17 63.63 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 131.015 3.726 . . . . 0.0 109.883 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -72.29 -51.05 22.58 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 128.206 2.603 . . . . 0.0 115.766 168.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 91.7 mmm -85.4 -29.11 24.67 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.147 -1.406 . . . . 0.0 110.632 -164.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 9.1 mp -115.61 153.26 31.57 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 119.308 0.958 . . . . 0.0 110.153 -175.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 11.9 p -75.59 159.04 82.47 Favored Pre-proline 0 N--CA 1.449 -0.477 0 C-N-CA 127.03 2.132 . . . . 0.0 112.514 163.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.61 -24.77 46.79 Favored 'Trans proline' 0 N--CA 1.451 -1.024 1 C-N-CA 126.404 4.736 . . . . 0.0 116.446 173.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.76 -26.85 25.59 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.029 1.332 . . . . 0.0 109.412 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -77.37 -35.24 54.66 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 118.668 0.667 . . . . 0.0 112.558 172.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 86.6 mtm-85 -55.43 -52.17 64.49 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 124.955 1.302 . . . . 0.0 111.615 166.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -69.27 -39.51 78.34 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 115.603 -2.141 . . . . 0.0 110.846 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.39 -46.37 88.88 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.629 2.013 . . . . 0.0 111.454 169.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . 0.265 28.8 mt -63.89 -27.48 69.18 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 120.273 1.397 . . . . 0.0 113.658 -174.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.85 -25.1 42.67 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 117.62 1.808 . . . . 0.0 117.62 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 24.3 m -74.2 -37.56 63.87 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 116.015 -1.945 . . . . 0.0 112.07 166.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -56.78 -38.58 72.71 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 128.973 2.909 . . . . 0.0 114.877 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 69.1 t -59.31 -43.99 91.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 115.806 -2.045 . . . . 0.0 108.997 170.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 48.9 mtp180 -68.11 -34.13 75.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 122.006 2.185 . . . . 0.0 110.487 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . 0.434 HG22 HG13 ' C' ' 82' ' ' ILE . 50.0 mt -72.51 -36.85 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 120.009 -1.682 . . . . 0.0 111.735 176.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 78.4 t -56.83 -47.59 82.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 N-CA-C 118.086 2.625 . . . . 0.0 118.086 160.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -53.91 -48.24 70.35 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 129.113 2.965 . . . . 0.0 115.92 175.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -69.06 -19.37 64.08 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.124 -1.417 . . . . 0.0 111.825 -177.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 95.8 mt -89.0 -30.07 19.01 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.161 -1.876 . . . . 0.0 114.666 177.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 37.8 mt -64.44 -43.86 92.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 119.357 0.981 . . . . 0.0 111.703 165.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -62.74 -51.04 68.71 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 127.405 2.282 . . . . 0.0 113.464 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.36 -5.05 79.27 Favored Glycine 0 C--N 1.338 0.644 0 CA-C-O 115.355 -2.914 . . . . 0.0 112.383 158.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -69.65 -15.16 63.13 Favored 'General case' 0 N--CA 1.447 -0.599 1 N-CA-C 121.879 4.029 . . . . 0.0 121.879 -174.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . 0.263 39.2 mtt -59.44 127.1 30.37 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 129.902 3.281 . . . . 0.0 110.199 173.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 96.4 p -81.47 168.29 18.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 125.517 1.761 . . . . 0.0 109.71 175.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -56.83 -26.28 57.89 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 117.061 -1.447 . . . . 0.0 114.248 174.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 mtp-105 -69.44 -26.21 64.49 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 126.448 1.899 . . . . 0.0 112.553 167.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -99.78 -34.31 10.21 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 128.126 2.57 . . . . 0.0 116.653 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . 0.25 24.7 mt -62.5 -22.51 66.32 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.88 -1.763 . . . . 0.0 109.251 168.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -91.11 -53.74 4.24 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 125.467 1.729 . . . . 0.0 113.689 168.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -104.87 -1.02 26.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 119.39 3.108 . . . . 0.0 119.39 -166.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 23.9 tp10 -122.74 -31.94 3.62 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 128.698 2.799 . . . . 0.0 116.502 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 tp -88.93 -31.39 18.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 121.464 -0.772 . . . . 0.0 112.583 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 93.05 -179.37 39.49 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-O 117.828 -1.54 . . . . 0.0 116.235 172.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.75 -21.13 54.69 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 125.168 2.413 . . . . 0.0 112.308 169.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.67 -15.47 18.76 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-O 124.894 2.386 . . . . 0.0 116.547 171.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 6.0 tt -70.16 -34.38 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 120.276 -1.72 . . . . 0.0 112.451 176.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.89 -27.29 68.04 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 171.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 25.2 m -72.63 -27.75 62.33 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 122.22 2.282 . . . . 0.0 110.414 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . 0.434 HG13 HG22 ' C' ' 57' ' ' ILE 0.317 39.2 mm -97.56 -22.8 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 126.876 2.07 . . . . 0.0 116.173 -173.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 39.4 p -118.39 -3.14 10.98 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 120.833 3.642 . . . . 0.0 120.833 -176.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -126.18 153.06 45.16 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 117.865 -3.022 . . . . 0.0 111.962 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 94.13 167.64 37.33 Favored Glycine 0 C--N 1.335 0.505 0 N-CA-C 117.484 1.754 . . . . 0.0 117.484 -172.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 93.9 p -80.61 2.92 23.7 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 117.854 2.539 . . . . 0.0 117.854 -174.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -117.72 -9.65 10.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.962 -1.971 . . . . 0.0 112.607 171.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 57.5 p -47.77 168.28 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 -173.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 tp -53.78 -38.96 65.01 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 120.714 3.598 . . . . 0.0 120.714 -163.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.256 57.1 mttt -88.51 -12.56 42.56 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 124.808 1.318 . . . . 0.0 114.406 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.13 -10.63 41.2 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 129.789 3.235 . . . . 0.0 112.242 169.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.05 150.59 69.56 Favored Pre-proline 0 N--CA 1.446 -0.648 0 CA-C-O 115.142 -2.361 . . . . 0.0 112.997 172.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -39.06 141.21 0.39 Allowed 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 123.794 2.996 . . . . 0.0 118.45 166.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 2.1 t -59.78 -45.28 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 CA-C-O 113.536 -3.126 . . . . 0.0 110.441 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.6 pm0 -61.12 -16.87 49.01 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 121.145 1.793 . . . . 0.0 115.414 -176.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 14.8 tp -82.64 -41.54 19.32 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 117.017 2.229 . . . . 0.0 117.017 164.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -60.82 -37.17 81.08 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 116.519 -3.863 . . . . 0.0 110.038 176.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -71.23 -35.02 71.32 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.971 1.708 . . . . 0.0 111.68 175.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -75.11 -40.27 59.99 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 31.1 mt -61.35 -36.71 80.95 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.972 1.709 . . . . 0.0 109.744 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.99 -27.92 67.84 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 170.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -79.36 -17.64 54.07 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 122.504 2.411 . . . . 0.0 111.137 174.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 92.8 t -108.93 -28.77 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 O-C-N 117.901 -2.999 . . . . 0.0 114.28 -176.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 65.9 mt -95.79 -45.9 6.8 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.079 0.942 . . . . 0.0 109.696 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 33.1 mt -92.98 16.85 11.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 120.992 -1.068 . . . . 0.0 113.271 -171.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 51.6 pttt . . . . . 0 N--CA 1.447 -0.601 0 O-C-N 118.506 -2.621 . . . . 0.0 116.813 157.169 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 21.0 p . . . . . 0 N--CA 1.447 -0.583 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 99.5 Cg_exo -53.25 -49.91 15.82 Favored 'Trans proline' 0 N--CA 1.449 -1.142 1 C-N-CA 125.651 4.234 . . . . 0.0 115.522 177.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -151.35 126.05 9.61 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.341 1.856 . . . . 0.0 114.547 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 14.5 t -47.12 113.66 0.71 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 166.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.16 -44.83 32.71 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 113.244 -1.798 . . . . 0.0 109.686 171.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.88 -26.47 62.36 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.612 2.078 . . . . 0.0 116.612 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . 0.431 ' O ' ' HD2' ' D' ' 15' ' ' ARG . 17.8 mmt -71.32 -31.22 67.16 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 126.058 2.098 . . . . 0.0 111.244 168.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.42 -21.99 52.23 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 118.374 -2.704 . . . . 0.0 111.064 176.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -79.22 -34.87 42.43 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.817 1.189 . . . . 0.0 109.705 166.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -62.39 -43.3 99.13 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 123.666 1.698 . . . . 0.0 111.325 -177.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . 0.431 ' HD2' ' O ' ' D' ' 11' ' ' MET . 0.0 OUTLIER -64.57 -33.14 75.21 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 118.99 2.959 . . . . 0.0 118.99 169.719 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -72.51 -12.88 61.26 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 119.089 -2.257 . . . . 0.0 113.228 166.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -94.09 -32.54 13.73 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 118.894 2.924 . . . . 0.0 118.894 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -67.62 -26.55 66.3 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 111.248 -2.705 . . . . 0.0 109.019 169.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 8.2 t-105 -74.04 -53.44 10.0 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 123.727 1.727 . . . . 0.0 110.97 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.92 -15.64 44.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 117.926 -2.983 . . . . 0.0 112.764 173.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -75.46 -23.83 56.93 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 120.256 1.389 . . . . 0.0 113.99 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -78.51 -35.05 46.87 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.748 2.019 . . . . 0.0 109.328 174.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 91.9 t -62.2 -47.23 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 O-C-N 124.209 0.943 . . . . 0.0 109.174 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -70.87 -40.11 72.49 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.574 1.15 . . . . 0.0 112.468 174.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 20.7 tp -50.92 -45.11 60.27 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 121.129 1.786 . . . . 0.0 113.255 168.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 56.6 tp -73.87 -38.06 64.55 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 123.445 1.593 . . . . 0.0 115.187 -176.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . 0.46 ' HA ' ' CD2' ' D' ' 30' ' ' TYR . 27.9 ttpt -61.84 -49.29 76.86 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 120.358 -1.464 . . . . 0.0 108.163 169.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -58.84 -22.08 58.17 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.931 -2.981 . . . . 0.0 117.557 171.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . 0.42 ' HA ' ' OD1' ' D' ' 32' ' ' ASN . . . -85.81 -26.43 25.74 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 120.27 -1.519 . . . . 0.0 112.455 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . 0.46 ' CD2' ' HA ' ' D' ' 27' ' ' LYS . 16.7 m-30 -56.69 -45.42 81.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 118.941 -2.35 . . . . 0.0 110.442 166.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -73.16 -25.59 60.86 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.886 2.074 . . . . 0.0 108.069 -163.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . 0.42 ' OD1' ' HA ' ' D' ' 29' ' ' ALA . 43.2 p30 -115.22 5.35 14.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.211 1.804 . . . . 0.0 114.963 174.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 57.61 28.45 15.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 -178.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 15.3 mt -83.59 1.43 42.19 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.234 2.214 . . . . 0.0 112.067 164.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -60.08 3.73 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 118.212 2.671 . . . . 0.0 118.212 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 9.0 mt -57.37 -54.31 56.27 Favored Pre-proline 0 N--CA 1.451 -0.412 0 CA-C-O 114.396 -2.716 . . . . 0.0 109.677 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -43.68 -46.24 10.42 Favored 'Trans proline' 0 N--CA 1.447 -1.238 0 CA-C-N 124.696 2.713 . . . . 0.0 115.393 159.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 22.5 tp -74.44 -39.09 62.8 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 116.379 -3.951 . . . . 0.0 114.744 -176.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' D' ' 39' ' ' LEU . 42.4 mt -59.7 -48.44 81.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.18 -2.2 . . . . 0.0 107.185 166.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 33.0 m-20 -63.43 -31.57 72.76 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 121.393 1.906 . . . . 0.0 114.516 -178.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 31.4 tp -71.15 -41.78 69.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 116.175 -1.869 . . . . 0.0 106.601 172.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 8.0 mmm -83.47 -23.3 32.26 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -170.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 29.5 mt -127.45 141.74 51.59 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 104.69 -2.337 . . . . 0.0 104.69 -173.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 71.7 p -60.22 158.05 29.88 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-O 114.745 -2.55 . . . . 0.0 116.82 171.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -48.15 -50.52 11.82 Favored 'Trans proline' 0 N--CA 1.447 -1.237 1 C-N-CA 126.684 4.923 . . . . 0.0 114.386 170.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -71.82 -17.83 62.13 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 117.738 2.496 . . . . 0.0 117.738 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -73.15 -42.14 63.16 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.412 163.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -61.18 -41.89 97.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 126.815 2.046 . . . . 0.0 108.02 175.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -66.07 -38.75 89.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.528 1.131 . . . . 0.0 110.927 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.59 -33.94 23.27 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.776 2.031 . . . . 0.0 112.911 -177.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 84.0 mt -58.65 -43.54 89.84 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.065 -2.397 . . . . 0.0 116.183 160.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.7 -34.44 70.41 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-N 121.102 1.774 . . . . 0.0 113.691 170.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 17.8 m -77.07 -38.14 53.12 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 122.335 1.064 . . . . 0.0 112.929 -177.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -61.54 -31.17 71.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 112.444 -3.646 . . . . 0.0 110.852 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.71 -49.94 70.95 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 CA-C-N 123.702 2.956 . . . . 0.0 112.515 170.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.307 9.4 ptm180 -65.64 -22.18 66.63 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 118.267 2.691 . . . . 0.0 118.267 169.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 10.2 mt -70.93 -42.49 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 124.194 3.179 . . . . 0.0 112.484 171.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 3.2 t -61.9 -48.12 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 128.163 3.415 . . . . 0.0 111.724 169.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -63.06 -38.82 92.73 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.313 -2.742 . . . . 0.0 108.976 -174.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . 0.425 ' HA ' ' HB3' ' D' ' 63' ' ' ARG . 75.5 mm-40 -75.14 -26.9 59.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 115.679 -2.105 . . . . 0.0 112.305 174.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 63.4 mt -68.73 -23.62 64.36 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 116.734 -1.603 . . . . 0.0 110.389 174.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 29.8 mt -84.09 -38.72 20.43 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 170.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . 0.425 ' HB3' ' HA ' ' D' ' 60' ' ' GLU . 40.1 ttm180 -69.64 -29.32 66.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 127.327 2.892 . . . . 0.0 114.455 175.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.42 36.99 92.5 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-O 115.727 -2.707 . . . . 0.0 113.481 158.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -111.63 -25.17 9.67 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 114.774 -2.536 . . . . 0.0 110.157 173.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . 0.256 33.6 mtm -89.23 30.84 0.93 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 169.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 77.7 p -85.36 172.83 10.77 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 119.47 -2.019 . . . . 0.0 111.022 -163.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.268 5.5 tp60 65.15 -17.64 0.09 Allowed 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 116.598 -3.814 . . . . 0.0 119.305 169.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 35.0 ttt85 -146.96 -59.85 0.28 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 129.995 3.318 . . . . 0.0 116.169 176.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -84.38 -35.86 22.87 Favored 'General case' 0 N--CA 1.446 -0.644 1 O-C-N 115.47 -4.519 . . . . 0.0 114.16 -152.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.72 -41.99 15.96 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 116.369 -3.957 . . . . 0.0 116.05 178.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt -61.14 -38.91 88.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 112.822 -1.99 . . . . 0.0 108.997 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -84.2 -20.56 32.12 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 126.49 2.369 . . . . 0.0 114.233 -176.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -97.3 -38.88 9.49 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 127.963 2.505 . . . . 0.0 110.986 -173.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -120.9 -16.91 8.02 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 85.47 -171.23 45.4 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-O 123.707 1.726 . . . . 0.0 116.746 165.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.254 . . -43.43 -16.69 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.88 -20.47 68.6 Favored Glycine 0 C--N 1.335 0.522 0 CA-C-N 122.585 2.448 . . . . 0.0 112.537 171.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 5.0 tt -46.05 -18.06 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 C-N-CA 126.498 1.919 . . . . 0.0 114.959 168.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -103.99 -21.9 13.54 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 117.866 -1.534 . . . . 0.0 112.65 -178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 17.7 m -66.72 -39.4 87.99 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.375 1.47 . . . . 0.0 109.816 165.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 8.5 mm -87.06 -18.18 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 O-C-N 117.755 -3.09 . . . . 0.0 114.444 -172.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 31.0 p -109.25 -24.89 10.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 120.99 3.7 . . . . 0.0 120.99 168.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.8 mtp85 -83.84 162.42 20.57 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.894 -3.004 . . . . 0.0 110.827 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.31 154.73 30.95 Favored Glycine 0 N--CA 1.446 -0.66 0 O-C-N 127.247 2.842 . . . . 0.0 112.275 -177.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 24.6 m -74.38 -7.2 52.08 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 115.847 -2.025 . . . . 0.0 114.943 -168.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . 0.276 18.2 m-80 -134.36 33.38 3.31 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 123.606 2.912 . . . . 0.0 105.963 -171.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 59.9 p -77.28 -175.5 3.72 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.415 2.746 . . . . 0.0 118.415 175.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 29.7 tp -56.24 -32.12 64.19 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 118.389 -2.695 . . . . 0.0 113.951 165.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -74.46 -16.92 60.84 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.161 0.584 . . . . 0.0 110.569 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -104.49 -15.24 15.42 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 113.634 -3.079 . . . . 0.0 113.372 -166.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . 0.478 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 45.07 87.19 0.12 Allowed Pre-proline 0 N--CA 1.449 -0.513 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 165.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . 0.478 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 50.7 Cg_exo 34.19 42.24 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.168 0 C-N-CA 122.447 -1.897 . . . . 0.0 115.861 36.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . 0.45 HG22 ' HB1' ' D' ' 92' ' ' ALA . 0.2 OUTLIER -72.73 15.19 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 111.062 -2.79 . . . . 0.0 110.743 -170.68 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . 0.442 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -144.25 -30.0 0.48 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -169.066 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 58.8 tp -50.82 -55.38 17.15 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.663 157.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . 0.31 24.2 ptt180 -59.3 -37.19 77.09 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 112.685 -3.531 . . . . 0.0 112.512 -176.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -71.16 -23.52 62.08 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.455 2.302 . . . . 0.0 110.72 176.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . 0.255 79.3 t90 -87.28 -42.48 12.89 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.709 1.204 . . . . 0.0 111.398 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 51.6 mt -59.76 -55.02 39.49 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 129.454 3.102 . . . . 0.0 106.432 169.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -44.47 -31.36 1.07 Allowed 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 173.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -89.49 -29.34 19.04 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 69.5 t -91.15 -22.83 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 O-C-N 121.316 -0.865 . . . . 0.0 110.729 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 65.9 mt -102.84 -27.67 12.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 119.915 -1.741 . . . . 0.0 112.308 -172.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 28.5 mt -101.78 12.01 37.78 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -62.2 152.16 34.03 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 127.478 2.986 . . . . 0.0 109.77 -171.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 47.8 m -66.38 -27.3 67.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 117.751 2.5 . . . . 0.0 117.751 -168.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . 0.255 0.6 OUTLIER . . . . . 0 C--O 1.25 1.099 0 O-C-N 126.899 2.625 . . . . 0.0 116.256 169.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.4 ttp . . . . . 0 N--CA 1.454 -0.262 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.87 -25.5 60.07 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 124.617 2.151 . . . . 0.0 116.691 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -64.91 -30.41 71.4 Favored 'General case' 0 N--CA 1.445 -0.698 0 O-C-N 120.07 -1.644 . . . . 0.0 113.337 165.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -80.65 -38.69 28.68 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 118.563 -1.255 . . . . 0.0 108.232 -170.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.7 mmt-85 -62.11 -25.03 67.48 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 125.8 1.938 . . . . 0.0 114.839 176.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.0 t60 -61.52 -46.64 89.12 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 117.836 2.532 . . . . 0.0 117.836 171.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -68.93 -26.09 64.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 171.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -72.13 -48.79 41.09 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.462 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG . 20.2 t-105 -60.91 -45.59 94.03 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.31 1.844 . . . . 0.0 112.22 172.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.52 -18.94 62.95 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 177.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -69.45 -29.09 66.7 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 119.003 0.819 . . . . 0.0 110.205 170.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -62.1 -46.28 89.79 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 120.315 -1.491 . . . . 0.0 112.092 165.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.8 t -84.46 -0.21 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 115.6 1.704 . . . . 0.0 115.6 -170.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -96.52 -39.07 9.73 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 113.894 -1.503 . . . . 0.0 109.485 164.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 66.0 tp -60.68 -34.52 74.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 127.121 2.168 . . . . 0.0 108.382 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.6 tp -85.18 -22.87 28.58 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 126.8 2.563 . . . . 0.0 109.741 -169.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -79.62 -31.53 41.68 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 121.399 -0.813 . . . . 0.0 112.013 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . 0.256 25.9 m-20 -82.17 -22.27 36.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 118.683 -2.511 . . . . 0.0 111.153 175.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.76 -43.54 92.94 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 169.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -55.47 -46.51 76.84 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 123.684 1.707 . . . . 0.0 111.391 172.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -66.31 -24.86 66.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.562 1.945 . . . . 0.0 112.806 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -104.96 11.13 33.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 113.855 -2.974 . . . . 0.0 114.209 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.417 1.8 m-20 61.03 22.38 12.64 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 125.64 1.838 . . . . 0.0 112.144 174.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.3 mt -109.88 4.15 21.32 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.365 1.866 . . . . 0.0 112.837 177.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -49.53 -43.55 45.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 -179.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 36' ' ' LEU 0.391 80.1 mt -58.13 -60.49 9.95 Favored Pre-proline 0 N--CA 1.45 -0.46 0 N-CA-C 116.314 1.968 . . . . 0.0 116.314 172.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . 0.269 27.2 Cg_endo -60.21 -39.97 63.75 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 117.225 -1.383 . . . . 0.0 112.704 -176.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 tp -55.29 -40.33 70.92 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.488 -2.633 . . . . 0.0 115.846 172.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 85.5 mt -75.12 -35.13 61.74 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.766 0.826 . . . . 0.0 109.036 178.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -62.74 -40.5 97.42 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 123.521 0.513 . . . . 0.0 111.052 176.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.9 tp -68.25 -30.39 69.41 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 115.674 -2.108 . . . . 0.0 114.088 174.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 85.3 mmm -97.64 -22.15 16.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 123.494 2.861 . . . . 0.0 112.372 -168.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mp -134.13 150.13 51.11 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 126.091 1.757 . . . . 0.0 109.661 -176.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.445 ' HB ' ' HD2' ' A' ' 45' ' ' PRO . 64.3 p -81.57 163.34 54.69 Favored Pre-proline 0 N--CA 1.451 -0.401 0 C-N-CA 126.704 2.002 . . . . 0.0 111.724 173.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.445 ' HD2' ' HB ' ' A' ' 44' ' ' THR . 24.7 Cg_endo -64.15 -32.45 63.31 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 CA-C-N 119.509 0.86 . . . . 0.0 111.998 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.19 -35.32 77.81 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 115.645 -2.121 . . . . 0.0 110.432 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.21 -24.07 60.47 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 122.955 2.616 . . . . 0.0 114.18 174.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.0 mtm-85 -84.98 -35.31 22.07 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 126.014 2.071 . . . . 0.0 115.204 171.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.3 -39.14 82.08 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.404 1.882 . . . . 0.0 110.316 170.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.47 83.86 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 130.565 3.546 . . . . 0.0 113.486 174.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.2 mt -72.33 -36.47 68.85 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 118.017 -2.927 . . . . 0.0 107.143 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.03 -51.39 54.14 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 174.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.25 8.8 m -62.99 -30.82 71.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 128.889 2.876 . . . . 0.0 113.143 175.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.7 mtt180 -80.88 -32.79 34.75 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 117.715 -1.594 . . . . 0.0 108.373 -168.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.447 ' HA ' ' HE1' ' B' ' 42' ' ' MET . 83.8 t -45.43 -46.4 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-O 115.16 -2.353 . . . . 0.0 114.738 154.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -79.51 -27.98 41.41 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.448 2.386 . . . . 0.0 108.657 -169.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.6 mt -63.53 -55.21 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 C-N-CA 125.27 1.428 . . . . 0.0 110.49 166.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.1 t -61.72 -35.16 65.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 117.019 -1.872 . . . . 0.0 113.514 -173.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . 0.256 28.8 tt0 -46.6 -60.09 2.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 118.137 -2.852 . . . . 0.0 113.136 166.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -58.82 -29.33 66.8 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 175.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 42.3 mt -76.09 -28.75 57.68 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 118.701 -1.2 . . . . 0.0 112.427 173.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.3 mt -74.28 -31.32 62.47 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 119.117 -2.239 . . . . 0.0 113.196 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 43.3 ttm105 -71.95 -41.48 67.73 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 129.805 3.242 . . . . 0.0 112.918 173.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.54 35.15 21.56 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 120.065 2.786 . . . . 0.0 120.065 -174.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -98.2 -37.43 9.7 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 119.863 1.831 . . . . 0.0 113.096 168.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 42.5 mtt -75.28 127.19 32.6 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 118.939 -1.105 . . . . 0.0 109.568 -177.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 54.0 p -47.94 165.75 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 127.227 2.211 . . . . 0.0 114.59 151.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -68.58 -33.65 74.43 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 127.407 2.283 . . . . 0.0 109.63 170.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.3 tpt85 -55.3 -54.35 44.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.248 1.019 . . . . 0.0 111.247 168.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -58.49 -48.58 80.34 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 175.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.5 mt -54.53 -29.09 49.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 115.463 1.653 . . . . 0.0 115.463 171.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -77.52 -50.03 13.48 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 118.305 -2.747 . . . . 0.0 109.084 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -64.18 -41.82 96.94 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 119.606 3.187 . . . . 0.0 119.606 172.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -81.06 -42.24 21.34 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 125.539 2.59 . . . . 0.0 114.072 -171.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.8 mt -120.9 -5.41 9.6 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 117.984 -2.948 . . . . 0.0 114.12 -172.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 82.32 -12.18 46.5 Favored Glycine 0 CA--C 1.523 0.577 0 O-C-N 116.664 -3.772 . . . . 0.0 115.686 175.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.45 ' HB1' HG12 ' A' ' 82' ' ' ILE . . . -71.55 120.69 17.49 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 125.498 1.352 . . . . 0.0 111.242 -174.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.8 -172.26 41.33 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-N 113.407 -1.724 . . . . 0.0 115.815 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.7 mt -55.37 -46.86 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-O 114.395 -2.717 . . . . 0.0 110.427 165.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.12 86.7 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 122.091 2.223 . . . . 0.0 115.228 -171.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 62.5 p -94.19 -25.57 17.03 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 124.003 1.859 . . . . 0.0 115.957 -174.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.45 HG12 ' HB1' ' A' ' 77' ' ' ALA . 31.1 mm -74.28 -34.2 36.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 O-C-N 118.446 -2.659 . . . . 0.0 107.717 171.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.1 m -62.39 -52.78 62.21 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 121.889 2.132 . . . . 0.0 109.071 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.6 ttt180 -63.17 -57.92 8.94 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 117.706 -1.14 . . . . 0.0 109.688 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.09 -31.42 4.38 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-O 123.19 1.439 . . . . 0.0 116.244 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.2 m -69.33 -50.79 43.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 119.998 -1.883 . . . . 0.0 111.108 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -56.82 -39.6 74.47 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 119.927 -1.733 . . . . 0.0 114.378 175.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.4 m -72.17 -41.32 67.17 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 115.018 -2.42 . . . . 0.0 112.263 176.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.7 tt -67.21 -40.91 86.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 122.844 2.566 . . . . 0.0 114.374 173.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -67.6 -23.3 65.36 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 118.121 2.637 . . . . 0.0 118.121 177.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.47 -13.66 25.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.848 1.659 . . . . 0.0 113.467 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.97 154.25 92.77 Favored Pre-proline 0 N--CA 1.452 -0.348 0 O-C-N 118.941 -2.349 . . . . 0.0 111.223 -177.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -64.99 141.52 70.9 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 125.008 3.805 . . . . 0.0 113.36 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.8 m -54.4 -32.04 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 O-C-N 126.877 2.611 . . . . 0.0 113.687 -177.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.5 pm0 -75.53 -22.91 56.69 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.559 -1.655 . . . . 0.0 113.739 -177.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 20.1 tp -76.76 -42.15 42.05 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 119.033 -2.292 . . . . 0.0 106.475 174.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . 0.331 22.9 mtm180 -67.76 -54.94 15.22 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 123.714 1.721 . . . . 0.0 114.415 -164.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -59.29 -13.96 9.7 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 129.983 3.313 . . . . 0.0 115.026 169.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 37.4 t90 -96.47 -28.49 14.4 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 115.092 -2.385 . . . . 0.0 109.675 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 84.9 mt -77.99 -35.79 49.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 123.834 3.015 . . . . 0.0 113.916 173.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.08 -30.5 71.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 116.551 -2.059 . . . . 0.0 115.305 170.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -65.79 -55.02 19.39 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 118.282 2.697 . . . . 0.0 118.282 162.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 84.9 t -80.83 -26.74 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 O-C-N 120.477 -1.389 . . . . 0.0 110.203 -167.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.9 mt -96.59 -32.53 12.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -175.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 44.2 mt -98.59 -11.27 22.31 Favored 'General case' 0 N--CA 1.446 -0.658 0 O-C-N 117.785 -3.072 . . . . 0.0 114.36 -171.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt . . . . . 0 N--CA 1.449 -0.521 0 O-C-N 124.089 0.868 . . . . 0.0 112.182 -176.017 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.643 0 N-CA-C 110.771 -0.085 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 12.3 ttm -70.86 -32.79 69.92 Favored 'General case' 0 N--CA 1.45 -0.448 1 O-C-N 116.047 -4.158 . . . . 0.0 108.654 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.56 -37.99 80.39 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.738 1.732 . . . . 0.0 111.825 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -61.76 -53.37 56.91 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.247 -2.158 . . . . 0.0 109.45 175.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -55.56 -20.37 13.11 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 117.497 2.406 . . . . 0.0 117.497 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 14.1 mmm180 -84.38 -33.51 23.79 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 170.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -66.35 -34.07 77.15 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 115.439 -2.22 . . . . 0.0 112.764 166.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -79.59 -27.52 41.1 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 115.808 -2.044 . . . . 0.0 109.838 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -65.29 -30.29 71.14 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 120.929 1.695 . . . . 0.0 114.96 164.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 18.6 t-105 -74.84 -45.68 41.6 Favored 'General case' 0 N--CA 1.445 -0.685 1 O-C-N 114.806 -4.934 . . . . 0.0 112.903 173.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 8.9 mt -60.72 -23.36 64.85 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 113.15 -3.309 . . . . 0.0 114.038 166.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 53.6 ttt180 -72.31 -34.37 68.07 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 125.325 3.693 . . . . 0.0 111.55 173.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -55.82 -50.69 69.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 119.649 1.113 . . . . 0.0 112.416 167.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 87.3 t -74.08 -33.58 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 O-C-N 127.159 2.787 . . . . 0.0 108.874 -171.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.82 -45.76 93.18 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 119.878 -1.764 . . . . 0.0 115.384 167.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 23.0 tp -62.75 -46.75 86.59 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.14 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 59.7 tp -69.32 -25.7 64.35 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 118.353 -2.717 . . . . 0.0 117.178 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -59.02 -61.28 2.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 118.265 -2.772 . . . . 0.0 110.011 162.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -60.32 -29.52 68.92 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.179 -3.451 . . . . 0.0 111.82 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.67 -32.28 69.49 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 130.766 3.626 . . . . 0.0 115.034 175.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -66.05 -52.46 48.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.962 1.305 . . . . 0.0 110.653 172.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -50.57 -43.38 56.35 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 115.94 -1.981 . . . . 0.0 115.511 167.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -91.18 3.68 54.2 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 130.27 3.428 . . . . 0.0 108.775 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.365 6.1 m-20 62.57 21.06 12.42 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 118.922 2.934 . . . . 0.0 118.922 -177.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -104.11 12.68 33.67 Favored 'General case' 0 N--CA 1.446 -0.636 1 O-C-N 114.46 -5.15 . . . . 0.0 114.651 -175.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 11.5 p-80 -57.86 -49.13 77.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 128.001 2.52 . . . . 0.0 116.151 -170.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 15.6 mt -66.21 -39.44 28.09 Favored Pre-proline 0 N--CA 1.449 -0.494 0 C-N-CA 126.881 2.072 . . . . 0.0 116.418 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.301 26.5 Cg_exo -59.03 -45.34 28.72 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 N-CA-C 115.193 1.19 . . . . 0.0 115.193 164.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 29.5 tp -56.62 -54.09 50.1 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 119.963 -1.711 . . . . 0.0 112.166 176.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 63.1 mt -54.58 -34.76 62.46 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 119.524 -1.985 . . . . 0.0 113.537 170.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -71.27 -29.44 65.08 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 117.796 -1.097 . . . . 0.0 110.685 173.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . 0.408 16.1 tp -75.04 -43.42 53.59 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 116.238 -1.839 . . . . 0.0 114.544 174.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . 0.447 ' HE1' ' HA ' ' A' ' 55' ' ' VAL . 19.5 mmt -94.84 -20.92 19.04 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 125.283 1.614 . . . . 0.0 112.272 -168.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -114.28 133.93 55.3 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 121.077 1.762 . . . . 0.0 111.122 173.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 73.2 p -72.98 152.95 90.93 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 122.038 2.199 . . . . 0.0 110.971 170.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 99.4 Cg_exo -28.3 -54.87 0.14 Allowed 'Trans proline' 0 N--CA 1.449 -1.105 1 C-N-CA 126.325 4.683 . . . . 0.0 112.559 166.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -62.3 -43.02 99.79 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 127.627 3.08 . . . . 0.0 115.847 -175.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -64.19 -39.23 93.56 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 119.611 3.189 . . . . 0.0 119.611 166.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . 0.462 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 37.8 mtm-85 -61.42 -40.34 94.05 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 115.006 -2.426 . . . . 0.0 107.209 169.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -66.5 -31.36 72.05 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 124.25 3.205 . . . . 0.0 113.151 175.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.2 -47.55 82.12 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 118.38 -2.7 . . . . 0.0 114.323 168.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.12 -37.57 83.28 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 120.007 3.336 . . . . 0.0 120.007 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.09 -18.76 76.72 Favored Glycine 0 C--N 1.34 0.767 0 C-N-CA 117.705 -2.188 . . . . 0.0 112.009 176.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -85.06 -36.31 21.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 119.243 -2.328 . . . . 0.0 109.82 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 85.9 mtt180 -60.3 -25.9 66.11 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.327 1.451 . . . . 0.0 114.216 171.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . 0.319 16.6 t -59.37 -56.96 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 C-N-CA 126.085 1.754 . . . . 0.0 111.025 164.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -72.25 -32.49 66.73 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 120.369 1.44 . . . . 0.0 112.422 -176.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 9.1 mt -59.6 -56.14 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 121.221 1.828 . . . . 0.0 113.214 162.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.261 29.6 t -66.7 -36.24 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 O-C-N 117.818 -3.051 . . . . 0.0 112.759 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -45.19 -59.49 2.61 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 128.972 2.909 . . . . 0.0 112.248 159.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -69.2 -21.07 63.98 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 119.024 -2.297 . . . . 0.0 114.852 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 12.2 mt -67.03 -19.03 65.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 116.705 -3.747 . . . . 0.0 110.468 167.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mt -96.02 -40.56 9.2 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 122.694 2.497 . . . . 0.0 109.874 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 27.6 ttm180 -58.79 -59.24 5.75 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 125.006 1.441 . . . . 0.0 113.25 174.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.49 48.48 23.4 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 115.983 -3.008 . . . . 0.0 115.347 -179.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -126.49 -27.71 3.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 126.568 1.981 . . . . 0.0 114.371 -178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 16.9 mtt -62.77 141.52 58.56 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 115.44 1.645 . . . . 0.0 115.44 177.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.7 p -72.65 157.97 36.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 162.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -64.29 -16.12 61.54 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 115.719 -2.086 . . . . 0.0 113.894 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -67.3 -48.48 67.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.708 1.203 . . . . 0.0 113.788 166.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -67.43 -34.06 76.44 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 128.506 2.723 . . . . 0.0 110.314 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.541 HD22 HD11 ' B' ' 82' ' ' ILE 0.252 79.4 mt -61.07 -55.14 36.07 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 123.501 1.62 . . . . 0.0 112.194 175.517 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -63.73 -44.79 92.52 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 119.844 -1.785 . . . . 0.0 110.56 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -97.23 -24.65 15.6 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 116.356 -1.783 . . . . 0.0 113.402 -160.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -117.1 -35.39 4.09 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 116.826 -1.95 . . . . 0.0 112.373 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 45.0 mt -92.43 -7.3 47.97 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 129.018 2.927 . . . . 0.0 115.38 177.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 55.31 41.17 78.85 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-O 118.893 -0.948 . . . . 0.0 115.156 -176.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.28 101.37 7.93 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 117.003 -1.475 . . . . 0.0 111.599 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.8 171.28 30.99 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 119.966 2.746 . . . . 0.0 119.966 161.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . 0.251 55.0 mt -40.9 -41.33 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 175.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . 0.334 . . -58.73 -37.87 77.12 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.639 1.175 . . . . 0.0 113.136 176.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.2 m -79.76 -35.01 39.32 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 120.785 -1.197 . . . . 0.0 113.161 178.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . 0.541 HD11 HD22 ' B' ' 71' ' ' LEU . 16.3 mm -70.76 -39.66 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-O 118.011 -0.995 . . . . 0.0 109.943 174.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 93.1 m -59.68 -59.18 5.85 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.715 2.406 . . . . 0.0 112.41 171.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -70.91 -33.53 70.63 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -173.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.25 -34.52 85.92 Favored Glycine 0 CA--C 1.524 0.649 0 O-C-N 116.68 -3.762 . . . . 0.0 115.116 169.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 75.1 m -76.16 -34.39 59.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -67.52 -27.58 67.1 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 119.478 -2.014 . . . . 0.0 112.135 172.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 22.4 m -76.64 -32.91 58.3 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 126.842 2.057 . . . . 0.0 113.593 176.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.4 mt -65.4 -48.62 72.23 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 116.54 -1.695 . . . . 0.0 112.991 168.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -71.27 -25.98 62.69 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 126.987 2.68 . . . . 0.0 112.874 -178.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . 0.367 . . -84.47 4.62 30.88 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 116.943 -3.598 . . . . 0.0 114.969 170.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.53 167.47 29.88 Favored Pre-proline 0 N--CA 1.448 -0.555 0 CA-C-N 119.595 1.089 . . . . 0.0 113.77 166.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -74.21 155.54 46.79 Favored 'Trans proline' 0 N--CA 1.448 -1.191 0 N-CA-C 117.068 1.911 . . . . 0.0 117.068 169.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 m -61.58 -39.55 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 115.918 -1.991 . . . . 0.0 115.15 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 12.3 pm0 -66.78 -25.33 66.42 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 126.27 2.231 . . . . 0.0 110.636 173.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.5 tp -73.51 -39.76 64.57 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.408 -3.308 . . . . 0.0 111.458 174.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 89.5 mtm-85 -68.12 -33.2 74.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 114.029 -2.891 . . . . 0.0 115.163 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -66.05 -30.25 70.75 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 128.371 3.544 . . . . 0.0 105.593 168.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -84.69 -45.74 12.16 Favored 'General case' 0 N--CA 1.45 -0.465 1 O-C-N 115.882 -4.262 . . . . 0.0 105.63 -169.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 22.4 mt -70.8 -35.82 72.7 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 124.96 1.412 . . . . 0.0 114.661 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -61.85 -17.65 57.18 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 170.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -102.92 -19.77 14.5 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 177.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 92.6 t -95.02 -38.91 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 CA-C-O 124.115 1.912 . . . . 0.0 112.754 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 6.6 mt -86.74 -68.33 0.75 Allowed 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 117.768 -3.083 . . . . 0.0 111.13 -174.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 79.9 mt -64.01 -33.61 76.14 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 126.888 3.233 . . . . 0.0 113.459 -165.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -55.17 -17.23 3.96 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.11 2.964 . . . . 0.0 114.175 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 3.4 m -71.47 -20.75 62.04 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 170.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.695 2.798 . . . . 0.0 113.266 171.105 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.47 0.539 0 N-CA-C 104.908 -2.256 . . . . 0.0 104.908 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -51.26 134.65 27.46 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 124.783 2.23 . . . . 0.0 114.751 -175.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -109.11 148.72 30.4 Favored 'General case' 0 N--CA 1.445 -0.724 1 N-CA-C 121.97 4.063 . . . . 0.0 121.97 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -165.13 152.53 11.01 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 121.166 1.803 . . . . 0.0 109.062 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 12.6 p -152.71 162.67 25.83 Favored Pre-proline 0 N--CA 1.448 -0.55 0 C-N-CA 128.176 2.59 . . . . 0.0 108.896 164.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -47.73 -25.25 5.55 Favored 'Trans proline' 0 N--CA 1.449 -1.091 1 N-CA-C 124.069 4.603 . . . . 0.0 124.069 -158.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -142.81 160.72 39.79 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.288 178.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 13.6 t -157.32 125.94 5.7 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 127.095 2.158 . . . . 0.0 110.297 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.39 -27.73 59.2 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 119.412 -2.055 . . . . 0.0 112.697 175.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.15 -36.54 83.39 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 -170.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 34.0 mtt -77.82 -31.25 51.56 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 117.534 -3.229 . . . . 0.0 115.539 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.76 95.16 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.811 1.244 . . . . 0.0 112.248 174.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 tp10 -72.54 -29.46 63.59 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 126.648 2.468 . . . . 0.0 111.54 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . 0.301 50.9 tt0 -72.26 -36.01 68.92 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.652 0.739 . . . . 0.0 111.991 164.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -31.53 71.74 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 118.061 -2.9 . . . . 0.0 114.88 177.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -64.58 -51.43 62.76 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.417 2.287 . . . . 0.0 112.869 170.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.376 80.8 mm-40 -55.97 -42.53 76.43 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 114.877 -2.487 . . . . 0.0 112.621 170.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 68.2 mt-10 -66.74 -52.47 44.0 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 125.777 1.923 . . . . 0.0 112.44 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -55.93 -37.75 69.38 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 170.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.66 -29.64 68.98 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 117.849 -3.032 . . . . 0.0 115.165 167.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 37.5 ttt-85 -71.74 -27.26 62.87 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 127.126 2.766 . . . . 0.0 109.548 170.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -66.62 -54.13 26.71 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.894 -2.379 . . . . 0.0 111.397 171.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 88.7 t -57.7 -39.64 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 123.618 1.675 . . . . 0.0 112.429 -174.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -61.13 -58.5 8.11 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.712 2.005 . . . . 0.0 108.215 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 58.8 tp -50.78 -39.37 52.36 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 129.768 3.227 . . . . 0.0 112.321 175.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . 0.476 HD11 HD21 ' C' ' 39' ' ' LEU . 46.6 tp -68.03 -50.04 57.77 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.726 2.41 . . . . 0.0 105.602 179.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -70.95 -29.39 65.4 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 120.23 -1.544 . . . . 0.0 114.868 -175.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -63.49 -32.09 73.44 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.848 -1.549 . . . . 0.0 113.85 166.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.99 -23.35 60.63 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.78 1.632 . . . . 0.0 112.852 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -69.88 -11.21 60.7 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 116.699 -3.75 . . . . 0.0 117.205 171.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -87.54 -25.61 23.56 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 128.955 2.902 . . . . 0.0 111.812 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -124.74 17.71 8.71 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 124.144 3.156 . . . . 0.0 111.44 -178.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 61.23 31.18 19.5 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 116.135 -1.888 . . . . 0.0 114.629 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 mt -103.36 13.99 32.48 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 175.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -78.39 -26.82 46.64 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 -170.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.4 83.8 mt -69.42 -48.11 25.63 Favored Pre-proline 0 N--CA 1.448 -0.553 0 O-C-N 126.691 2.494 . . . . 0.0 114.772 168.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -55.51 -38.96 93.55 Favored 'Trans proline' 0 N--CA 1.447 -1.261 1 C-N-CA 127.576 5.518 . . . . 0.0 111.995 171.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 40.2 tp -77.35 -37.64 51.92 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 119.524 -1.985 . . . . 0.0 112.323 -176.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . 0.476 HD21 HD11 ' C' ' 26' ' ' LEU . 34.2 mt -74.42 -31.29 62.26 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 122.19 2.268 . . . . 0.0 107.344 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -70.16 -35.6 74.13 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 167.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 30.5 tp -63.52 -43.72 96.34 Favored 'General case' 0 N--CA 1.448 -0.543 1 O-C-N 115.969 -4.207 . . . . 0.0 111.136 170.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 12.9 mmt -74.01 -49.93 22.12 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.931 2.892 . . . . 0.0 116.374 -174.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.7 mp -106.5 130.0 54.36 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 129.948 3.299 . . . . 0.0 112.276 -176.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 71.0 p -56.35 153.45 19.65 Favored Pre-proline 0 N--CA 1.448 -0.555 0 O-C-N 127.241 2.838 . . . . 0.0 117.867 157.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . 0.271 13.5 Cg_exo -49.92 -39.96 49.18 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 C-N-CA 115.803 -2.331 . . . . 0.0 115.418 171.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.95 -31.6 71.15 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.706 1.602 . . . . 0.0 114.979 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -77.42 -30.94 53.73 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 113.666 -3.064 . . . . 0.0 111.429 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 46.4 mtm-85 -81.33 -27.68 34.85 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 126.478 2.361 . . . . 0.0 111.859 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -68.63 -43.38 76.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 119.261 -2.15 . . . . 0.0 113.199 163.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.29 86.5 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 116.845 -1.55 . . . . 0.0 112.5 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 19.4 mt -78.37 -25.66 46.36 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 117.876 2.547 . . . . 0.0 117.876 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.18 -35.72 70.74 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 119.07 -1.538 . . . . 0.0 114.157 169.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 7.0 m -54.55 -49.09 71.15 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 118.528 -2.748 . . . . 0.0 114.966 163.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -58.14 -24.14 57.76 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 126.014 2.071 . . . . 0.0 113.322 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 40.6 t -71.72 -37.27 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 115.541 -2.171 . . . . 0.0 110.003 170.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -73.29 -16.38 61.38 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 122.49 2.404 . . . . 0.0 113.429 174.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 11.6 mt -73.62 -35.27 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 121.271 -0.893 . . . . 0.0 111.354 170.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 47.6 t -70.78 -43.86 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 O-C-N 120.728 -1.233 . . . . 0.0 109.865 170.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.05 -42.22 98.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 117.671 -3.143 . . . . 0.0 115.852 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -68.71 -25.65 64.87 Favored 'General case' 0 N--CA 1.449 -0.508 1 O-C-N 115.741 -4.349 . . . . 0.0 113.822 174.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 86.7 mt -87.91 8.95 23.83 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 116.843 -3.661 . . . . 0.0 112.525 172.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 62.5 mt -112.99 -20.25 11.61 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 120.152 1.342 . . . . 0.0 111.935 162.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 39.0 ttm105 -78.15 -38.08 44.46 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 127.836 2.455 . . . . 0.0 112.978 171.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.58 25.71 67.52 Favored Glycine 0 CA--C 1.524 0.653 0 CA-C-O 126.22 3.122 . . . . 0.0 115.449 161.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -92.83 -33.9 14.07 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 112.306 -1.947 . . . . 0.0 113.989 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 53.9 mtt -62.87 142.74 58.14 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 127.356 2.91 . . . . 0.0 112.007 178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 61.0 p -71.54 159.31 34.69 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.91 1.284 . . . . 0.0 113.15 160.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -59.8 -28.47 67.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 166.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . 0.254 23.6 ttp-105 -53.13 -49.18 67.08 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 127.772 2.429 . . . . 0.0 113.366 162.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -68.39 -59.38 3.22 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.108 1.763 . . . . 0.0 111.13 170.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mt -44.23 -38.85 4.04 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.991 -2.943 . . . . 0.0 116.481 176.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -53.15 -43.45 67.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 126.761 2.024 . . . . 0.0 115.374 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -112.21 -41.98 3.82 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 120.637 1.562 . . . . 0.0 112.479 -171.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -90.54 -33.1 16.05 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 120.176 -1.578 . . . . 0.0 109.157 -166.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 6.2 tp -84.24 -21.88 31.0 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 119.447 -2.033 . . . . 0.0 114.778 168.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.95 -174.77 28.8 Favored Glycine 0 C--N 1.335 0.508 0 N-CA-C 121.393 3.317 . . . . 0.0 121.393 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.21 68.26 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 111.895 -2.153 . . . . 0.0 115.87 -168.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.58 -13.17 2.77 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 121.191 3.236 . . . . 0.0 121.191 169.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 9.3 tt -60.22 -20.57 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.82 -27.78 58.04 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 120.532 -1.355 . . . . 0.0 111.356 -179.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . 0.64 HG23 HG23 ' D' ' 44' ' ' THR . 93.2 m -64.83 -29.88 70.86 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 127.103 2.161 . . . . 0.0 110.2 172.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 7.5 mm -96.38 -31.17 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 115.835 -2.031 . . . . 0.0 110.98 -174.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 29.7 p -117.57 -0.86 11.78 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 125.425 1.703 . . . . 0.0 113.597 -163.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -124.06 148.94 46.68 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 120.998 -1.064 . . . . 0.0 113.007 172.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 98.79 169.74 31.18 Favored Glycine 0 C--N 1.338 0.639 0 CA-C-O 123.713 1.73 . . . . 0.0 112.19 -171.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 92.7 p -66.63 -34.52 78.06 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -177.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -89.34 10.69 21.48 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 115.195 -2.336 . . . . 0.0 112.022 -176.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 60.4 p -79.3 169.8 17.57 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 126.443 2.339 . . . . 0.0 114.542 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 21.0 tp -51.25 -42.76 61.25 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 116.822 -3.673 . . . . 0.0 113.922 -165.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -97.18 24.17 6.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 124.016 3.098 . . . . 0.0 111.791 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -141.43 -19.99 0.77 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 115.648 -2.12 . . . . 0.0 112.304 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.04 150.87 1.26 Allowed Pre-proline 0 N--CA 1.449 -0.495 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 164.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.54 156.1 62.71 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 CA-C-N 121.886 1.709 . . . . 0.0 113.475 -174.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 70.6 t -77.22 -27.5 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-O 112.757 -3.496 . . . . 0.0 108.338 -161.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -68.79 -29.32 67.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 124.849 3.477 . . . . 0.0 113.509 173.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 18.3 tp -78.75 -45.7 20.53 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 120.472 1.487 . . . . 0.0 108.547 176.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -50.38 -39.31 46.43 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 170.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -74.24 -35.88 63.87 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.235 -1.364 . . . . 0.0 108.347 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 36.2 t90 -81.55 -22.3 37.93 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 118.334 2.716 . . . . 0.0 118.334 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.15 -32.26 70.16 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.971 -0.456 . . . . 0.0 111.709 171.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.98 -35.18 80.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 115.0 1.482 . . . . 0.0 115.0 171.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -83.3 -29.29 28.47 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 118.512 -2.617 . . . . 0.0 115.258 -173.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 t -85.46 -41.24 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 171.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 7.0 mt -88.38 -5.02 58.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 121.771 3.989 . . . . 0.0 121.771 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . 0.286 99.3 mt -129.56 50.6 2.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 125.972 2.045 . . . . 0.0 112.11 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 16.8 pttt . . . . . 0 N--CA 1.448 -0.559 0 O-C-N 117.925 -2.984 . . . . 0.0 113.07 -166.887 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 3.4 p . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 118.235 -0.888 . . . . 0.0 108.991 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.64 -52.3 2.51 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-N 123.763 2.38 . . . . 0.0 110.808 177.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -141.73 128.87 20.91 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 128.905 2.882 . . . . 0.0 113.295 167.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.6 t -61.21 137.41 58.24 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 118.682 2.845 . . . . 0.0 118.682 -175.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.61 -35.49 72.54 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 131.047 3.739 . . . . 0.0 110.272 170.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.56 -14.23 59.71 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.494 -2.629 . . . . 0.0 112.21 175.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 11.3 mmt -87.14 -31.85 20.18 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.588 1.995 . . . . 0.0 115.381 168.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . 0.303 . . -62.88 -33.69 75.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.369 -2.253 . . . . 0.0 116.324 167.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -61.54 -38.26 86.78 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 128.382 3.551 . . . . 0.0 113.935 168.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -81.56 -35.47 30.2 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 114.179 -2.82 . . . . 0.0 109.534 -169.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . 0.45 HH11 ' HD3' ' D' ' 15' ' ' ARG . 0.0 OUTLIER -63.62 -21.5 66.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 117.392 2.367 . . . . 0.0 117.392 174.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -84.57 -37.16 21.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.995 2.118 . . . . 0.0 113.312 173.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -76.86 -37.23 55.96 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 125.08 1.487 . . . . 0.0 111.579 176.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -63.85 -18.99 64.71 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 116.072 -2.251 . . . . 0.0 112.422 166.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 -79.89 -47.61 14.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.835 1.254 . . . . 0.0 110.986 175.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 63.2 mt -52.52 -32.84 42.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.2 -2.333 . . . . 0.0 113.972 170.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 41.5 ttt180 -76.73 -19.49 57.6 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 114.867 -2.492 . . . . 0.0 110.265 173.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -75.56 -41.94 53.56 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 123.91 3.05 . . . . 0.0 114.836 155.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 77.8 t -60.19 -38.24 76.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 121.557 1.98 . . . . 0.0 111.826 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -74.44 -32.12 62.52 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 120.778 3.621 . . . . 0.0 120.778 168.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 21.4 tp -63.1 -44.08 96.69 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 165.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . 0.419 HD11 ' CE1' ' D' ' 30' ' ' TYR . 26.2 tp -67.71 -43.16 80.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 120.462 1.483 . . . . 0.0 109.377 178.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . 0.472 ' HE2' ' HB3' ' D' ' 27' ' ' LYS . 35.9 ttpt -57.34 -41.43 79.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 118.479 -2.638 . . . . 0.0 115.397 175.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -69.7 -32.49 71.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 116.674 -1.631 . . . . 0.0 110.243 171.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.263 . . -68.7 -20.93 64.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 121.419 1.918 . . . . 0.0 115.239 168.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . 0.419 ' CE1' HD11 ' D' ' 26' ' ' LEU . 15.2 m-85 -66.42 -45.61 79.32 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 123.236 2.744 . . . . 0.0 108.686 170.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -67.33 -5.79 15.88 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.628 -1.92 . . . . 0.0 114.644 -166.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 39.4 p-10 -137.25 16.08 2.99 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 125.428 1.705 . . . . 0.0 112.442 165.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 60.92 33.91 19.7 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 115.927 1.825 . . . . 0.0 115.927 172.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 48.1 mt -93.18 3.1 56.25 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 111.169 -2.741 . . . . 0.0 115.984 161.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.28 -60.68 2.99 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 130.753 3.621 . . . . 0.0 113.741 -178.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.13 -47.89 89.35 Favored Pre-proline 0 N--CA 1.451 -0.421 0 O-C-N 117.376 -3.327 . . . . 0.0 113.866 -174.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -64.01 -18.61 64.34 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 CA-C-N 123.035 2.119 . . . . 0.0 111.0 174.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . 0.315 38.1 tp -64.64 -70.81 0.21 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 123.353 2.797 . . . . 0.0 110.148 167.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . 0.427 ' H ' ' HG ' ' D' ' 39' ' ' LEU . 3.9 mt -36.09 -53.32 0.79 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 116.469 -1.729 . . . . 0.0 115.289 170.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . 0.291 26.8 m-20 -74.89 -22.27 58.74 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 116.998 -1.881 . . . . 0.0 111.194 -176.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 35.9 tp -65.65 -38.5 89.54 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 121.723 2.056 . . . . 0.0 112.84 166.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 72.1 mmm -89.85 -32.74 16.76 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 126.191 2.182 . . . . 0.0 114.223 -165.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 73.4 mt -105.61 122.3 45.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 118.041 -2.912 . . . . 0.0 112.888 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . 0.64 HG23 HG23 ' C' ' 81' ' ' THR 0.323 73.1 p -57.23 151.82 34.35 Favored Pre-proline 0 N--CA 1.45 -0.47 0 N-CA-C 119.223 3.046 . . . . 0.0 119.223 160.206 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -42.26 -53.3 3.7 Favored 'Trans proline' 0 N--CA 1.448 -1.201 0 C-N-CA 124.816 3.677 . . . . 0.0 116.864 -175.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.299 0.9 OUTLIER -84.22 -3.93 58.5 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 115.762 -2.066 . . . . 0.0 112.045 -169.704 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -75.41 -44.1 46.44 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 125.863 1.665 . . . . 0.0 109.199 162.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 36.9 mtm-85 -67.61 -33.58 75.27 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 115.318 -2.277 . . . . 0.0 111.781 171.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -67.59 -44.83 77.19 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 175.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.25 . . -56.31 -48.07 77.44 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 121.446 1.93 . . . . 0.0 113.289 176.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 mt -65.78 -39.38 90.94 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.877 -1.765 . . . . 0.0 114.429 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.33 -36.74 53.78 Favored Glycine 0 N--CA 1.448 -0.504 0 O-C-N 119.526 -1.984 . . . . 0.0 113.601 167.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 29.5 m -94.73 -31.83 13.61 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 120.203 -1.763 . . . . 0.0 109.438 -171.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -52.37 -33.84 45.09 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 119.273 3.064 . . . . 0.0 119.273 170.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.46 -39.47 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 N-CA-C 115.932 1.827 . . . . 0.0 115.932 173.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -80.25 -25.08 39.69 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 174.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 78.8 mt -56.22 -50.21 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 O-C-N 120.631 -1.293 . . . . 0.0 112.34 158.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 41.9 t -64.47 -50.54 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 O-C-N 125.338 1.649 . . . . 0.0 114.349 176.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -51.67 -42.28 62.01 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 125.165 2.412 . . . . 0.0 109.823 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -72.78 -19.3 61.38 Favored 'General case' 0 N--CA 1.451 -0.409 1 O-C-N 115.051 -4.78 . . . . 0.0 117.193 178.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 62.8 mt -79.49 -18.93 50.92 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 126.449 2.343 . . . . 0.0 115.425 166.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 10.4 mt -94.83 -25.99 16.39 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.956 2.102 . . . . 0.0 108.548 175.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 31.4 ttm105 -77.23 -38.47 51.17 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 122.627 2.467 . . . . 0.0 110.822 163.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.37 17.63 74.51 Favored Glycine 0 C--N 1.339 0.696 0 CA-C-N 123.441 2.837 . . . . 0.0 116.869 169.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -92.93 -40.49 10.55 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 119.034 1.417 . . . . 0.0 110.841 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 49.5 mtm -75.15 44.51 0.25 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.094 2.558 . . . . 0.0 108.154 173.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 85.5 p -87.24 175.45 8.03 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 119.673 3.212 . . . . 0.0 119.673 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 63.92 -33.33 0.13 Allowed 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 129.918 3.287 . . . . 0.0 112.797 174.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -146.75 -46.13 0.18 Allowed 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 129.119 2.968 . . . . 0.0 108.771 -176.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -75.39 -40.79 57.56 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 117.738 -3.101 . . . . 0.0 118.537 -149.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 tt -62.83 -43.0 99.96 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.81 0.844 . . . . 0.0 109.575 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -54.0 -22.51 10.68 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.133 0.973 . . . . 0.0 112.434 175.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -110.78 -37.56 5.39 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 116.942 2.201 . . . . 0.0 116.942 174.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -64.6 -51.12 64.37 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.435 3.094 . . . . 0.0 115.79 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.37 1.3 mm? -99.23 -22.75 15.48 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.563 1.545 . . . . 0.0 109.884 170.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 77.57 -149.7 35.49 Favored Glycine 0 CA--C 1.523 0.593 1 N-CA-C 123.949 4.34 . . . . 0.0 123.949 166.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -45.51 -24.1 0.29 Allowed 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 128.031 2.842 . . . . 0.0 118.154 -164.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.05 -20.43 79.97 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-O 125.72 2.845 . . . . 0.0 118.984 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . 0.308 2.1 tt -44.31 -39.13 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 111.846 -2.177 . . . . 0.0 114.739 176.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.79 -17.43 44.15 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 129.548 3.139 . . . . 0.0 110.414 -175.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 1.7 m -74.73 -39.61 61.76 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 125.473 2.558 . . . . 0.0 112.598 164.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 15.2 mm -73.62 -19.87 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 120.991 3.7 . . . . 0.0 120.991 173.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 72.5 p -111.54 -40.98 4.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 117.565 -3.209 . . . . 0.0 105.826 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.279 35.0 mtp85 -70.79 169.53 14.39 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 122.765 2.53 . . . . 0.0 114.28 171.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 100.73 133.37 8.11 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 104.763 -3.335 . . . . 0.0 104.763 -174.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -49.68 -24.79 2.44 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -145.11 42.89 1.31 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 127.688 2.395 . . . . 0.0 112.847 -169.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 60.2 p -75.95 -177.93 4.1 Favored 'General case' 0 N--CA 1.45 -0.464 1 O-C-N 129.252 4.095 . . . . 0.0 107.918 174.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.285 3.0 tt -52.98 -31.67 42.05 Favored 'General case' 0 N--CA 1.45 -0.44 1 N-CA-C 122.356 4.206 . . . . 0.0 122.356 160.152 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -72.09 -24.59 61.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.418 1.887 . . . . 0.0 112.214 172.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.69 -19.57 16.0 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.614 -1.66 . . . . 0.0 114.728 -175.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 41.5 84.5 0.18 Allowed Pre-proline 0 N--CA 1.449 -0.489 0 C-N-CA 128.736 2.814 . . . . 0.0 113.581 163.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . 0.473 ' C ' ' H ' ' D' ' 95' ' ' GLU . 50.2 Cg_exo 22.82 54.07 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 O-C-N 115.231 -3.089 . . . . 0.0 112.933 58.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 4.7 t -74.03 31.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 CA-C-O 122.612 1.196 . . . . 0.0 110.325 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . 0.473 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -137.18 -37.42 0.64 Allowed 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 116.199 -1.858 . . . . 0.0 114.788 174.597 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . 0.259 26.4 tp -55.68 -46.46 77.57 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.588 -1.672 . . . . 0.0 109.204 163.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 26.2 ptt180 -65.38 -35.04 79.76 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 117.0 -1.88 . . . . 0.0 114.217 -176.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -71.08 -35.54 71.89 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 115.038 1.495 . . . . 0.0 115.038 -172.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 29.9 t90 -63.65 -46.91 83.48 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 160.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 21.2 mt -63.22 -38.79 92.57 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 122.776 1.274 . . . . 0.0 113.234 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -47.38 -42.71 22.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 117.797 2.517 . . . . 0.0 117.797 163.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -95.15 -20.59 19.13 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 118.349 -2.719 . . . . 0.0 108.352 -166.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 89.8 t -85.61 -32.79 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 128.532 2.733 . . . . 0.0 114.185 165.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 64.9 mt -102.26 -6.09 23.54 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -171.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 51.9 mt -120.54 21.33 11.62 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 119.992 -1.692 . . . . 0.0 108.465 170.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 14.1 pttp -59.59 159.89 7.86 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 116.648 2.092 . . . . 0.0 116.648 -173.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.8 m -71.46 5.64 2.23 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 119.881 3.289 . . . . 0.0 119.881 -172.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 C--O 1.248 0.992 0 C-N-CA 127.167 2.187 . . . . 0.0 112.68 150.33 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.5 ttp . . . . . 0 N--CA 1.445 -0.691 0 CA-C-O 125.254 2.454 . . . . 0.0 114.685 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.78 -26.43 67.25 Favored 'General case' 0 N--CA 1.452 -0.346 1 O-C-N 114.173 -5.329 . . . . 0.0 111.616 166.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -88.19 -27.21 21.97 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 127.077 2.151 . . . . 0.0 114.485 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -85.15 -44.01 13.33 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 103.447 -2.797 . . . . 0.0 103.447 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.414 ' HD3' ' HA ' ' A' ' 15' ' ' ARG . 9.8 mmt180 -67.18 -45.63 76.38 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 104.054 -2.573 . . . . 0.0 104.054 -175.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -59.09 -46.29 88.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 117.737 -1.585 . . . . 0.0 114.349 175.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.11 -24.18 67.36 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 120.318 -1.488 . . . . 0.0 108.42 178.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.54 -28.83 61.13 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.969 -2.957 . . . . 0.0 109.569 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -94.52 -33.8 12.93 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 125.53 2.586 . . . . 0.0 112.583 -172.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.7 mt -60.75 -15.06 25.43 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 116.943 -3.598 . . . . 0.0 119.699 163.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -68.87 -48.32 63.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 130.472 3.509 . . . . 0.0 105.39 173.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -71.93 -37.29 70.04 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.549 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.3 t -65.45 -41.19 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-O 124.453 2.073 . . . . 0.0 112.264 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -69.96 -34.66 73.69 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 119.634 -1.916 . . . . 0.0 110.202 172.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 24.5 tp -73.96 -45.72 48.42 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 117.847 -3.033 . . . . 0.0 109.579 -173.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 tp -59.09 -36.59 75.38 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.432 ' HB2' ' CE1' ' B' ' 30' ' ' TYR . 69.8 tttt -62.62 -46.65 87.29 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 112.434 -2.166 . . . . 0.0 115.47 170.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -57.21 -39.19 74.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 126.205 1.802 . . . . 0.0 106.963 172.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.98 -31.27 56.39 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 114.395 -2.716 . . . . 0.0 108.597 -177.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -58.24 -42.2 85.86 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 173.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -75.68 -15.09 60.35 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 127.536 2.334 . . . . 0.0 110.553 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -131.78 16.69 4.76 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.34 3.4 m-20 73.3 1.75 4.1 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 168.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.2 mt -75.29 6.0 4.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.529 1.157 . . . . 0.0 113.562 168.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . 0.341 17.2 p-80 -67.47 -62.39 1.44 Allowed 'General case' 0 N--CA 1.451 -0.416 1 O-C-N 113.847 -5.533 . . . . 0.0 111.564 -166.436 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.262 26.7 mt -49.1 -46.79 76.12 Favored Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-O 114.115 -2.85 . . . . 0.0 117.338 167.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -58.96 -42.88 47.71 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 124.665 3.577 . . . . 0.0 113.089 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 17.7 tp -69.69 -46.83 65.14 Favored 'General case' 0 N--CA 1.452 -0.372 1 O-C-N 115.025 -4.797 . . . . 0.0 110.726 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 74.7 mt -55.16 -42.46 73.15 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 126.416 2.323 . . . . 0.0 115.577 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -77.82 -4.6 47.35 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.084 1.353 . . . . 0.0 113.388 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 23.6 tp -99.36 -29.13 12.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 114.144 -2.836 . . . . 0.0 113.276 169.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 59.8 mmm -107.72 -9.48 15.81 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.076 2.11 . . . . 0.0 116.543 -177.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.5 mp -118.36 152.11 36.46 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 118.839 -2.413 . . . . 0.0 109.339 159.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.8 p -110.46 165.45 12.66 Favored Pre-proline 0 N--CA 1.452 -0.343 0 C-N-CA 124.972 1.309 . . . . 0.0 107.79 -170.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -61.34 -40.68 47.2 Favored 'Trans proline' 0 N--CA 1.446 -1.315 0 C-N-CA 124.307 3.338 . . . . 0.0 117.994 -163.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -22.56 62.56 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 116.632 -1.651 . . . . 0.0 109.969 176.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -72.0 -41.86 67.1 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 121.219 1.827 . . . . 0.0 112.517 175.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 20.6 mtm180 -65.23 -49.82 68.2 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 123.946 0.899 . . . . 0.0 110.944 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -55.92 -39.3 71.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 171.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.43 -37.15 84.56 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 117.261 -1.352 . . . . 0.0 110.14 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 30.2 mt -74.88 -27.88 60.42 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 124.664 3.393 . . . . 0.0 110.571 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.41 -44.39 98.09 Favored Glycine 0 CA--C 1.522 0.517 0 O-C-N 119.757 -1.839 . . . . 0.0 113.67 171.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -60.66 -32.13 71.33 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.288 1.435 . . . . 0.0 114.131 171.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.262 93.9 mtt180 -68.67 -34.42 75.66 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.545 -0.74 . . . . 0.0 111.232 -177.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.96 -48.21 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 168.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -55.01 -39.43 69.07 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 112.624 -3.56 . . . . 0.0 114.473 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 52.8 mt -63.43 -49.13 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 123.285 2.766 . . . . 0.0 111.849 167.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.0 -35.33 71.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 O-C-N 117.772 -3.08 . . . . 0.0 108.541 -174.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -60.45 -54.53 44.4 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 118.824 -2.423 . . . . 0.0 108.686 174.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -60.5 -27.6 67.72 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 171.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.5 mt -76.28 -25.31 54.77 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 117.456 -3.277 . . . . 0.0 111.149 176.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.9 mt -92.35 -40.06 11.12 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 127.725 2.41 . . . . 0.0 112.226 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.6 ttm105 -46.73 -56.49 6.11 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 117.044 -3.535 . . . . 0.0 112.454 148.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.67 44.94 61.12 Favored Glycine 0 C--N 1.337 0.611 0 C-N-CA 117.602 -2.237 . . . . 0.0 112.702 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -121.04 -52.08 2.09 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 127.653 2.381 . . . . 0.0 114.762 178.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.0 mtt -67.7 130.81 44.17 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 119.101 -2.249 . . . . 0.0 114.516 175.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.1 p -83.54 178.32 8.05 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 120.459 1.481 . . . . 0.0 110.033 -178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -63.87 -46.45 84.92 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 116.507 -2.077 . . . . 0.0 112.855 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.9 tpt85 -63.01 -10.07 12.46 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 119.792 3.256 . . . . 0.0 119.792 170.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -86.66 -42.89 13.05 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 120.938 1.699 . . . . 0.0 110.668 165.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 19.8 mt -63.83 -26.32 68.57 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.963 -1.71 . . . . 0.0 111.259 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -63.45 -21.81 66.52 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.356 1.062 . . . . 0.0 111.427 -176.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -102.08 -53.03 3.02 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 129.36 3.064 . . . . 0.0 111.125 166.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -74.59 -27.06 60.32 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 124.011 3.096 . . . . 0.0 115.523 -168.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.4 mt -121.83 -5.23 9.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 118.707 2.854 . . . . 0.0 118.707 170.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 82.35 5.15 89.83 Favored Glycine 0 CA--C 1.523 0.555 0 CA-C-O 116.137 -2.48 . . . . 0.0 115.027 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.67 138.78 43.08 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 117.438 2.384 . . . . 0.0 117.438 -170.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.73 171.53 55.13 Favored Glycine 0 C--N 1.34 0.779 0 CA-C-O 124.552 2.196 . . . . 0.0 116.159 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.8 mt -54.31 -59.29 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 1 O-C-N 115.096 -4.767 . . . . 0.0 112.656 173.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.11 -34.96 75.79 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.99 1.716 . . . . 0.0 113.842 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.15 -36.2 66.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 124.121 0.968 . . . . 0.0 110.538 177.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.39 49.7 mm -69.33 -45.15 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 O-C-N 118.465 -2.647 . . . . 0.0 114.338 164.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.1 m -65.36 -52.35 54.26 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.629 -177.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -74.55 -32.86 62.57 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 121.201 1.818 . . . . 0.0 110.462 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.12 -34.97 90.75 Favored Glycine 0 C--N 1.338 0.668 0 O-C-N 120.142 -1.599 . . . . 0.0 111.566 169.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.0 m -68.67 -45.0 72.87 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.126 -2.985 . . . . 0.0 111.036 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -57.94 -40.87 81.57 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 172.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 75.8 m -72.16 -25.94 61.89 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 113.656 -1.611 . . . . 0.0 113.848 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.6 tp -71.0 -33.09 70.06 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 166.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -69.04 -32.51 72.07 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 113.491 -3.147 . . . . 0.0 112.193 169.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.91 -5.68 40.09 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 128.109 3.381 . . . . 0.0 114.892 170.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.4 143.0 87.33 Favored Pre-proline 0 N--CA 1.448 -0.538 1 O-C-N 115.679 -4.388 . . . . 0.0 108.692 172.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -73.2 149.15 45.31 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 123.574 2.849 . . . . 0.0 110.202 175.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.2 m -65.98 -32.47 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 116.873 -3.642 . . . . 0.0 107.953 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.265 18.2 pm0 -65.07 -26.24 68.15 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 119.92 1.236 . . . . 0.0 111.192 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 48.2 tp -80.99 -41.9 22.02 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 116.757 -1.592 . . . . 0.0 110.853 177.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -68.59 -38.09 80.37 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 121.89 2.132 . . . . 0.0 111.79 176.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -53.79 -37.27 63.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 129.534 3.133 . . . . 0.0 111.815 168.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 34.2 t90 -77.19 -49.69 14.61 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.891 1.276 . . . . 0.0 109.098 176.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 79.1 mt -68.64 -33.42 73.99 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 -174.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.21 -36.18 81.16 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 121.64 2.018 . . . . 0.0 113.855 169.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -74.55 -34.43 62.94 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 118.959 -2.338 . . . . 0.0 114.548 170.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.4 t -70.55 -44.07 77.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 O-C-N 119.589 -1.944 . . . . 0.0 110.184 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . 0.286 12.0 mt -97.34 -27.98 14.24 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -172.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.6 mt -103.82 19.81 19.26 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 117.162 -3.461 . . . . 0.0 114.991 -167.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt . . . . . 0 N--CA 1.447 -0.579 0 O-C-N 119.848 -1.783 . . . . 0.0 115.417 -170.309 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.586 0 CA-C-O 115.556 -2.164 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 4.0 mtt -87.61 -43.0 12.3 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 103.95 -2.611 . . . . 0.0 103.95 -176.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.65 -37.36 63.05 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 128.114 2.566 . . . . 0.0 116.183 170.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -66.23 -57.27 7.94 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 130.559 3.544 . . . . 0.0 107.724 -178.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -47.93 -46.14 31.71 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 129.397 3.079 . . . . 0.0 115.394 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -74.7 -43.27 55.99 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 126.407 1.883 . . . . 0.0 109.837 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -62.9 -26.66 68.9 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.179 1.354 . . . . 0.0 114.393 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -73.81 -50.72 19.14 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 116.278 -1.82 . . . . 0.0 110.581 174.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -43.12 -51.84 5.72 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 127.718 3.136 . . . . 0.0 114.26 163.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 -57.09 -49.84 74.64 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.934 1.694 . . . . 0.0 115.028 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 38.7 mt -63.46 -23.34 67.36 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 119.751 -1.843 . . . . 0.0 112.009 -176.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . 0.259 67.5 ttt180 -67.93 -30.19 69.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.788 2.035 . . . . 0.0 112.301 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -79.77 -36.83 36.59 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 115.899 -2.0 . . . . 0.0 111.358 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 20.9 t -59.28 -39.69 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 O-C-N 126.402 2.314 . . . . 0.0 112.914 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -80.1 -35.23 37.17 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 116.464 -1.732 . . . . 0.0 114.872 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 25.8 tp -58.74 -47.43 84.66 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 126.175 2.893 . . . . 0.0 114.63 168.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 28.8 tp -70.53 -32.93 70.58 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 116.863 -3.648 . . . . 0.0 112.526 -177.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . 0.317 59.2 tttt -49.7 -50.59 43.21 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 126.318 2.961 . . . . 0.0 110.854 165.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -81.91 -20.04 39.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 116.958 -3.588 . . . . 0.0 111.51 -174.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.49 -36.32 57.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 172.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . 0.432 ' CE1' ' HB2' ' A' ' 27' ' ' LYS . 6.3 m-85 -50.53 -39.73 49.78 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 170.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -90.28 6.28 43.6 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.375 2.361 . . . . 0.0 117.375 178.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -119.67 6.21 11.01 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 119.409 -2.057 . . . . 0.0 107.93 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 57.82 43.5 21.65 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 117.231 -3.418 . . . . 0.0 112.793 -173.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 89.3 mt -125.15 5.51 7.86 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.46 -2.65 . . . . 0.0 111.523 -174.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -62.76 -39.49 94.31 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 119.197 -2.189 . . . . 0.0 113.555 -178.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' B' ' 36' ' ' LEU . 12.3 mt -66.54 -52.42 35.59 Favored Pre-proline 0 N--CA 1.446 -0.662 1 O-C-N 115.21 -4.681 . . . . 0.0 109.143 -173.281 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' B' ' 36' ' ' LEU . 38.9 Cg_endo -70.53 -26.16 24.26 Favored 'Trans proline' 0 N--CA 1.447 -1.215 0 C-N-CA 121.665 1.576 . . . . 0.0 110.833 -177.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 tp -64.76 -44.47 89.93 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.583 1.553 . . . . 0.0 114.864 174.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 83.1 mt -78.84 -32.03 45.97 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.848 2.459 . . . . 0.0 111.456 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -62.33 -28.06 69.48 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 123.567 2.894 . . . . 0.0 109.276 165.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 51.6 tp -89.36 -34.79 16.4 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.643 1.977 . . . . 0.0 113.844 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 16.6 mmt -86.99 -21.47 26.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 115.085 -2.388 . . . . 0.0 112.077 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 44.5 mt -137.81 124.55 21.08 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 128.891 2.876 . . . . 0.0 110.153 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 77.1 p -68.9 166.79 24.23 Favored Pre-proline 0 N--CA 1.451 -0.423 0 C-N-CA 124.769 1.228 . . . . 0.0 112.292 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -40.54 -52.51 3.07 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 124.65 3.567 . . . . 0.0 113.726 167.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -66.7 -24.63 66.28 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 121.719 2.054 . . . . 0.0 114.816 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -83.49 -33.79 25.49 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 127.296 2.239 . . . . 0.0 115.912 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 56.6 mtm-85 -72.71 -40.53 66.11 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 127.442 2.297 . . . . 0.0 108.848 177.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.286 38.8 tt0 -63.57 -37.47 87.45 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 126.579 2.425 . . . . 0.0 115.688 176.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.7 -53.44 58.01 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.987 174.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.0 mt -59.14 -37.48 77.37 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 121.134 3.753 . . . . 0.0 121.134 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.19 -30.73 74.6 Favored Glycine 0 CA--C 1.523 0.594 0 C-N-CA 126.638 2.066 . . . . 0.0 115.313 166.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 74.1 m -87.29 -45.08 10.92 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 112.191 -3.766 . . . . 0.0 104.221 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -51.01 -45.93 61.35 Favored 'General case' 0 N--CA 1.452 -0.359 1 CA-C-N 126.227 4.103 . . . . 0.0 109.879 176.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.0 t -50.62 -55.07 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 116.627 -1.654 . . . . 0.0 111.773 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -56.18 -35.02 66.77 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 116.116 1.895 . . . . 0.0 116.116 172.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 80.7 mt -67.55 -45.37 85.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 120.545 1.521 . . . . 0.0 113.33 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 43.7 t -83.56 -1.9 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 126.285 1.834 . . . . 0.0 114.608 -172.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . 0.292 57.4 tt0 -92.36 -28.21 17.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.062 -1.829 . . . . 0.0 106.062 171.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -78.57 -20.96 49.4 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 126.467 1.907 . . . . 0.0 115.616 177.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 91.9 mt -63.93 -33.79 76.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 160.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . 0.267 13.2 mt -77.03 -33.27 57.37 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 120.6 3.556 . . . . 0.0 120.6 174.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 37.4 ttm105 -87.42 -58.67 2.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 127.867 3.229 . . . . 0.0 108.5 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.71 39.5 20.93 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 118.98 2.352 . . . . 0.0 118.98 175.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -123.5 -6.09 8.15 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 117.705 -1.141 . . . . 0.0 111.648 -168.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 5.1 mtt -83.37 152.33 25.1 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 30.5 p -83.45 159.56 21.73 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 117.662 -3.149 . . . . 0.0 115.989 157.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -61.97 -31.15 71.48 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 119.86 -1.775 . . . . 0.0 109.119 -173.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -59.29 -39.76 84.03 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 119.275 -2.141 . . . . 0.0 114.497 171.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -72.1 -38.1 69.41 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 119.822 -1.799 . . . . 0.0 108.5 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 46.3 mt -55.98 -48.85 75.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 118.95 -2.344 . . . . 0.0 107.554 176.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -66.39 -40.3 89.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 116.505 -2.078 . . . . 0.0 114.881 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -99.38 -17.86 17.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 125.691 2.663 . . . . 0.0 117.317 -164.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -105.2 -49.62 3.42 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 128.98 2.912 . . . . 0.0 112.236 176.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 60.7 mt -95.85 -4.83 42.98 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 126.452 2.345 . . . . 0.0 113.604 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.84 19.27 60.74 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-O 118.895 -0.947 . . . . 0.0 114.14 -178.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -100.79 118.25 36.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 116.418 2.007 . . . . 0.0 116.418 -165.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.01 167.98 54.36 Favored Glycine 0 CA--C 1.523 0.556 1 CA-C-O 128.364 4.313 . . . . 0.0 110.688 174.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 80.6 mt -52.23 -39.71 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 O-C-N 116.467 -3.961 . . . . 0.0 112.399 171.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . 0.275 . . -78.65 -39.29 37.39 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 116.798 -3.689 . . . . 0.0 115.013 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 9.2 m -56.92 -36.82 70.65 Favored 'General case' 0 N--CA 1.454 -0.272 1 O-C-N 114.22 -5.3 . . . . 0.0 113.171 166.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 14.3 mm -64.1 -53.07 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 170.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 24.1 m -55.07 -48.28 73.74 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 121.309 1.868 . . . . 0.0 114.455 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 20.1 ttt180 -63.88 -41.37 97.76 Favored 'General case' 0 N--CA 1.451 -0.408 1 O-C-N 116.239 -4.038 . . . . 0.0 112.524 175.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.68 -46.82 66.04 Favored Glycine 0 C--N 1.334 0.46 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 172.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m -71.6 -29.66 64.93 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 117.008 -1.472 . . . . 0.0 113.953 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -61.27 -58.79 6.82 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 119.79 1.177 . . . . 0.0 111.119 169.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -60.04 -33.24 71.75 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.078 2.151 . . . . 0.0 114.225 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 20.2 mt -58.69 -36.25 73.92 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 113.59 -3.1 . . . . 0.0 114.446 162.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 58.8 mttt -70.33 1.79 4.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 122.6 2.455 . . . . 0.0 112.39 173.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -117.52 -5.79 11.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 127.897 2.479 . . . . 0.0 115.761 174.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.4 131.84 64.15 Favored Pre-proline 0 N--CA 1.448 -0.567 0 C-N-CA 124.225 1.01 . . . . 0.0 109.809 -174.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -61.69 153.27 68.51 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 117.843 -0.971 . . . . 0.0 109.839 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.0 m -55.89 -33.77 35.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 126.52 2.388 . . . . 0.0 114.084 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 -74.49 -27.89 60.76 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 117.508 2.41 . . . . 0.0 117.508 -177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 52.7 tp -66.34 -50.79 62.38 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 117.343 -3.348 . . . . 0.0 111.437 164.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 15.3 mtm180 -61.47 -45.02 96.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 -173.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -53.98 -38.8 65.43 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 118.679 -2.513 . . . . 0.0 115.651 163.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -74.16 -35.44 64.03 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.42 -31.31 72.43 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 175.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -75.54 -18.78 59.68 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 124.488 1.117 . . . . 0.0 113.035 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -84.6 -31.85 24.07 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 131.617 3.967 . . . . 0.0 115.663 170.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 84.8 t -104.68 -52.63 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 116.287 -1.816 . . . . 0.0 111.956 -170.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 79.1 mt -76.41 -50.11 14.98 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 121.446 1.93 . . . . 0.0 108.665 -173.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 45.0 mt -67.91 -30.45 69.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.226 2.204 . . . . 0.0 110.376 -173.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . 0.283 89.1 mttt -70.06 -11.69 61.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 120.038 -1.664 . . . . 0.0 114.281 172.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.3 m -82.31 -9.37 59.5 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 116.554 -3.842 . . . . 0.0 116.506 168.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 . . . . . 0 C--O 1.248 1.013 0 CA-C-N 123.608 2.913 . . . . 0.0 112.428 170.165 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 14.9 ttt . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 124.975 2.321 . . . . 0.0 108.466 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.53 159.44 31.28 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 111.867 -2.424 . . . . 0.0 114.166 -168.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -131.86 148.4 52.54 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -127.09 127.22 44.3 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 128.462 2.705 . . . . 0.0 110.943 169.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 74.5 p -119.95 167.92 11.41 Favored Pre-proline 0 N--CA 1.451 -0.382 0 O-C-N 127.735 3.147 . . . . 0.0 113.45 168.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . 0.269 87.4 Cg_exo -59.52 -31.59 94.84 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.983 3.122 . . . . 0.0 117.18 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . 0.271 68.9 t80 -148.66 141.56 24.74 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 119.346 -2.096 . . . . 0.0 108.539 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 2.7 t -141.37 120.89 13.26 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.443 -1.253 . . . . 0.0 112.328 166.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.82 -5.74 22.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 121.558 3.91 . . . . 0.0 121.558 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.91 -17.02 59.2 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 117.596 2.443 . . . . 0.0 117.596 171.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 33.1 mtt -86.58 -39.31 16.29 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 126.215 1.806 . . . . 0.0 108.015 173.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.07 -28.06 54.5 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 177.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -70.89 -28.93 64.9 Favored 'General case' 0 N--CA 1.449 -0.494 1 O-C-N 116.287 -4.008 . . . . 0.0 109.942 170.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -76.07 -31.66 58.88 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 115.86 -2.019 . . . . 0.0 113.457 171.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -35.34 79.09 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 121.535 1.97 . . . . 0.0 109.576 165.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -66.29 -49.56 66.67 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 125.92 2.012 . . . . 0.0 107.414 -174.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 71.4 mm-40 -63.9 -30.58 71.65 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -67.36 -34.31 77.03 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.199 -2.188 . . . . 0.0 109.207 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . 0.507 ' CE2' ' HD2' ' D' ' 48' ' ' ARG . 58.3 t-105 -82.98 -40.27 20.24 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 -175.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 21.8 mt -64.85 -37.14 86.62 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 117.463 -1.695 . . . . 0.0 112.318 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -53.59 -36.78 62.31 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 128.172 2.589 . . . . 0.0 113.627 167.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . 0.274 75.7 t80 -52.24 -59.92 3.82 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 127.239 2.216 . . . . 0.0 106.153 171.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 98.8 t -74.38 -32.48 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 125.162 1.538 . . . . 0.0 110.671 -170.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -68.4 -34.34 75.86 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 116.698 -3.751 . . . . 0.0 112.02 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . 0.438 ' CD1' HG11 ' D' ' 103' ' ' VAL . 35.8 tp -77.44 -28.35 52.44 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 119.095 -2.253 . . . . 0.0 109.276 174.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . 0.445 HD11 HD21 ' C' ' 39' ' ' LEU . 15.6 tp -70.72 -28.33 64.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 115.652 -2.118 . . . . 0.0 113.848 170.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp -88.11 -28.66 21.15 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 121.901 2.137 . . . . 0.0 110.365 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -60.98 -28.67 69.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.863 1.665 . . . . 0.0 110.952 164.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.44 -7.22 48.68 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 122.98 1.371 . . . . 0.0 111.786 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -99.64 0.75 42.66 Favored 'General case' 0 N--CA 1.451 -0.402 1 O-C-N 115.968 -4.207 . . . . 0.0 110.89 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -70.69 -36.56 73.34 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 124.474 3.306 . . . . 0.0 111.402 175.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 49.8 p-10 -124.1 17.65 9.2 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 120.408 -1.432 . . . . 0.0 108.859 -171.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.292 4.2 m-20 56.31 32.55 20.64 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 116.939 2.2 . . . . 0.0 116.939 -175.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 21.9 mt -89.2 10.04 23.51 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.105 -2.872 . . . . 0.0 107.567 173.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -58.23 -47.03 84.8 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 123.011 2.641 . . . . 0.0 110.96 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.283 62.8 mt -67.55 -44.61 45.16 Favored Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-O 113.227 -3.273 . . . . 0.0 110.466 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -70.27 -20.3 32.6 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 CA-C-N 123.731 2.368 . . . . 0.0 111.629 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 26.5 tp -81.17 -30.02 34.5 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 122.088 2.222 . . . . 0.0 115.215 167.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . 0.634 HD13 ' CZ2' ' D' ' 19' ' ' TRP . 75.1 mt -65.34 -27.98 68.97 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 120.452 -1.405 . . . . 0.0 111.795 165.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -92.94 -0.64 57.18 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 126.913 2.085 . . . . 0.0 109.235 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 30.7 tp -100.63 -44.41 5.84 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 127.939 3.733 . . . . 0.0 115.106 167.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . 0.252 9.1 mmt -77.57 -36.47 52.04 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 117.51 -3.244 . . . . 0.0 114.284 -175.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.53 152.6 33.77 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 125.128 1.518 . . . . 0.0 111.787 -173.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 27.8 p -76.46 162.43 70.94 Favored Pre-proline 0 N--CA 1.452 -0.347 0 C-N-CA 127.024 2.129 . . . . 0.0 115.909 163.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -56.9 -37.29 98.62 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 CA-C-N 124.241 2.55 . . . . 0.0 116.72 -176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -79.61 -4.32 51.04 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 127.985 3.303 . . . . 0.0 114.871 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -97.38 -16.58 20.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.006 -1.452 . . . . 0.0 113.39 171.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -84.5 -44.62 13.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 117.613 -1.184 . . . . 0.0 111.02 167.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -57.4 -43.9 84.08 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 104.31 -2.478 . . . . 0.0 104.31 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.05 -40.61 64.96 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 118.62 -2.55 . . . . 0.0 110.887 -169.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . 0.442 HD22 ' CZ ' ' D' ' 22' ' ' PHE . 3.3 mt -60.29 -45.63 92.68 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 125.427 2.537 . . . . 0.0 108.988 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.66 -43.26 96.36 Favored Glycine 0 CA--C 1.524 0.652 0 CA-C-O 116.781 -2.122 . . . . 0.0 111.667 173.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 60.6 m -60.37 -42.67 96.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.152 1.976 . . . . 0.0 112.982 173.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.309 96.0 mtt180 -57.61 -24.61 57.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 119.716 -1.865 . . . . 0.0 112.543 -172.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 98.5 t -63.8 -38.84 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 106.322 -1.732 . . . . 0.0 106.322 178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 68.2 mtp180 -83.27 -15.53 49.87 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 123.855 1.788 . . . . 0.0 112.048 -171.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 32.6 mt -74.95 -47.23 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 C-N-CA 126.272 1.829 . . . . 0.0 106.522 169.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 35.1 t -61.16 -48.98 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 122.602 1.192 . . . . 0.0 113.553 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -49.83 -42.54 47.48 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 117.44 2.385 . . . . 0.0 117.44 173.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -69.4 -50.74 43.2 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 115.149 -2.357 . . . . 0.0 109.684 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 mt -66.06 -7.22 16.17 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 123.238 2.744 . . . . 0.0 117.464 177.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 80.1 mt -93.74 -33.25 13.69 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.449 2.3 . . . . 0.0 110.387 167.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 45.5 ttm180 -80.02 -38.7 31.47 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.54 22.23 74.95 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 122.672 3.829 . . . . 0.0 122.672 170.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -83.54 -16.08 46.84 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 116.665 -3.844 . . . . 0.0 115.763 165.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 35.4 mtt -77.96 130.13 36.16 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 117.708 -1.597 . . . . 0.0 113.095 173.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 81.7 p -80.8 168.31 18.94 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 124.065 0.853 . . . . 0.0 111.992 159.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -41.37 -43.63 2.57 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 130.023 3.329 . . . . 0.0 110.52 172.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -52.77 -41.62 64.25 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 118.05 -2.906 . . . . 0.0 112.263 -176.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -90.38 -38.3 13.41 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 131.592 3.957 . . . . 0.0 109.616 -169.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 62.8 mt -62.23 -21.49 65.2 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 120.133 -1.604 . . . . 0.0 111.689 174.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 31.7 tttp -80.46 -46.43 15.93 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 118.133 -1.427 . . . . 0.0 113.199 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -86.59 -54.0 4.65 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 119.02 -2.3 . . . . 0.0 112.506 -176.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -71.41 -32.97 69.01 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.327 -1.483 . . . . 0.0 113.67 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 mp -101.22 -3.24 29.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 116.447 2.017 . . . . 0.0 116.447 174.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 72.23 -142.17 32.46 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-O 117.112 -1.938 . . . . 0.0 112.698 159.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -99.48 -7.04 26.56 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 131.446 3.899 . . . . 0.0 114.169 164.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.38 -32.45 52.07 Favored Glycine 0 C--N 1.337 0.595 0 C-N-CA 126.778 2.132 . . . . 0.0 112.567 172.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 13.1 tt -54.29 -40.9 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-O 114.705 -2.569 . . . . 0.0 117.161 175.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.65 -34.28 77.85 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.148 1.53 . . . . 0.0 109.972 -178.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . 0.464 HG23 ' CG2' ' D' ' 44' ' ' THR . 31.5 m -60.25 -33.13 71.87 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 115.418 -2.229 . . . . 0.0 114.054 168.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 28.1 mm -88.97 -17.41 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 126.825 2.05 . . . . 0.0 111.492 -177.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.2 p -117.48 -19.73 9.35 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -165.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -119.23 151.03 39.1 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 118.494 -2.629 . . . . 0.0 114.609 -175.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.7 170.0 44.17 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 120.879 3.111 . . . . 0.0 120.879 -164.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 67.8 p -84.96 0.85 49.89 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 118.103 -2.998 . . . . 0.0 113.654 -168.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -117.98 5.93 12.13 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.74 2.416 . . . . 0.0 114.325 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 74.6 p -61.14 158.35 14.03 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 119.939 3.311 . . . . 0.0 119.939 175.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 15.7 tp -57.11 -28.18 62.45 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 120.016 -1.677 . . . . 0.0 115.41 -163.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -103.4 16.67 25.93 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -119.68 -7.78 10.02 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 128.181 2.592 . . . . 0.0 112.867 169.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.64 163.32 61.74 Favored Pre-proline 0 N--CA 1.451 -0.379 0 C-N-CA 128.167 2.587 . . . . 0.0 109.587 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -61.63 146.68 96.63 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.504 2.803 . . . . 0.0 110.506 -176.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 12.9 t -67.15 -42.34 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 CA-C-N 113.376 -1.738 . . . . 0.0 113.42 -178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pm0 -56.5 -12.05 1.56 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 160.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . 0.285 14.3 tp -93.36 -41.3 9.92 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.632 -3.168 . . . . 0.0 115.073 164.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -51.68 -34.1 36.87 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 129.243 3.017 . . . . 0.0 113.69 167.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -94.47 -42.13 9.01 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 116.795 -1.574 . . . . 0.0 108.148 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -58.14 -40.49 81.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 116.713 -1.613 . . . . 0.0 113.562 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 82.6 mt -62.61 -38.67 91.09 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 125.707 1.879 . . . . 0.0 110.696 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -71.68 -8.23 52.88 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 172.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -99.25 -5.72 29.35 Favored 'General case' 0 N--CA 1.447 -0.595 2 CA-C-N 127.383 4.628 . . . . 0.0 110.75 175.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 90.0 t -125.49 -42.97 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.675 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 8.3 mt -80.6 -15.24 57.11 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.95 -2.344 . . . . 0.0 109.786 -176.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 83.9 mt -136.42 15.76 3.19 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 116.84 2.163 . . . . 0.0 116.84 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 60.2 pttt . . . . . 0 N--CA 1.45 -0.436 0 O-C-N 118.441 -2.662 . . . . 0.0 116.409 172.779 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 79.1 p . . . . . 0 N--CA 1.449 -0.494 0 CA-C-O 113.934 -2.936 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.42 -27.97 46.68 Favored 'Trans proline' 0 N--CA 1.448 -1.148 1 C-N-CA 128.105 5.87 . . . . 0.0 113.973 -176.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -142.81 145.13 32.91 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 143.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 31.0 t -70.93 129.26 38.57 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 125.435 2.54 . . . . 0.0 110.829 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.45 -19.34 50.12 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 128.911 2.884 . . . . 0.0 108.485 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . 0.252 . . -67.61 -50.85 56.17 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 128.18 2.592 . . . . 0.0 110.285 167.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 17.1 mmt -63.27 -41.64 99.05 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 119.368 -2.082 . . . . 0.0 110.509 168.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.42 -33.62 72.77 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 120.588 1.54 . . . . 0.0 114.427 -176.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -51.89 -65.21 0.6 Allowed 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 119.157 -2.214 . . . . 0.0 114.114 158.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -52.05 -35.5 47.48 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 118.53 2.789 . . . . 0.0 118.53 -174.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -34.67 78.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 120.261 -1.524 . . . . 0.0 113.768 171.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -78.76 -25.01 44.39 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 112.394 -3.67 . . . . 0.0 108.148 165.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -72.0 -33.33 67.99 Favored 'General case' 0 N--CA 1.45 -0.465 1 CA-C-N 126.17 4.077 . . . . 0.0 115.351 177.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -70.03 -25.25 63.49 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.095 1.758 . . . . 0.0 112.09 174.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . 0.634 ' CZ2' HD13 ' C' ' 39' ' ' LEU . 24.9 t-105 -79.83 -52.34 8.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 127.264 2.852 . . . . 0.0 106.451 177.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 61.5 mt -49.77 -32.97 15.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 116.762 2.134 . . . . 0.0 116.762 167.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -73.07 -31.0 64.1 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.611 1.564 . . . . 0.0 114.011 176.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . 0.442 ' CZ ' HD22 ' C' ' 51' ' ' LEU . 69.3 t80 -69.07 -46.43 67.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 126.656 2.472 . . . . 0.0 115.062 165.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 77.5 t -59.07 -36.92 65.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 120.255 1.389 . . . . 0.0 110.787 175.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . 0.326 20.8 t70 -61.26 -62.98 1.45 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 127.081 2.152 . . . . 0.0 111.7 169.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . 0.482 HD23 HD21 ' D' ' 38' ' ' LEU . 13.2 tp -47.68 -42.98 26.09 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 115.493 -2.194 . . . . 0.0 110.352 177.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 60.1 tp -71.27 -50.96 27.34 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 127.765 2.426 . . . . 0.0 108.8 -174.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -56.35 -35.21 67.38 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.072 -2.268 . . . . 0.0 114.249 170.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -68.52 -40.46 80.77 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 116.962 -1.895 . . . . 0.0 110.597 173.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.76 -15.32 62.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 127.219 2.208 . . . . 0.0 113.578 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . 0.298 18.3 m-30 -75.26 -26.2 58.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 118.034 -2.916 . . . . 0.0 111.007 161.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -83.91 -23.95 30.97 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 124.288 3.222 . . . . 0.0 114.788 -168.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -103.28 4.74 36.89 Favored 'General case' 0 N--CA 1.451 -0.397 1 N-CA-C 121.863 4.024 . . . . 0.0 121.863 153.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.261 39.9 m-20 68.11 26.56 7.14 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.593 1.957 . . . . 0.0 113.762 170.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 91.1 mt -93.94 5.67 50.92 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.12 2.568 . . . . 0.0 113.294 175.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -52.79 59.83 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.531 2.332 . . . . 0.0 114.063 176.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.7 -45.91 66.79 Favored Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-O 115.808 -2.044 . . . . 0.0 108.758 -168.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.251 26.5 Cg_endo -64.4 -28.57 62.76 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 CA-C-N 122.428 1.903 . . . . 0.0 113.211 176.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . 0.482 HD21 HD23 ' D' ' 25' ' ' LEU . 44.4 tp -68.2 -50.17 55.96 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 -179.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 95.4 mt -58.28 -38.37 76.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.542 1.537 . . . . 0.0 114.128 166.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . 0.395 6.1 m-20 -68.01 -29.64 68.7 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 117.503 -1.237 . . . . 0.0 111.04 177.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 17.1 tp -75.29 -35.41 61.31 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 123.247 1.499 . . . . 0.0 113.439 172.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 7.4 mmm -87.24 -19.97 27.57 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 116.154 -2.218 . . . . 0.0 114.359 -176.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 93.8 mt -125.78 126.4 44.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.534 -2.604 . . . . 0.0 107.968 -172.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . 0.464 ' CG2' HG23 ' C' ' 81' ' ' THR . 61.8 p -62.67 157.97 54.34 Favored Pre-proline 0 N--CA 1.449 -0.524 0 CA-C-O 114.152 -2.832 . . . . 0.0 117.646 174.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -59.69 -37.42 87.67 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 CA-C-N 125.429 2.975 . . . . 0.0 117.221 -173.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -63.68 -31.81 73.1 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 120.44 -1.413 . . . . 0.0 113.327 169.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -73.15 -30.13 63.37 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 120.351 -1.468 . . . . 0.0 110.958 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . 0.507 ' HD2' ' CE2' ' C' ' 19' ' ' TRP . 77.9 mtm-85 -76.59 -41.17 47.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.933 2.093 . . . . 0.0 111.898 176.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -54.96 -60.44 3.37 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 125.379 1.472 . . . . 0.0 111.933 166.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.15 -43.23 66.85 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 73.3 mt -64.58 -53.92 40.22 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 126.163 2.165 . . . . 0.0 114.08 173.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -37.89 -36.93 0.36 Allowed Glycine 0 C--N 1.336 0.534 0 CA-C-N 120.224 1.374 . . . . 0.0 116.315 159.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 87.3 m -77.84 -35.94 50.55 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.017 2.127 . . . . 0.0 110.633 -176.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . 0.43 ' HB3' HD11 ' D' ' 82' ' ' ILE . 22.7 mtt180 -71.87 -20.94 61.73 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 114.199 -2.81 . . . . 0.0 110.445 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 85.8 t -55.79 -46.63 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 116.285 1.957 . . . . 0.0 116.285 166.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -84.81 -26.52 27.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 126.689 2.493 . . . . 0.0 110.22 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 15.4 mt -70.31 -36.72 68.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 O-C-N 118.759 -2.463 . . . . 0.0 108.737 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . 0.483 ' CG2' HD12 ' D' ' 82' ' ' ILE . 94.9 t -67.93 -32.62 57.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 118.097 2.629 . . . . 0.0 118.097 170.276 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -70.82 -45.22 64.96 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.407 -1.724 . . . . 0.0 111.667 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.18 -32.7 74.38 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.428 1.491 . . . . 0.0 110.045 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 19.7 mt -71.88 -17.09 62.14 Favored 'General case' 0 N--CA 1.447 -0.579 1 O-C-N 115.027 -4.796 . . . . 0.0 114.676 172.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -91.21 -32.11 15.91 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 124.249 1.976 . . . . 0.0 113.025 165.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . 0.576 ' HG2' ' HG3' ' D' ' 65' ' ' GLU . 20.6 ttm180 -61.78 -52.79 62.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.733 -1.854 . . . . 0.0 113.029 170.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.63 26.23 69.61 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-O 115.362 -2.91 . . . . 0.0 118.792 174.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . 0.576 ' HG3' ' HG2' ' D' ' 63' ' ' ARG . 81.4 mt-10 -99.75 -45.59 5.69 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 100.808 -3.775 . . . . 0.0 100.808 -166.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 5.1 mtm -88.88 56.57 3.78 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 23.7 p -90.36 -171.77 3.21 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 123.428 1.585 . . . . 0.0 113.629 -168.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.376 7.2 tp60 61.25 -82.64 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 121.3 3.815 . . . . 0.0 121.3 170.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 25.7 ttt85 -93.84 -31.96 14.14 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 126.247 2.217 . . . . 0.0 112.53 175.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -76.49 -44.22 36.27 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 -165.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.54 -44.42 69.2 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 172.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . 0.285 27.1 mtmt -72.96 -19.2 61.28 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 114.988 -2.434 . . . . 0.0 109.674 -177.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -123.9 -11.31 7.66 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 125.872 1.983 . . . . 0.0 111.812 -168.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 -103.85 -47.6 4.16 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 128.642 2.777 . . . . 0.0 109.816 176.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.21 -45.06 11.0 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 128.316 3.51 . . . . 0.0 105.448 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 76.73 -135.0 16.1 Favored Glycine 0 N--CA 1.444 -0.822 0 O-C-N 117.784 -3.072 . . . . 0.0 118.035 172.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.298 . . -78.28 36.83 0.25 Allowed 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 118.683 2.846 . . . . 0.0 118.683 -154.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.41 -15.64 2.7 Favored Glycine 0 N--CA 1.447 -0.594 1 C-N-CA 130.861 4.077 . . . . 0.0 113.626 168.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 3.9 tt -68.21 -15.45 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-O 114.091 -2.862 . . . . 0.0 116.217 -172.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -95.75 -27.32 15.31 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 127.183 2.802 . . . . 0.0 109.853 178.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.3 m -52.46 -39.98 61.74 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 124.289 3.222 . . . . 0.0 111.65 159.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . 0.483 HD12 ' CG2' ' D' ' 58' ' ' VAL 0.259 34.2 mm -71.28 -45.03 72.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 C-N-CA 125.447 1.499 . . . . 0.0 112.237 -176.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 19.5 p -86.4 -24.02 25.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 115.465 -2.207 . . . . 0.0 114.606 174.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -90.95 168.23 11.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 126.479 3.038 . . . . 0.0 106.099 177.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.11 147.33 18.52 Favored Glycine 0 N--CA 1.447 -0.585 0 CA-C-O 125.102 2.501 . . . . 0.0 107.527 172.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 5.9 m -68.15 -27.99 66.91 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 118.155 -2.968 . . . . 0.0 114.742 -154.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -128.42 33.99 4.61 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 122.786 1.279 . . . . 0.0 110.956 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 90.7 p -73.72 -177.84 2.92 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 118.16 -2.837 . . . . 0.0 111.686 170.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.6 tt -69.89 -23.88 63.32 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 117.364 -3.335 . . . . 0.0 112.725 -164.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -60.56 -17.46 46.29 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 128.802 2.841 . . . . 0.0 111.265 167.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.09 -35.62 10.75 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.062 -1.923 . . . . 0.0 110.311 175.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 56.96 80.54 0.28 Allowed Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 119.909 3.3 . . . . 0.0 119.909 -175.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . 0.559 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.413 67.2 Cg_exo 32.66 27.82 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.114 0 O-C-N 123.223 1.118 . . . . 0.0 114.399 46.197 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 47.9 t -51.17 -8.31 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 117.608 2.448 . . . . 0.0 117.608 174.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . 0.559 ' OE2' ' HA ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -117.72 -21.85 8.29 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 113.262 -1.79 . . . . 0.0 110.506 -173.195 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 40.3 tp -63.77 -53.79 45.47 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.761 -2.066 . . . . 0.0 109.657 151.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -46.1 -60.86 2.03 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 120.523 3.527 . . . . 0.0 120.523 171.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -60.41 -18.17 48.97 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 127.358 2.263 . . . . 0.0 115.03 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 59.1 t90 -88.3 -42.43 12.24 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 170.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 42.0 mt -51.62 -46.36 63.61 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 170.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -60.88 -35.08 75.71 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.797 2.839 . . . . 0.0 109.96 -170.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.61 9.31 21.69 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 127.194 2.197 . . . . 0.0 116.544 177.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . 0.438 HG11 ' CD1' ' C' ' 25' ' ' LEU . 88.6 t -125.24 -35.06 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 112.338 -2.21 . . . . 0.0 111.243 177.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 82.5 mt -97.7 -23.05 16.11 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.264 1.826 . . . . 0.0 114.376 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 60.0 mt -117.23 12.78 14.49 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 125.32 1.638 . . . . 0.0 107.021 -174.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -70.33 161.8 29.73 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 120.027 -1.67 . . . . 0.0 110.912 -174.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -62.67 -32.3 73.34 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 126.122 1.769 . . . . 0.0 111.928 -177.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 C--O 1.251 1.152 0 C-N-CA 127.823 2.449 . . . . 0.0 109.938 170.306 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 53.9 ttp . . . . . 0 N--CA 1.448 -0.535 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -38.2 90.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 126.786 2.554 . . . . 0.0 113.754 172.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -59.59 -48.42 81.73 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 115.127 -2.368 . . . . 0.0 109.112 170.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -67.48 -42.4 83.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 126.407 2.317 . . . . 0.0 110.981 -169.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 86.8 mmt-85 -66.01 -25.38 67.05 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 126.54 2.4 . . . . 0.0 114.504 175.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -82.1 -30.04 31.44 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.574 -0.704 . . . . 0.0 110.762 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -73.43 -27.97 61.72 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.813 -3.054 . . . . 0.0 112.039 169.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -63.18 -35.0 78.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 116.556 -3.84 . . . . 0.0 115.334 170.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -62.07 -53.61 53.1 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 128.151 3.834 . . . . 0.0 115.863 168.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.1 mt -67.59 -26.53 66.32 Favored 'General case' 0 N--CA 1.447 -0.609 1 O-C-N 112.933 -6.104 . . . . 0.0 116.977 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.445 HH12 ' CD ' ' B' ' 59' ' ' GLU . 67.0 ttt180 -49.33 -43.26 43.56 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 116.35 -1.786 . . . . 0.0 110.342 162.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -75.01 -23.21 58.18 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 114.954 -2.45 . . . . 0.0 115.764 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.3 t -81.65 -14.71 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 119.987 1.267 . . . . 0.0 113.177 171.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -88.88 -45.97 9.29 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 117.863 -3.023 . . . . 0.0 116.258 161.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.3 tp -54.18 -42.19 69.38 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 118.264 -2.772 . . . . 0.0 111.239 170.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.262 29.9 tp -67.12 -38.8 86.22 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.829 1.252 . . . . 0.0 114.092 175.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -67.47 -48.61 66.69 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 116.932 -1.508 . . . . 0.0 109.957 174.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.7 m-20 -59.06 -20.52 54.03 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 119.422 1.01 . . . . 0.0 113.586 174.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.29 -36.95 29.21 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -63.79 -44.58 92.94 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 119.314 -2.116 . . . . 0.0 112.538 168.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.77 -29.51 70.18 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.327 -1.797 . . . . 0.0 112.581 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -95.97 9.41 40.79 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.386 7.8 m-20 54.98 21.94 4.05 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 118.143 2.646 . . . . 0.0 118.143 -168.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.8 mt -89.47 9.15 27.53 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.27 -2.769 . . . . 0.0 107.143 172.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -55.63 -51.8 65.97 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.989 2.177 . . . . 0.0 113.587 -171.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.52 -53.36 52.47 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-O 115.84 -2.029 . . . . 0.0 114.221 177.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_exo -35.0 -53.02 0.69 Allowed 'Trans proline' 0 N--CA 1.448 -1.162 0 C-N-CA 122.563 2.175 . . . . 0.0 113.563 162.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.6 tp -74.87 -32.42 61.88 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.575 -3.203 . . . . 0.0 115.573 -171.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -63.43 -44.95 93.09 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 130.335 3.454 . . . . 0.0 114.782 171.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -60.76 -34.92 75.18 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 127.063 2.145 . . . . 0.0 108.995 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.0 tp -74.56 -42.87 58.03 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 120.517 3.525 . . . . 0.0 120.517 170.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 95.9 mmm -78.73 -21.5 47.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 114.745 -2.55 . . . . 0.0 116.857 177.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 mp -132.93 141.13 48.19 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.126 1.77 . . . . 0.0 108.041 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.3 p -80.39 153.76 74.03 Favored Pre-proline 0 N--CA 1.446 -0.628 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -55.68 -17.16 16.83 Favored 'Trans proline' 0 N--CA 1.452 -0.94 1 C-N-CA 125.594 4.196 . . . . 0.0 116.233 -173.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -76.88 -45.18 29.17 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 167.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . 0.279 42.1 mt-10 -74.7 -31.37 61.85 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 123.509 1.623 . . . . 0.0 109.997 -175.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -67.12 -54.41 21.64 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 119.361 -2.087 . . . . 0.0 115.374 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -47.75 -44.58 28.2 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.274 1.83 . . . . 0.0 112.738 163.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.81 -38.12 89.93 Favored 'General case' 0 N--CA 1.448 -0.561 1 O-C-N 114.787 -4.946 . . . . 0.0 114.962 174.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -62.77 -37.29 86.05 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 116.402 -1.761 . . . . 0.0 113.366 165.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.51 -36.83 48.27 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 119.999 2.76 . . . . 0.0 119.999 159.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.1 m -74.38 -40.62 61.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 120.996 2.398 . . . . 0.0 110.901 173.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.267 97.6 mtt180 -53.16 -36.11 60.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 67.3 t -63.18 -38.94 83.43 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 167.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.6 mtp180 -74.71 -25.74 59.35 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 114.726 -2.559 . . . . 0.0 110.759 175.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.251 63.2 mt -68.84 -51.09 48.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 115.514 -2.184 . . . . 0.0 108.857 167.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 53.9 t -62.38 -31.26 51.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 115.041 -2.409 . . . . 0.0 115.036 177.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -59.34 -55.46 34.44 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 127.454 2.971 . . . . 0.0 108.274 169.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -73.26 -14.86 61.41 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 122.658 2.481 . . . . 0.0 115.85 -178.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.9 mt -84.25 -27.38 27.95 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.318 1.847 . . . . 0.0 113.148 173.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.51 -18.37 41.78 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 117.934 -2.979 . . . . 0.0 118.336 165.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.6 ttm105 -82.22 -53.48 6.03 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 170.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.3 37.29 90.66 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 129.589 3.471 . . . . 0.0 107.727 170.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -86.32 -49.76 7.43 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 120.199 -1.765 . . . . 0.0 109.684 170.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 44.2 mtt -63.58 135.1 56.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 123.65 1.691 . . . . 0.0 109.527 165.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.2 p -99.37 -174.87 2.84 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 110.042 -3.254 . . . . 0.0 111.738 161.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -75.93 -33.49 59.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 117.359 -3.338 . . . . 0.0 109.132 -170.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.0 tpt85 -58.87 -26.97 64.74 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 131.067 3.747 . . . . 0.0 114.021 172.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -87.49 -42.93 12.42 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 120.283 -1.511 . . . . 0.0 111.971 173.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.31 -23.98 67.66 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -174.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.8 tptp -66.2 -40.1 90.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 113.958 -1.474 . . . . 0.0 110.864 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -83.64 -34.48 25.03 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 124.578 2.132 . . . . 0.0 112.456 179.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -85.25 -55.62 3.94 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.355 -2.716 . . . . 0.0 108.099 -170.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.0 mt -112.17 6.05 18.84 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 128.504 2.722 . . . . 0.0 114.343 -165.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.82 10.95 73.15 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-O 115.624 -2.765 . . . . 0.0 110.417 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.32 119.63 27.78 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 122.116 2.958 . . . . 0.0 118.312 -174.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.91 162.23 9.55 Favored Glycine 0 C--N 1.342 0.892 0 O-C-N 126.658 2.474 . . . . 0.0 118.396 159.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 52.1 mt -59.34 -45.84 92.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 131.535 3.934 . . . . 0.0 111.791 -172.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.33 -39.2 63.0 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -178.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.6 p -63.77 -41.35 97.99 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 114.785 -2.531 . . . . 0.0 117.364 169.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 31.0 mm -62.05 -37.34 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 125.931 3.968 . . . . 0.0 112.795 163.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . 0.369 54.3 m -64.67 -49.62 70.26 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.189 -2.194 . . . . 0.0 113.386 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -62.58 -53.47 54.23 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.248 -2.158 . . . . 0.0 107.653 173.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -41.75 -38.57 2.36 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 126.368 1.937 . . . . 0.0 115.609 175.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.4 m -77.03 -36.12 56.42 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 117.863 0.832 . . . . 0.0 110.274 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -68.44 -35.52 77.72 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 121.597 -0.69 . . . . 0.0 112.718 170.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 7.8 m -62.68 -38.26 89.64 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 173.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . 0.259 35.7 tp -68.28 -31.16 70.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.986 2.114 . . . . 0.0 113.926 174.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -84.35 -33.61 23.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 119.75 1.159 . . . . 0.0 112.434 171.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . 0.261 . . -71.48 -18.4 62.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 117.485 2.402 . . . . 0.0 117.485 166.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.56 136.76 92.47 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 158.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.5 153.03 79.29 Favored 'Trans proline' 0 N--CA 1.446 -1.288 0 CA-C-O 126.836 2.765 . . . . 0.0 113.831 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.5 m -61.8 -26.17 39.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-O 115.344 -2.265 . . . . 0.0 111.461 -169.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.266 22.9 pm0 -69.47 -32.45 71.37 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 123.414 2.824 . . . . 0.0 110.108 175.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 4.6 tp -76.13 -38.24 57.06 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 124.288 3.222 . . . . 0.0 113.162 173.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 56.1 mtm-85 -56.7 -37.06 70.39 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.57 1.948 . . . . 0.0 115.126 161.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -72.41 -31.19 65.32 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 121.748 2.067 . . . . 0.0 112.304 170.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -72.59 -50.07 27.92 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 115.586 -2.15 . . . . 0.0 116.24 172.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.27 -21.25 59.84 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 122.326 2.33 . . . . 0.0 110.912 -170.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -77.96 -15.39 59.02 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.691 1.996 . . . . 0.0 112.695 176.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -92.89 -33.27 14.28 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 121.854 2.116 . . . . 0.0 110.542 166.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . 0.411 47.0 t -84.16 -26.06 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-O 115.289 -2.291 . . . . 0.0 116.546 -168.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.7 mt -107.56 -3.99 18.8 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 123.692 1.71 . . . . 0.0 113.537 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 75.4 mt -133.45 8.64 3.95 Favored 'General case' 0 N--CA 1.447 -0.584 1 O-C-N 113.324 -5.86 . . . . 0.0 111.478 -156.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.6 mtpt . . . . . 0 N--CA 1.452 -0.339 0 CA-C-N 122.257 2.298 . . . . 0.0 115.668 178.952 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 122.651 1.215 . . . . 0.0 108.713 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . 0.295 42.6 mtt -65.13 -51.22 62.52 Favored 'General case' 0 N--CA 1.444 -0.751 0 O-C-N 121.523 -0.735 . . . . 0.0 111.226 176.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.59 -40.94 69.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.392 1.077 . . . . 0.0 113.834 177.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -70.74 -32.4 69.56 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 126.912 2.085 . . . . 0.0 110.68 177.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -73.93 -41.18 62.43 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 118.396 -2.69 . . . . 0.0 109.488 178.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -65.55 -42.51 91.78 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 169.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -63.8 -36.7 84.77 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 167.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -63.36 -40.74 98.09 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 117.307 -1.757 . . . . 0.0 113.476 170.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -53.17 -49.2 67.14 Favored 'General case' 0 N--CA 1.452 -0.36 1 O-C-N 115.79 -4.319 . . . . 0.0 111.617 172.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -52.64 -49.08 65.87 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 127.677 2.391 . . . . 0.0 110.631 171.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 79.4 mt -69.42 -30.32 68.23 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 116.175 -4.078 . . . . 0.0 109.677 -178.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -63.07 -26.43 68.83 Favored 'General case' 0 N--CA 1.453 -0.319 1 CA-C-N 126.057 4.026 . . . . 0.0 113.427 171.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -76.09 -46.12 30.56 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.186 1.794 . . . . 0.0 111.958 174.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 18.7 t -64.91 -37.81 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 119.941 -1.725 . . . . 0.0 106.417 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -64.36 -50.24 68.49 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.504 -1.998 . . . . 0.0 108.635 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 39.0 tp -60.67 -39.3 87.91 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 120.073 -1.642 . . . . 0.0 111.627 -174.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 23.8 tp -75.97 -35.94 59.45 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 119.449 -2.032 . . . . 0.0 112.375 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -48.36 -39.72 23.14 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 124.465 2.078 . . . . 0.0 112.988 168.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -89.06 -23.48 22.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 118.93 -2.357 . . . . 0.0 109.987 -176.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.55 -26.61 66.39 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-O 116.092 -1.909 . . . . 0.0 109.213 174.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -76.38 -30.32 57.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 127.15 2.18 . . . . 0.0 112.509 175.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -70.71 -26.25 63.32 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 165.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -105.76 -4.86 20.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 124.678 2.18 . . . . 0.0 110.897 -175.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.278 7.4 m-20 57.21 42.34 25.55 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 116.522 -3.861 . . . . 0.0 111.797 -175.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 22.9 mt -120.31 13.46 11.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.842 2.457 . . . . 0.0 112.619 174.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -65.07 -39.91 93.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 112.78 -3.486 . . . . 0.0 114.375 174.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 11.3 mt -55.04 -48.28 96.43 Favored Pre-proline 0 N--CA 1.452 -0.346 0 CA-C-N 121.899 2.136 . . . . 0.0 112.857 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.302 58.4 Cg_endo -66.77 -40.76 12.08 Favored 'Trans proline' 0 N--CA 1.445 -1.352 0 O-C-N 117.581 -1.852 . . . . 0.0 114.787 172.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' B' ' 38' ' ' LEU . 24.0 tp -52.66 -40.71 63.12 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 125.581 1.801 . . . . 0.0 109.722 174.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 68.8 mt -80.65 -36.64 32.23 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.133 -2.854 . . . . 0.0 110.335 -171.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -60.88 -42.0 97.1 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 173.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 46.4 tp -67.41 -45.11 77.11 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.866 1.266 . . . . 0.0 111.095 -175.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 14.9 mmt -75.1 -34.4 61.72 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.778 2.031 . . . . 0.0 115.415 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 33.7 mt -128.1 122.69 32.67 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 125.235 1.414 . . . . 0.0 109.218 -170.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 35.7 p -75.32 162.6 72.23 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 126.331 1.852 . . . . 0.0 114.978 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . 0.274 9.7 Cg_endo -67.8 -21.28 44.78 Favored 'Trans proline' 0 N--CA 1.446 -1.31 0 CA-C-N 125.136 2.87 . . . . 0.0 116.244 -164.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.61 -37.63 73.88 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.552 1.941 . . . . 0.0 111.543 169.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -72.62 -35.24 67.78 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 173.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 45.9 mtm-85 -66.61 -37.3 84.58 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 116.209 -1.853 . . . . 0.0 112.715 169.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.46 -46.75 87.87 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 126.3 2.25 . . . . 0.0 115.662 165.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.2 -30.11 66.0 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 116.734 -1.603 . . . . 0.0 109.307 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 17.7 mt -75.42 -28.43 59.4 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 121.238 1.836 . . . . 0.0 113.989 174.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.41 -41.47 77.47 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 125.504 1.526 . . . . 0.0 111.971 172.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 27.2 m -76.44 -37.65 56.69 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.011 -0.995 . . . . 0.0 112.119 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -58.92 -31.14 68.39 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 124.874 1.359 . . . . 0.0 108.797 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 91.9 t -59.16 -49.22 84.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 O-C-N 116.895 -3.628 . . . . 0.0 115.279 167.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -56.51 -32.92 65.53 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 116.94 -3.6 . . . . 0.0 109.432 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 62.9 mt -72.04 -44.59 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-O 115.912 -1.994 . . . . 0.0 114.746 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 54.7 t -66.88 -41.69 87.99 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 119.638 1.108 . . . . 0.0 110.439 176.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . 0.445 ' CD ' HH12 ' A' ' 21' ' ' ARG . 36.5 tt0 -52.47 -41.07 63.02 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 169.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -82.78 -25.19 33.0 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 117.579 2.437 . . . . 0.0 117.579 173.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . 0.446 HD23 ' HA ' ' B' ' 61' ' ' LEU . 14.0 mt -48.79 -44.74 39.31 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 120.332 1.424 . . . . 0.0 113.657 154.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 44.3 mt -85.73 -2.61 58.39 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 115.158 -2.353 . . . . 0.0 114.426 -178.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 ttm105 -93.34 -71.7 0.64 Allowed 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 125.634 1.834 . . . . 0.0 114.701 176.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.16 55.75 1.92 Allowed Glycine 0 CA--C 1.525 0.702 0 CA-C-N 114.3 -1.318 . . . . 0.0 113.338 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -137.83 -8.3 1.62 Allowed 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 127.656 2.382 . . . . 0.0 115.441 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 40.4 mtt -89.82 133.37 34.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 167.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -62.27 160.41 13.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 127.883 2.473 . . . . 0.0 116.287 156.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -50.52 -43.29 55.87 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.576 -1.202 . . . . 0.0 111.237 172.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -58.88 -45.4 90.31 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 126.885 2.616 . . . . 0.0 114.281 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -67.12 -46.22 74.79 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.092 2.957 . . . . 0.0 109.998 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' B' ' 71' ' ' LEU . 34.3 mt -48.77 -56.11 9.58 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.927 1.691 . . . . 0.0 109.014 171.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 34.7 tptt -66.9 -31.74 72.53 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 115.477 1.658 . . . . 0.0 115.477 -174.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -126.21 0.73 7.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 120.919 1.69 . . . . 0.0 112.914 -167.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -124.1 -6.4 7.79 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.77 1.228 . . . . 0.0 114.143 171.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 33.1 mt -127.88 -10.98 5.46 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 129.395 3.078 . . . . 0.0 117.051 165.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 79.45 11.87 84.4 Favored Glycine 0 CA--C 1.524 0.63 0 C-N-CA 126.453 1.978 . . . . 0.0 117.383 178.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.92 114.32 28.32 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 129.956 3.302 . . . . 0.0 115.038 -164.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.54 171.56 36.57 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 127.205 2.336 . . . . 0.0 111.736 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 mt -48.98 -47.2 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 131.603 3.961 . . . . 0.0 111.856 172.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.1 -55.77 16.86 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.997 -2.314 . . . . 0.0 114.211 176.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 27.2 m -46.18 -45.44 16.79 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 118.178 2.658 . . . . 0.0 118.178 165.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 18.4 mm -67.34 -45.42 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 O-C-N 116.909 -3.62 . . . . 0.0 113.896 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 5.7 m -47.75 -40.27 20.14 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 169.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -74.39 -37.74 63.33 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.853 2.461 . . . . 0.0 113.703 -176.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -72.73 -37.31 57.57 Favored Glycine 0 N--CA 1.447 -0.587 0 O-C-N 119.01 -2.306 . . . . 0.0 116.67 165.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 37.9 m -64.4 -42.06 96.32 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 119.097 -2.413 . . . . 0.0 113.834 176.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -61.8 -37.47 84.49 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 120.757 -1.214 . . . . 0.0 112.328 168.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 37.2 m -75.69 -30.2 59.27 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.913 0.863 . . . . 0.0 113.025 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.83 -44.02 94.28 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 114.917 -2.468 . . . . 0.0 113.182 164.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 61.1 mttt -51.36 -45.62 62.46 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 127.109 2.755 . . . . 0.0 111.725 169.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.81 -30.55 65.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -176.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.76 155.06 92.39 Favored Pre-proline 0 N--CA 1.45 -0.44 0 C-N-CA 128.055 2.542 . . . . 0.0 113.221 -171.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . 0.271 23.9 Cg_exo -63.38 156.28 57.1 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 O-C-N 117.184 -2.061 . . . . 0.0 116.424 176.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -61.89 -40.83 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 O-C-N 118.41 -2.682 . . . . 0.0 113.791 170.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.325 23.0 pm0 -61.02 -26.07 67.35 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 114.08 -2.867 . . . . 0.0 114.984 170.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.3 tp -84.89 -44.58 13.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 122.311 2.323 . . . . 0.0 105.597 178.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 23.2 mtm-85 -64.5 -27.13 68.76 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 116.347 -3.971 . . . . 0.0 116.696 -177.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -75.2 -33.31 61.4 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.24 0.543 . . . . 0.0 111.657 178.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -69.74 -52.56 24.29 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.976 2.11 . . . . 0.0 105.886 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.3 mt -65.07 -43.68 91.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.697 0.799 . . . . 0.0 112.043 -172.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -59.86 -36.29 76.56 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.838 0.455 . . . . 0.0 110.245 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -68.83 -46.22 69.11 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 116.226 1.936 . . . . 0.0 116.226 171.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.7 t -71.16 -57.57 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 113.905 -2.95 . . . . 0.0 112.362 174.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.84 -18.81 63.46 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 126.544 2.402 . . . . 0.0 113.616 -163.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 31.4 mt -97.09 -36.27 10.54 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 116.941 -3.599 . . . . 0.0 109.236 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -88.3 19.79 3.59 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 116.37 -3.956 . . . . 0.0 109.508 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . 0.363 69.0 m -87.94 -25.62 23.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 131.289 3.836 . . . . 0.0 114.26 160.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 . . . . . 0 C--O 1.25 1.088 0 O-C-N 116.511 -3.868 . . . . 0.0 112.132 166.991 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ttt . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.12 128.22 33.01 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 126.006 2.066 . . . . 0.0 110.668 -176.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -122.76 135.73 54.65 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 126.392 2.307 . . . . 0.0 113.277 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -120.58 156.38 31.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.078 0.951 . . . . 0.0 111.466 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -129.85 165.68 31.63 Favored Pre-proline 0 N--CA 1.45 -0.438 1 C-N-CA 132.367 4.267 . . . . 0.0 113.214 169.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -81.6 -20.57 6.73 Favored 'Trans proline' 0 N--CA 1.449 -1.107 0 N-CA-C 116.175 1.567 . . . . 0.0 116.175 -179.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -138.96 160.61 39.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.891 1.994 . . . . 0.0 108.951 170.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 28.0 t -151.58 124.45 8.58 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 129.46 3.104 . . . . 0.0 110.405 176.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.68 -26.5 61.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 124.183 1.944 . . . . 0.0 113.188 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.87 -37.42 14.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 117.424 -3.298 . . . . 0.0 117.036 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 64.3 mtt -61.2 -33.85 74.14 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 126.27 2.232 . . . . 0.0 111.167 163.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.9 -42.65 99.86 Favored 'General case' 0 N--CA 1.446 -0.664 1 O-C-N 115.61 -4.431 . . . . 0.0 115.279 168.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -75.23 -25.73 58.36 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 120.283 -1.511 . . . . 0.0 113.945 175.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -62.03 -37.17 83.92 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 120.765 -1.209 . . . . 0.0 109.48 160.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -36.6 84.64 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 119.732 -1.855 . . . . 0.0 112.92 174.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -68.61 -33.31 73.83 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 124.302 2.001 . . . . 0.0 116.327 174.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -77.35 -24.12 50.77 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 129.918 3.287 . . . . 0.0 117.038 173.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -70.52 -36.56 73.81 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 125.092 2.377 . . . . 0.0 112.611 161.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 9.4 t-105 -63.45 -58.3 7.48 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 118.555 -2.59 . . . . 0.0 112.628 167.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 20.9 mt -56.63 -29.21 61.96 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 124.573 3.351 . . . . 0.0 109.772 -176.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -82.94 -23.92 33.26 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 122.007 2.185 . . . . 0.0 113.238 -177.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -62.6 -40.31 96.52 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 114.482 -2.675 . . . . 0.0 110.294 162.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.37 -49.94 67.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 116.002 -1.951 . . . . 0.0 110.202 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -60.52 -39.65 88.6 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 122.411 2.368 . . . . 0.0 115.902 176.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 63.7 tp -65.1 -41.63 94.78 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 127.291 2.236 . . . . 0.0 107.556 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 12.0 tp -74.1 -43.77 56.4 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 122.545 1.164 . . . . 0.0 111.682 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -57.09 -28.93 63.07 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 164.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . 0.277 91.7 m-20 -79.02 -24.1 43.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 129.364 3.066 . . . . 0.0 113.812 176.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.24 -6.21 54.25 Favored 'General case' 0 N--CA 1.448 -0.555 1 O-C-N 115.607 -4.433 . . . . 0.0 112.018 176.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -76.09 -21.93 56.16 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.533 171.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -65.08 -23.92 67.3 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 120.287 -1.508 . . . . 0.0 111.342 177.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -138.43 7.73 2.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 119.817 -1.802 . . . . 0.0 113.107 -163.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 50.8 28.16 3.49 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.684 2.476 . . . . 0.0 117.684 -168.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 50.1 mt -88.86 19.12 4.25 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 118.873 0.76 . . . . 0.0 110.302 164.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -64.94 -46.33 82.04 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 119.243 -2.161 . . . . 0.0 115.43 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.333 71.6 mt -68.86 -41.93 22.01 Favored Pre-proline 0 N--CA 1.452 -0.358 0 C-N-CA 127.685 2.394 . . . . 0.0 113.936 169.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_exo -58.93 -48.83 13.0 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 C-N-CA 121.668 1.579 . . . . 0.0 115.569 170.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 66.3 tp -53.86 -45.56 71.02 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 118.132 -2.855 . . . . 0.0 115.05 167.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 20.5 mt -68.24 -26.42 65.68 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 118.938 -1.105 . . . . 0.0 112.986 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -77.85 -39.13 44.48 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 127.782 2.433 . . . . 0.0 108.159 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 38.7 tp -56.71 -48.03 78.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 125.217 2.437 . . . . 0.0 111.835 167.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 7.8 mmt -84.03 -15.48 47.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 112.194 -3.765 . . . . 0.0 113.721 -167.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mp -135.34 157.53 46.66 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 126.724 2.515 . . . . 0.0 114.662 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 34.7 p -76.44 151.78 83.28 Favored Pre-proline 0 N--CA 1.448 -0.555 0 CA-C-O 114.023 -2.894 . . . . 0.0 111.32 161.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -63.46 -27.23 70.45 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 CA-C-N 123.797 2.392 . . . . 0.0 112.177 179.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.05 -44.0 74.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 115.713 -2.089 . . . . 0.0 110.922 170.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -71.13 -28.57 64.39 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 116.465 -1.731 . . . . 0.0 110.754 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . 0.401 ' HD2' ' CZ2' ' D' ' 19' ' ' TRP . 88.1 mtm-85 -71.61 -46.49 59.02 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 121.722 2.056 . . . . 0.0 109.267 176.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.15 -30.71 71.81 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.851 -1.78 . . . . 0.0 114.237 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.31 -50.4 63.75 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.786 2.434 . . . . 0.0 110.095 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . 0.493 HD13 ' CE1' ' D' ' 22' ' ' PHE . 9.2 mt -65.81 -40.28 91.72 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 122.147 2.249 . . . . 0.0 108.676 -179.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.9 -38.57 94.29 Favored Glycine 0 C--N 1.337 0.605 0 O-C-N 117.186 -3.446 . . . . 0.0 115.706 171.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 20.8 m -66.65 -38.69 87.39 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 114.341 -2.742 . . . . 0.0 110.59 169.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -61.71 -29.91 70.42 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 121.109 1.777 . . . . 0.0 112.642 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 91.2 t -69.5 -43.07 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 123.113 2.688 . . . . 0.0 108.812 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -70.15 -28.8 65.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 113.144 -3.312 . . . . 0.0 113.065 174.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 9.4 mt -56.31 -57.61 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 124.852 3.478 . . . . 0.0 112.168 157.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 57.5 t -57.11 -40.48 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 CA-C-O 117.17 -1.395 . . . . 0.0 111.429 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -61.4 -45.82 92.72 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.719 2.008 . . . . 0.0 106.166 178.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -68.28 -32.96 73.5 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 120.309 1.413 . . . . 0.0 111.453 -176.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 22.4 mt -76.58 -22.89 53.64 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 124.564 1.146 . . . . 0.0 109.359 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 80.7 mt -80.17 -44.18 20.28 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 117.509 -3.244 . . . . 0.0 113.713 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttm105 -57.0 -39.26 74.35 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.492 2.317 . . . . 0.0 115.664 170.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 57.77 26.83 58.26 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 126.81 2.148 . . . . 0.0 117.269 171.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -97.07 -7.37 32.96 Favored 'General case' 0 N--CA 1.449 -0.495 1 CA-C-O 111.474 -4.108 . . . . 0.0 108.569 170.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 50.6 mtt -69.55 147.68 50.45 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 125.864 3.938 . . . . 0.0 116.621 167.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 88.6 p -106.8 168.2 9.35 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.352 1.461 . . . . 0.0 107.706 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -46.53 -30.15 2.1 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 176.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 29.9 ttp-105 -59.01 -55.01 40.62 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 126.22 2.2 . . . . 0.0 113.686 176.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . 0.319 1.7 mt-10 -70.27 -40.66 74.24 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 -174.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 22.5 mt -53.43 -35.63 60.65 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 119.073 -2.267 . . . . 0.0 112.469 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -91.32 -30.68 16.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.895 2.078 . . . . 0.0 112.747 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -97.83 -59.17 1.82 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 119.514 1.052 . . . . 0.0 111.22 -171.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -70.31 -42.18 72.32 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 116.559 -2.056 . . . . 0.0 113.804 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mp -90.0 -15.42 31.93 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 127.629 2.371 . . . . 0.0 112.427 -172.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 60.93 -105.47 0.86 Allowed Glycine 0 N--CA 1.448 -0.535 0 CA-C-O 116.711 -2.161 . . . . 0.0 116.753 168.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.24 -17.44 2.68 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 129.887 3.275 . . . . 0.0 112.839 -169.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.54 -13.82 71.62 Favored Glycine 0 N--CA 1.45 -0.399 0 O-C-N 118.177 -2.827 . . . . 0.0 114.236 172.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 3.9 tt -56.48 -39.86 64.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 CA-C-N 114.765 -0.718 . . . . 0.0 109.949 174.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.1 -12.77 59.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 126.916 3.246 . . . . 0.0 112.585 -170.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 11.0 m -69.69 -46.45 66.0 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 116.927 -3.608 . . . . 0.0 107.191 166.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 46.4 mm -66.96 -40.18 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 N-CA-C 116.781 2.141 . . . . 0.0 116.781 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 40.5 p -100.69 -17.77 16.83 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -167.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 60.4 mtp85 -103.62 161.51 13.84 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 114.819 -2.515 . . . . 0.0 115.288 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.33 158.51 30.0 Favored Glycine 0 CA--C 1.524 0.618 0 O-C-N 126.053 2.095 . . . . 0.0 117.838 -177.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 88.9 p -63.85 4.83 0.26 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 118.135 2.642 . . . . 0.0 118.135 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -115.78 -5.25 12.09 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 3.2 p -68.21 177.12 2.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.287 1.835 . . . . 0.0 113.233 -154.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 15.3 tp -58.05 -26.49 62.55 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 116.272 -1.823 . . . . 0.0 111.703 -167.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -106.14 7.63 31.75 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 113.933 -2.937 . . . . 0.0 111.73 176.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -111.91 -5.74 14.32 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 129.976 3.31 . . . . 0.0 113.353 167.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.79 151.09 89.78 Favored Pre-proline 0 N--CA 1.452 -0.334 0 C-N-CA 127.076 2.15 . . . . 0.0 115.449 171.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -55.69 139.02 82.82 Favored 'Trans proline' 0 N--CA 1.448 -1.193 0 CA-C-N 120.324 1.151 . . . . 0.0 112.238 174.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 99.0 t -72.22 -30.94 37.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 124.714 1.206 . . . . 0.0 108.266 -166.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -60.75 -19.7 59.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.956 2.947 . . . . 0.0 118.956 161.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 43.8 tp -84.02 -47.25 11.15 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.322 -0.861 . . . . 0.0 109.53 168.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 76.8 mtp180 -56.85 -49.9 74.06 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 115.894 -2.003 . . . . 0.0 109.812 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -53.09 -50.61 64.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.026 1.73 . . . . 0.0 109.294 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 61.0 t90 -75.1 -33.21 61.6 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.817 1.247 . . . . 0.0 112.271 -165.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 82.3 mt -63.49 -26.07 68.55 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 116.635 -3.791 . . . . 0.0 114.657 166.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -72.97 -27.39 61.79 Favored 'General case' 0 N--CA 1.45 -0.436 1 O-C-N 114.549 -5.094 . . . . 0.0 108.041 169.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -80.3 -24.17 40.18 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . 0.317 99.5 t -97.95 -28.18 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 124.73 3.423 . . . . 0.0 116.382 177.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 18.6 mt -110.52 -29.05 8.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.268 1.827 . . . . 0.0 112.973 -172.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 71.3 mt -121.0 30.54 6.81 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 41.4 pttt . . . . . 0 N--CA 1.45 -0.456 0 C-N-CA 126.578 1.951 . . . . 0.0 113.168 162.856 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . 0.448 ' HB2' ' HD2' ' D' ' 6' ' ' PRO . 90.9 p . . . . . 0 N--CA 1.45 -0.439 0 CA-C-O 116.618 -1.658 . . . . 0.0 110.17 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . 0.448 ' HD2' ' HB2' ' D' ' 5' ' ' SER . 37.5 Cg_endo -79.92 -44.03 0.12 Allowed 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 124.652 3.568 . . . . 0.0 112.112 155.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -152.66 140.24 19.79 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 155.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 36.0 t -67.13 121.22 15.14 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 109.805 -3.361 . . . . 0.0 110.849 -173.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . 0.263 . . -56.97 -21.26 28.98 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 117.711 -1.138 . . . . 0.0 110.659 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.5 -29.18 17.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.889 2.476 . . . . 0.0 113.556 -172.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.3 21.7 mmt -64.95 -37.48 87.79 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.888 -0.577 . . . . 0.0 112.189 158.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.81 -35.14 80.15 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 117.147 2.277 . . . . 0.0 117.147 173.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -60.73 -58.25 9.25 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.957 -2.965 . . . . 0.0 108.233 159.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -47.3 -38.38 12.52 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 117.907 -2.995 . . . . 0.0 118.815 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.39 5.8 49.23 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 131.408 3.883 . . . . 0.0 115.074 -173.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -104.93 -22.62 13.11 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 117.046 -1.454 . . . . 0.0 107.949 146.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -77.29 -34.08 55.61 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 123.23 2.741 . . . . 0.0 112.294 -176.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -66.5 -15.3 63.27 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 171.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . 0.401 ' CZ2' ' HD2' ' C' ' 48' ' ' ARG . 28.6 t-105 -82.96 -37.18 24.45 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 167.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.17 -15.34 62.93 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 114.501 -2.666 . . . . 0.0 111.095 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -65.15 -49.58 69.32 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 114.012 -2.899 . . . . 0.0 105.714 164.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . 0.493 ' CE1' HD13 ' C' ' 51' ' ' LEU . 74.4 t80 -70.05 -38.76 75.89 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 122.177 2.262 . . . . 0.0 111.207 -172.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 20.7 t -66.19 -34.84 72.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 C-N-CA 128.317 2.647 . . . . 0.0 111.032 171.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -75.31 -37.83 60.6 Favored 'General case' 0 N--CA 1.448 -0.539 1 O-C-N 115.302 -4.624 . . . . 0.0 115.46 167.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 tp -69.09 -33.07 72.94 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 24.8 tp -73.85 -46.07 47.24 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 121.426 -0.796 . . . . 0.0 110.066 -177.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -58.03 -46.05 85.94 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 126.222 1.809 . . . . 0.0 112.097 172.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -52.35 -30.44 28.63 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 166.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 -29.24 30.87 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.436 1.094 . . . . 0.0 113.369 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -50.54 -40.57 52.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 125.264 2.459 . . . . 0.0 111.246 167.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -75.44 -30.18 59.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 118.834 -2.416 . . . . 0.0 113.744 -158.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 53.3 p-10 -111.18 14.17 21.79 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 128.922 3.889 . . . . 0.0 118.448 168.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 52.89 54.82 9.88 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 14.9 mt -121.33 5.42 10.22 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 129.305 3.042 . . . . 0.0 110.749 171.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -61.89 2.26 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 116.428 -1.748 . . . . 0.0 112.071 174.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 4.2 mt -52.15 -45.74 93.8 Favored Pre-proline 0 N--CA 1.45 -0.445 0 CA-C-O 115.183 -2.342 . . . . 0.0 115.22 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.24 -20.55 14.39 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 114.714 -3.057 . . . . 0.0 114.159 172.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 12.0 tp -68.01 -35.73 78.78 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 124.126 3.148 . . . . 0.0 113.18 169.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 24.3 mt -71.05 -36.37 72.29 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 123.227 1.489 . . . . 0.0 107.15 -175.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 35.3 m-20 -78.58 -26.99 45.6 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.863 1.792 . . . . 0.0 112.688 -175.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -68.02 -48.45 65.65 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.143 166.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 65.1 mmm -65.47 -34.63 78.74 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 114.892 -2.48 . . . . 0.0 114.858 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -115.16 144.76 43.18 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 122.231 2.287 . . . . 0.0 116.798 -172.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 70.1 p -67.62 148.78 98.54 Favored Pre-proline 0 N--CA 1.452 -0.37 0 O-C-N 117.161 -3.462 . . . . 0.0 110.035 167.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -35.79 -54.15 0.81 Allowed 'Trans proline' 0 N--CA 1.451 -1.009 1 C-N-CA 127.072 5.181 . . . . 0.0 113.438 171.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -71.37 -9.63 58.47 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 -178.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . 0.251 38.8 mt-10 -86.43 -41.63 14.28 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 120.398 -1.439 . . . . 0.0 112.321 163.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -59.88 -36.5 77.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 125.216 2.436 . . . . 0.0 114.455 172.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -74.43 -40.19 62.12 Favored 'General case' 0 N--CA 1.451 -0.412 1 C-N-CA 134.76 5.224 . . . . 0.0 108.404 -175.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.28 -41.4 63.65 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 116.605 -3.809 . . . . 0.0 112.736 171.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 50.8 mt -59.65 -44.87 93.38 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 119.833 -1.792 . . . . 0.0 107.904 178.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.22 -33.38 85.77 Favored Glycine 0 CA--C 1.523 0.576 0 C-N-CA 118.563 -1.78 . . . . 0.0 114.884 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 97.6 m -78.96 -24.03 44.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 119.577 -2.131 . . . . 0.0 111.156 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 27.0 mtt180 -75.26 -20.67 59.05 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 117.579 -1.649 . . . . 0.0 113.105 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 99.3 t -49.56 -61.02 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 114.731 -2.556 . . . . 0.0 115.763 159.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -65.27 -26.07 67.92 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 126.187 2.179 . . . . 0.0 113.515 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . 0.404 HG12 ' HB3' ' D' ' 75' ' ' LEU . 36.5 mt -67.51 -52.09 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 129.711 3.204 . . . . 0.0 107.831 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 55.0 t -54.49 -39.62 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 125.984 1.714 . . . . 0.0 115.618 165.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -58.1 -60.73 3.28 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 122.98 1.371 . . . . 0.0 114.005 176.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -57.24 -37.86 72.93 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 128.725 2.81 . . . . 0.0 110.525 176.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 7.2 mt -61.06 -41.34 96.44 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 115.857 -2.337 . . . . 0.0 114.262 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 31.5 mt -67.84 -40.62 83.68 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.521 2.328 . . . . 0.0 110.91 170.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -63.9 -42.6 97.39 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 115.214 1.561 . . . . 0.0 115.214 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 52.0 61.2 6.73 Favored Glycine 0 CA--C 1.521 0.443 0 O-C-N 116.841 -3.662 . . . . 0.0 116.019 -173.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -139.31 -37.63 0.5 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 121.005 2.402 . . . . 0.0 106.972 -174.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 49.1 mtt -93.08 52.68 1.84 Allowed 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 118.9 -2.375 . . . . 0.0 113.724 159.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 31.1 p -95.01 -174.85 3.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 121.405 3.854 . . . . 0.0 121.405 -172.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.25 4.4 tp-100 56.3 -76.24 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 129.101 2.96 . . . . 0.0 115.431 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 49.8 ttt85 -88.25 -34.95 17.56 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 121.565 1.984 . . . . 0.0 114.137 169.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -74.67 -51.84 13.27 Favored 'General case' 0 N--CA 1.446 -0.674 0 O-C-N 118.829 -2.419 . . . . 0.0 116.504 -157.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -35.66 -47.97 0.5 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.517 1.127 . . . . 0.0 112.757 161.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -68.91 -27.24 65.59 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 116.948 2.203 . . . . 0.0 116.948 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -105.32 -31.73 8.93 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 124.796 2.236 . . . . 0.0 112.823 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -87.67 -36.45 17.43 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.537 2.051 . . . . 0.0 116.537 -172.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . 0.404 ' HB3' HG12 ' D' ' 57' ' ' ILE . 0.8 OUTLIER -110.19 -36.31 5.86 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.714 2.006 . . . . 0.0 108.638 175.977 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 59.61 -113.01 4.81 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 118.885 2.314 . . . . 0.0 118.885 167.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.57 2.91 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 120.94 3.681 . . . . 0.0 120.94 -159.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -110.94 -7.2 25.56 Favored Glycine 0 CA--C 1.526 0.774 0 O-C-N 119.736 -1.852 . . . . 0.0 111.512 170.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 4.9 tt -73.91 -19.43 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 118.839 -2.566 . . . . 0.0 114.3 -166.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -97.34 -11.85 23.53 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 119.589 1.086 . . . . 0.0 109.466 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.2 m -79.54 -55.43 5.05 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 106.376 -1.712 . . . . 0.0 106.376 161.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.327 20.4 mm -58.18 -26.98 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 118.141 -2.849 . . . . 0.0 114.599 176.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 30.9 p -111.08 8.55 21.85 Favored 'General case' 0 N--CA 1.451 -0.401 1 N-CA-C 123.34 4.57 . . . . 0.0 123.34 177.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -112.03 -144.58 0.39 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 114.915 -2.469 . . . . 0.0 106.519 164.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 75.77 155.3 5.38 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-N 122.959 2.618 . . . . 0.0 109.757 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 94.1 p -71.66 -30.8 66.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 176.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -138.9 43.16 2.09 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 -167.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 96.6 p -84.14 -179.32 7.2 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 124.074 1.892 . . . . 0.0 112.053 173.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.267 1.6 mp -69.46 -9.0 51.81 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 112.665 -2.061 . . . . 0.0 114.676 175.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 22.6 tttt -71.81 -16.44 62.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 115.618 1.711 . . . . 0.0 115.618 155.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -101.08 -41.88 6.59 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 120.057 -1.652 . . . . 0.0 109.515 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . 0.493 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 59.62 91.66 0.07 OUTLIER Pre-proline 0 N--CA 1.452 -0.345 0 CA-C-N 120.695 1.589 . . . . 0.0 109.997 -174.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . 0.493 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.285 97.9 Cg_exo 37.4 35.72 0.0 OUTLIER 'Cis proline' 0 N--CA 1.448 -1.161 0 N-CA-C 116.756 1.791 . . . . 0.0 116.756 29.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . 0.481 HG22 ' HB1' ' D' ' 92' ' ' ALA . 61.1 t -66.76 -18.22 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 C-N-CA 128.327 2.651 . . . . 0.0 111.324 -172.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.55 -28.11 9.06 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -166.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 36.9 tp -57.69 -46.06 84.81 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 120.531 -1.356 . . . . 0.0 110.884 151.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -67.5 -49.24 64.34 Favored 'General case' 0 N--CA 1.451 -0.408 1 O-C-N 116.135 -4.103 . . . . 0.0 112.184 -175.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -61.0 -2.61 0.61 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 114.383 -2.722 . . . . 0.0 111.811 172.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -103.87 -54.18 2.61 Favored 'General case' 0 N--CA 1.45 -0.438 1 CA-C-N 127.74 4.791 . . . . 0.0 110.888 171.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 92.1 mt -48.81 -42.56 36.46 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.8 1.24 . . . . 0.0 107.657 174.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -66.99 -35.54 80.17 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.574 -0.704 . . . . 0.0 112.372 -173.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -80.51 -24.35 39.46 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 120.612 1.551 . . . . 0.0 109.136 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 78.1 t -100.88 -15.2 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 123.908 3.049 . . . . 0.0 107.626 -168.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 83.9 mt -112.9 -16.22 12.74 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 121.487 1.949 . . . . 0.0 112.463 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.353 25.1 mt -98.4 16.34 21.96 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 171.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 15.6 pttp -77.77 161.52 27.62 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.741 2.016 . . . . 0.0 114.131 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 5.4 m -80.74 -9.66 59.79 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 117.893 -3.005 . . . . 0.0 117.797 -164.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-N 121.851 2.114 . . . . 0.0 112.913 -176.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 56.6 ttp . . . . . 0 N--CA 1.448 -0.549 0 CA-C-O 121.197 0.523 . . . . 0.0 109.863 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.97 -49.81 76.46 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 117.08 -3.513 . . . . 0.0 114.959 168.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -54.31 -43.13 70.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 122.711 1.243 . . . . 0.0 112.452 173.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -55.42 -53.11 60.33 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 122.78 1.276 . . . . 0.0 112.313 174.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -69.94 -40.57 75.42 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 116.576 -1.678 . . . . 0.0 109.372 -175.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -47.8 -33.35 7.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 125.768 2.699 . . . . 0.0 116.067 171.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . 0.309 2.6 mp0 -73.55 -31.7 63.79 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 117.772 -3.08 . . . . 0.0 113.008 173.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -76.08 -19.8 58.26 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 119.401 -2.062 . . . . 0.0 110.014 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.47 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG 0.34 38.7 t-105 -71.18 -50.06 37.22 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.184 2.994 . . . . 0.0 114.981 166.304 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.54 -27.38 68.58 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.027 1.731 . . . . 0.0 114.514 173.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -75.05 -35.06 61.91 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 116.566 2.061 . . . . 0.0 116.566 165.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.38 -50.27 70.15 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 119.883 1.219 . . . . 0.0 112.806 161.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.4 t -76.96 -25.58 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 CA-C-O 115.414 -2.232 . . . . 0.0 113.811 -173.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -61.02 -55.74 29.21 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 115.405 -2.236 . . . . 0.0 114.893 155.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 48.9 tp -56.18 -37.43 69.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 121.011 1.732 . . . . 0.0 113.154 -173.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 23.4 tp -68.23 -46.84 69.43 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 110.082 -3.235 . . . . 0.0 114.411 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -60.88 -42.47 97.99 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 118.569 -2.582 . . . . 0.0 112.023 174.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.89 -32.23 71.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 126.221 2.201 . . . . 0.0 111.996 173.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.505 ' HB2' HD22 ' A' ' 38' ' ' LEU . . . -66.88 -36.68 82.84 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 111.883 -3.913 . . . . 0.0 108.971 171.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -62.64 -34.05 76.26 Favored 'General case' 0 N--CA 1.448 -0.547 1 CA-C-N 130.116 5.871 . . . . 0.0 115.328 168.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.328 77.1 mt-30 -64.6 -21.2 66.65 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 116.972 2.212 . . . . 0.0 116.972 170.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -109.02 10.57 26.17 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 124.701 1.25 . . . . 0.0 108.623 173.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 52.66 27.21 5.0 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 116.737 -3.727 . . . . 0.0 118.265 -168.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.2 mt -102.54 6.69 40.03 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 117.491 -3.255 . . . . 0.0 112.004 -172.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -72.22 -30.59 65.07 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.561 1.544 . . . . 0.0 110.755 -158.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 56.4 mt -63.6 -59.23 12.28 Favored Pre-proline 0 N--CA 1.451 -0.396 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 167.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -49.96 -33.91 35.67 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 CA-C-N 124.994 2.819 . . . . 0.0 113.454 170.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.505 HD22 ' HB2' ' A' ' 29' ' ' ALA . 13.3 tp -64.44 -52.08 59.87 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 122.281 2.31 . . . . 0.0 116.097 174.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.3 mt -60.68 -35.09 75.41 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.13 1.772 . . . . 0.0 114.78 168.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 -73.87 -30.75 62.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 121.801 2.091 . . . . 0.0 108.02 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.275 19.6 tp -78.36 -36.93 45.41 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 116.78 -3.7 . . . . 0.0 111.272 176.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 62.1 mmm -70.68 -20.28 62.7 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 118.279 2.696 . . . . 0.0 118.279 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.426 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 10.5 mt -137.32 125.15 22.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 130.342 3.457 . . . . 0.0 114.278 178.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 66.8 p -67.16 152.19 96.35 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-O 114.715 -2.564 . . . . 0.0 108.855 175.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -59.32 -26.83 83.24 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 N-CA-C 119.163 2.717 . . . . 0.0 119.163 -159.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -63.59 -44.55 93.67 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 125.645 1.84 . . . . 0.0 108.143 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 21.9 mt-10 -59.13 -44.9 92.06 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 131.673 3.989 . . . . 0.0 114.353 177.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.6 mtm180 -65.48 -54.67 25.02 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.889 3.276 . . . . 0.0 113.266 172.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -47.42 -36.32 9.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 165.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.12 -38.74 79.05 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 118.595 -2.565 . . . . 0.0 114.057 169.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.9 mt -66.7 -32.49 73.84 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 116.672 -1.632 . . . . 0.0 107.076 178.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.93 -50.74 62.67 Favored Glycine 0 CA--C 1.523 0.57 0 CA-C-N 120.287 1.403 . . . . 0.0 110.986 166.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.5 m -60.74 -33.85 73.53 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 120.723 2.261 . . . . 0.0 110.804 -175.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -73.18 -25.95 60.99 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 120.926 1.694 . . . . 0.0 109.092 -170.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 85.8 t -58.49 -43.4 86.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 C-N-CA 124.695 1.198 . . . . 0.0 112.44 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 -67.16 -43.21 82.83 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 129.271 3.028 . . . . 0.0 112.227 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 81.8 mt -54.11 -54.64 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 125.114 1.509 . . . . 0.0 111.09 165.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.7 t -66.1 -26.2 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 120.729 1.604 . . . . 0.0 112.263 176.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . 0.25 11.0 tt0 -63.67 -53.39 52.07 Favored 'General case' 0 N--CA 1.446 -0.652 1 O-C-N 116.066 -4.146 . . . . 0.0 111.396 170.095 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -75.63 -23.05 56.33 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 117.17 -3.456 . . . . 0.0 113.02 -175.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 80.3 mt -76.31 -34.88 59.04 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 119.011 -2.306 . . . . 0.0 112.224 165.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 63.2 mt -73.55 -50.12 22.95 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 116.792 -3.693 . . . . 0.0 113.105 173.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.7 ttm180 -43.05 -41.54 3.54 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 116.532 -3.855 . . . . 0.0 115.424 161.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 59.11 29.71 65.91 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 120.278 2.871 . . . . 0.0 120.278 172.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -95.75 -43.13 8.02 Favored 'General case' 0 N--CA 1.444 -0.725 1 C-N-CA 131.746 4.019 . . . . 0.0 114.505 175.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 40.8 mtt -69.48 130.54 42.78 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 168.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.7 p -78.73 172.19 14.08 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.933 2.093 . . . . 0.0 113.074 158.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -50.54 -44.4 56.44 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 128.106 2.562 . . . . 0.0 113.995 171.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -61.9 -27.1 68.57 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 118.935 -2.353 . . . . 0.0 115.517 177.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -84.26 -54.64 4.66 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 126.994 2.118 . . . . 0.0 111.788 -178.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.5 mt -46.74 -29.71 2.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 119.127 3.01 . . . . 0.0 119.127 164.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -72.86 -18.4 61.44 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.795 2.038 . . . . 0.0 114.53 173.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -91.99 -74.27 0.52 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.106 2.162 . . . . 0.0 110.628 160.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -66.22 -21.78 66.32 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 127.105 2.753 . . . . 0.0 112.238 -151.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 13.0 mt -120.07 -26.79 5.46 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 120.254 -1.529 . . . . 0.0 108.425 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.51 15.47 27.24 Favored Glycine 0 CA--C 1.526 0.774 0 C-N-CA 126.137 1.827 . . . . 0.0 115.993 170.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.52 126.79 35.12 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 126.248 1.793 . . . . 0.0 113.784 -164.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.21 157.16 49.63 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-O 122.079 0.821 . . . . 0.0 113.927 175.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.4 mt -57.09 -48.79 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.52 -33.42 66.04 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 117.561 -1.209 . . . . 0.0 113.562 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.6 p -67.64 -44.35 78.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 122.005 0.907 . . . . 0.0 111.091 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.3 mm -70.94 -33.79 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.276 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 15.0 m -56.14 -61.79 2.15 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 118.487 -2.633 . . . . 0.0 113.661 165.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -58.02 -36.49 72.78 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 130.673 3.589 . . . . 0.0 114.013 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.59 -36.76 32.56 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-O 115.008 -3.107 . . . . 0.0 108.172 -177.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 68.8 m -63.56 -52.97 58.76 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 119.368 1.584 . . . . 0.0 113.373 168.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -57.11 -31.52 65.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.754 -1.593 . . . . 0.0 110.285 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.7 m -77.06 -25.8 52.83 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 124.865 3.484 . . . . 0.0 113.479 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 29.3 tp -82.62 -42.43 18.24 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 119.222 3.045 . . . . 0.0 119.222 174.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -59.38 -39.88 84.73 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 125.179 1.391 . . . . 0.0 111.335 162.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.11 -35.77 78.67 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 117.283 -1.767 . . . . 0.0 113.762 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -50.47 142.59 15.04 Favored Pre-proline 0 N--CA 1.448 -0.532 0 CA-C-O 116.597 -1.668 . . . . 0.0 113.573 175.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.7 145.32 36.7 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 CA-C-N 121.472 1.561 . . . . 0.0 111.624 -168.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 m -57.26 -32.25 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -168.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -55.42 -36.03 66.03 Favored 'General case' 0 N--CA 1.445 -0.723 1 O-C-N 113.409 -5.807 . . . . 0.0 114.79 174.059 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 33.5 tp -67.31 -39.31 85.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 114.268 -2.777 . . . . 0.0 115.373 169.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 87.1 mtm-85 -66.82 -43.12 84.62 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 125.375 1.672 . . . . 0.0 110.467 168.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -61.63 -28.3 69.27 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 125.171 1.544 . . . . 0.0 108.7 -176.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 22.1 t90 -75.14 -61.74 1.79 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 170.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 92.1 mt -51.35 -38.47 53.35 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -58.25 -31.0 66.99 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 120.94 -1.1 . . . . 0.0 112.764 172.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -83.54 -19.28 35.95 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 120.144 -1.597 . . . . 0.0 114.743 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 21.2 t -95.81 -55.39 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 1 C-N-CA 133.105 4.562 . . . . 0.0 111.1 -176.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.6 mt -89.32 -15.56 33.15 Favored 'General case' 0 N--CA 1.448 -0.533 1 O-C-N 115.35 -4.594 . . . . 0.0 110.433 -171.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 59.4 mt -116.5 4.58 13.29 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 122.829 2.559 . . . . 0.0 113.634 -172.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mttp . . . . . 0 N--CA 1.451 -0.392 0 O-C-N 123.874 0.734 . . . . 0.0 112.886 179.142 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.709 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 51.7 mtt -69.39 -38.52 78.02 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 116.319 -1.801 . . . . 0.0 108.776 168.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.11 -41.38 98.17 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 124.126 3.148 . . . . 0.0 109.787 -173.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -71.98 -26.18 62.15 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 119.867 -1.771 . . . . 0.0 113.96 173.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -73.94 -36.27 64.62 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 117.974 -2.954 . . . . 0.0 112.135 169.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -72.43 -34.33 67.73 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 116.433 -1.746 . . . . 0.0 112.775 177.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 69.1 t60 -62.15 -46.14 90.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 127.862 3.226 . . . . 0.0 109.512 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -64.58 -35.19 80.2 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 117.374 -3.329 . . . . 0.0 115.805 168.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -70.06 -22.54 63.06 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 119.706 -1.872 . . . . 0.0 111.887 176.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -85.16 -47.69 9.88 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 128.361 2.664 . . . . 0.0 106.936 174.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . 0.253 45.5 mt -49.98 -24.57 2.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 118.12 2.637 . . . . 0.0 118.12 174.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 50.9 ttt180 -68.19 -33.63 74.8 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.938 -2.351 . . . . 0.0 112.196 173.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -66.28 -43.47 86.3 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 127.142 2.177 . . . . 0.0 110.971 176.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 38.6 t -58.97 -38.69 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 129.988 3.315 . . . . 0.0 115.545 173.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -71.44 -41.9 68.89 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 113.249 -1.796 . . . . 0.0 113.696 166.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 48.5 tp -60.38 -36.31 77.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 173.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.328 55.2 tp -80.77 -37.15 30.86 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 115.537 -2.173 . . . . 0.0 111.229 178.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -56.91 -44.41 82.37 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 116.491 -2.084 . . . . 0.0 114.398 167.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 50.6 m-20 -73.45 -26.49 60.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 120.19 1.359 . . . . 0.0 111.929 -172.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.86 -36.21 62.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.494 1.918 . . . . 0.0 114.939 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -60.79 -33.75 73.46 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 116.21 -1.853 . . . . 0.0 114.813 159.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -67.55 -29.22 68.54 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 122.529 2.422 . . . . 0.0 112.221 171.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -96.8 -0.1 48.53 Favored 'General case' 0 N--CA 1.447 -0.599 1 CA-C-O 111.465 -4.112 . . . . 0.0 110.174 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.46 0.4 OUTLIER 57.92 14.09 2.43 Favored 'General case' 0 N--CA 1.445 -0.683 1 C-N-CA 131.94 4.096 . . . . 0.0 117.163 -178.438 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' B' ' 34' ' ' LEU . 20.5 mt -88.96 22.08 2.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 129.115 2.966 . . . . 0.0 109.722 -177.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -88.39 -20.61 25.04 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 117.456 2.391 . . . . 0.0 117.456 -157.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 23.5 mt -73.2 -56.62 3.2 Favored Pre-proline 0 N--CA 1.449 -0.497 0 CA-C-N 112.089 -2.323 . . . . 0.0 111.747 170.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -62.62 -27.96 76.68 Favored 'Trans proline' 0 N--CA 1.448 -1.15 1 C-N-CA 125.698 4.265 . . . . 0.0 112.814 178.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 41.9 tp -73.35 -37.66 65.99 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.849 1.968 . . . . 0.0 106.903 -178.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 80.7 mt -70.84 -38.69 73.2 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 125.522 2.582 . . . . 0.0 112.189 175.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -57.39 -29.31 63.97 Favored 'General case' 0 N--CA 1.449 -0.5 1 O-C-N 114.531 -5.105 . . . . 0.0 113.578 165.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 45.0 tp -78.5 -48.02 16.16 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 117.283 -3.386 . . . . 0.0 111.904 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 11.4 mmt -82.89 -11.23 58.37 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -167.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 1.1 mp -140.61 128.32 21.65 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.287 1.835 . . . . 0.0 112.354 -169.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 66.8 p -80.19 160.63 67.72 Favored Pre-proline 0 N--CA 1.449 -0.48 0 CA-C-O 115.385 -2.245 . . . . 0.0 110.334 -178.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -55.16 -36.36 92.96 Favored 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 124.895 3.73 . . . . 0.0 113.784 -169.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.32 -26.28 38.87 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 124.468 1.105 . . . . 0.0 110.155 -172.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -67.49 -47.27 70.52 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 119.084 -2.26 . . . . 0.0 110.91 167.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . 0.47 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 62.7 mtm-85 -63.58 -41.35 98.38 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 125.163 1.539 . . . . 0.0 115.064 178.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.57 -39.31 93.51 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 118.891 -2.38 . . . . 0.0 114.876 169.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.62 -46.96 65.03 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 18.8 mt -53.09 -34.93 58.83 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 117.04 -3.537 . . . . 0.0 116.492 169.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.96 -24.17 71.47 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 110.688 -2.96 . . . . 0.0 115.967 172.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.5 m -101.88 -22.35 14.35 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 114.926 -2.464 . . . . 0.0 110.969 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -63.32 -21.62 66.37 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 121.311 1.869 . . . . 0.0 112.643 166.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 10.5 t -54.16 -49.37 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 O-C-N 116.599 -3.813 . . . . 0.0 114.424 163.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 -74.07 -31.84 63.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 96.3 mt -70.73 -46.97 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 3.3 t -63.23 -36.2 75.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 O-C-N 116.975 -3.578 . . . . 0.0 111.634 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.16 -41.94 76.24 Favored 'General case' 0 N--CA 1.452 -0.35 1 O-C-N 115.861 -4.274 . . . . 0.0 116.396 169.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -80.08 -17.33 52.95 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 129.951 3.3 . . . . 0.0 112.468 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 54.6 mt -82.73 -9.78 59.2 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 117.183 -3.448 . . . . 0.0 111.027 168.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 89.3 mt -107.38 -31.33 8.22 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 128.413 2.685 . . . . 0.0 112.079 169.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 16.5 ttm105 -70.66 -54.46 11.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.692 1.738 . . . . 0.0 115.692 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.68 54.61 30.22 Favored Glycine 0 C--N 1.337 0.622 0 CA-C-O 115.301 -2.944 . . . . 0.0 117.111 -170.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -126.95 -17.01 4.99 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 117.152 2.278 . . . . 0.0 117.152 175.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 81.4 mtp -102.93 146.44 28.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.208 -2.183 . . . . 0.0 111.731 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -93.54 172.55 8.2 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 118.471 -2.643 . . . . 0.0 107.845 172.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -58.4 -37.41 75.25 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 175.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -55.25 -36.51 66.14 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 126.298 2.951 . . . . 0.0 118.208 172.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -85.08 -38.92 18.57 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 128.284 2.634 . . . . 0.0 106.681 -174.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 73.3 mt -58.56 -42.49 88.06 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 117.056 -3.527 . . . . 0.0 111.491 170.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 tptt -59.26 -65.92 0.59 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 127.757 2.423 . . . . 0.0 111.02 173.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -74.16 -29.75 61.93 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 114.687 -2.805 . . . . 0.0 114.147 -168.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . 0.31 39.6 mt-10 -115.91 -23.62 8.5 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 114.867 -2.492 . . . . 0.0 114.422 -162.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mt -104.85 -6.1 20.53 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 126.092 2.12 . . . . 0.0 114.389 162.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.94 16.8 70.91 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 119.672 -1.251 . . . . 0.0 113.496 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.55 134.72 34.18 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 122.833 3.316 . . . . 0.0 117.808 -179.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.17 -173.24 7.43 Favored Glycine 0 C--N 1.334 0.456 0 CA-C-O 124.527 2.181 . . . . 0.0 111.848 158.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 97.3 mt -83.13 -44.98 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 O-C-N 117.255 -3.497 . . . . 0.0 113.146 -177.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.97 -23.26 52.34 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 -169.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 17.2 m -66.04 -44.31 85.0 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.315 1.446 . . . . 0.0 113.841 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 21.1 mm -76.74 -30.14 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 C-N-CA 125.916 1.686 . . . . 0.0 107.663 173.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 6.7 m -59.4 -50.72 72.86 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 120.245 -1.534 . . . . 0.0 111.003 169.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -61.72 -42.18 98.61 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -48.55 -44.54 29.31 Favored Glycine 0 N--CA 1.446 -0.657 1 C-N-CA 131.038 4.161 . . . . 0.0 109.7 176.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 3.6 p -74.02 -35.83 64.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.361 1.465 . . . . 0.0 114.055 -178.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -69.59 -41.19 76.11 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 127.514 2.326 . . . . 0.0 107.702 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 6.0 m -72.51 -31.99 65.79 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 119.33 -2.107 . . . . 0.0 115.057 -176.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.09 -25.86 20.53 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 115.913 -1.994 . . . . 0.0 106.682 -177.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 58.1 tttm -64.4 -48.67 74.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 121.993 2.179 . . . . 0.0 105.234 172.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.18 3.94 25.29 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 117.368 -3.332 . . . . 0.0 116.671 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.7 141.71 64.91 Favored Pre-proline 0 N--CA 1.45 -0.425 0 O-C-N 117.49 -3.256 . . . . 0.0 113.157 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -49.03 124.99 12.35 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 123.192 2.595 . . . . 0.0 116.891 172.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.31 -23.56 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 1 O-C-N 115.887 -4.258 . . . . 0.0 115.571 -172.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -60.36 -30.25 69.43 Favored 'General case' 0 N--CA 1.453 -0.308 1 O-C-N 114.865 -4.897 . . . . 0.0 111.877 171.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 14.7 tp -79.35 -36.79 38.86 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 117.39 -1.291 . . . . 0.0 110.655 171.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 32.0 mtm-85 -65.78 -39.77 91.33 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.832 2.16 . . . . 0.0 116.832 171.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -58.23 -39.37 78.92 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 130.296 3.438 . . . . 0.0 112.013 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -61.44 -59.2 5.61 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 128.188 2.595 . . . . 0.0 114.347 163.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 50.5 mt -75.11 -25.4 58.45 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 122.036 2.198 . . . . 0.0 114.529 -165.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -52.53 -35.79 54.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 129.71 3.204 . . . . 0.0 110.814 170.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -95.47 -47.71 6.15 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.156 2.183 . . . . 0.0 114.021 175.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.9 t -68.16 -20.78 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 O-C-N 119.749 -1.844 . . . . 0.0 112.928 -170.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 50.9 mt -107.14 -42.99 4.72 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -176.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 11.5 mt -77.35 -5.76 50.8 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.007 -1.451 . . . . 0.0 114.066 -174.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -104.29 -2.56 25.41 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 117.268 2.322 . . . . 0.0 117.268 169.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 31.6 m -79.68 -1.13 36.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 114.338 -2.744 . . . . 0.0 114.051 164.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 . . . . . 0 C--O 1.25 1.107 0 CA-C-N 124.905 3.502 . . . . 0.0 109.523 -178.689 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 11.5 ttt . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 116.941 -1.504 . . . . 0.0 111.581 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.263 . . -57.39 141.96 45.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 129.049 2.94 . . . . 0.0 104.646 178.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -120.11 149.66 41.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 123.921 0.763 . . . . 0.0 111.301 -176.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -141.2 148.37 39.83 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 174.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 60.4 p -159.67 158.47 27.38 Favored Pre-proline 0 N--CA 1.446 -0.646 1 C-N-CA 132.77 4.428 . . . . 0.0 111.025 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -52.91 -47.82 25.45 Favored 'Trans proline' 0 N--CA 1.45 -1.076 0 C-N-CA 122.376 2.051 . . . . 0.0 113.58 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -139.88 141.52 36.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 117.308 -3.37 . . . . 0.0 110.951 -171.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 11.9 t -141.95 137.38 31.22 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 112.684 -2.053 . . . . 0.0 106.341 168.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.89 -42.76 94.51 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 117.546 2.424 . . . . 0.0 117.546 174.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.85 -33.38 23.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 168.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 47.6 mtt -83.44 -37.83 22.69 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 115.189 -2.338 . . . . 0.0 113.43 175.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.85 -37.31 71.11 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 123.224 2.738 . . . . 0.0 112.802 166.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -67.52 -38.36 84.12 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 119.389 -2.069 . . . . 0.0 114.661 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -72.22 -25.97 61.85 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.074 -1.641 . . . . 0.0 111.626 176.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -39.59 86.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 125.888 2.756 . . . . 0.0 113.237 169.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -69.54 -48.83 59.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 119.439 -2.038 . . . . 0.0 108.856 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -70.34 -24.85 63.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 115.265 -2.302 . . . . 0.0 110.552 -175.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -56.8 -48.9 76.89 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.482 2.313 . . . . 0.0 113.138 161.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 -56.29 -64.74 0.76 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 170.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . 0.477 HD13 ' HA ' ' C' ' 20' ' ' LEU . 4.4 mm? -57.7 -33.08 68.01 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.901 2.08 . . . . 0.0 106.342 -175.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -66.74 -36.12 81.71 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 112.721 -3.514 . . . . 0.0 115.995 167.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -64.78 -37.57 88.05 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 122.747 2.521 . . . . 0.0 107.329 169.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.57 -23.38 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 O-C-N 116.647 -3.783 . . . . 0.0 111.521 176.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -83.6 -40.94 18.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 172.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 32.0 tp -56.13 -41.77 75.85 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 119.268 0.94 . . . . 0.0 111.674 171.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 37.3 tp -72.67 -31.58 65.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 123.962 1.839 . . . . 0.0 113.101 -177.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -83.81 -18.71 36.73 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 119.265 -2.147 . . . . 0.0 114.285 176.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -74.27 -38.87 63.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 116.665 -1.636 . . . . 0.0 112.714 160.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.3 -21.68 62.91 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.13 -5.76 37.81 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 120.34 1.427 . . . . 0.0 108.435 173.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -80.1 -38.55 31.42 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 121.936 2.153 . . . . 0.0 111.473 -176.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . 0.277 25.2 p-10 -120.5 33.11 5.71 Favored 'General case' 0 N--CA 1.451 -0.406 1 O-C-N 115.528 -4.483 . . . . 0.0 116.034 169.89 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 61.48 33.6 18.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 131.097 3.759 . . . . 0.0 117.499 171.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 42.0 mt -103.32 10.22 37.61 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.759 1.623 . . . . 0.0 109.593 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -74.04 -32.62 63.41 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 118.384 -2.698 . . . . 0.0 114.601 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 11.3 mt -78.04 -42.57 2.18 Favored Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-O 116.278 -1.82 . . . . 0.0 108.839 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -59.45 -34.64 97.23 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 CA-C-O 115.306 -2.039 . . . . 0.0 113.578 166.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 14.3 tp -61.66 -43.77 98.23 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.768 1.918 . . . . 0.0 113.654 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -67.01 -25.51 66.33 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 173.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -75.14 -19.08 60.07 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 169.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 38.2 tp -84.2 -55.17 4.33 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 126.027 2.079 . . . . 0.0 113.672 168.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 9.1 mmt -73.93 -24.41 59.66 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 119.13 -2.232 . . . . 0.0 110.973 -162.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 11.1 mp -127.25 132.6 50.33 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 129.743 3.217 . . . . 0.0 111.623 -171.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -73.06 157.23 88.81 Favored Pre-proline 0 N--CA 1.448 -0.532 0 C-N-CA 125.787 1.635 . . . . 0.0 108.622 172.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -45.94 -32.44 9.54 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 121.393 1.396 . . . . 0.0 113.451 168.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -39.88 87.35 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 122.097 0.951 . . . . 0.0 113.368 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -72.76 -47.12 49.47 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 129.797 3.239 . . . . 0.0 109.919 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . 0.465 ' HD2' ' CZ2' ' D' ' 19' ' ' TRP . 58.0 mtm-85 -56.95 -41.54 78.47 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 175.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -70.69 -33.08 70.52 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 172.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.16 -39.58 82.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 171.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 20.9 mt -61.84 -33.2 73.74 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 122.238 2.29 . . . . 0.0 113.612 167.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.42 -27.32 73.84 Favored Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.834 171.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 93.8 m -82.18 -43.61 17.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.034 -2.45 . . . . 0.0 112.131 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -57.25 -36.61 71.18 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 114.214 -2.803 . . . . 0.0 115.298 169.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 22.1 t -51.05 -44.53 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-O 113.585 -3.102 . . . . 0.0 113.926 162.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 16.0 mtp180 -62.14 -28.51 69.69 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 124.698 3.408 . . . . 0.0 112.846 171.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 67.7 mt -80.93 -32.88 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 C-N-CA 119.297 -0.961 . . . . 0.0 111.577 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 92.4 t -66.98 -48.97 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 117.593 -1.194 . . . . 0.0 110.801 165.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -58.47 -50.77 72.55 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -177.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -66.81 -37.01 83.69 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 115.385 -2.245 . . . . 0.0 111.107 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 94.1 mt -70.0 -21.46 63.21 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 116.844 2.164 . . . . 0.0 116.844 173.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 19.7 mt -78.49 -23.69 46.27 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 169.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -71.48 -44.6 64.42 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.874 -2.391 . . . . 0.0 110.868 168.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 65.76 22.78 70.35 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-O 125.235 2.575 . . . . 0.0 116.87 174.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -99.03 -21.52 16.17 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 117.964 -3.08 . . . . 0.0 111.077 -176.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 12.0 mtt -71.89 127.19 31.76 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 120.529 -1.357 . . . . 0.0 112.223 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 60.4 p -74.64 163.01 28.2 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 126.146 2.154 . . . . 0.0 111.382 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -37.89 -41.9 0.57 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 116.191 1.923 . . . . 0.0 116.191 171.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 31.8 ttp-105 -60.75 -48.41 81.9 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 121.912 0.863 . . . . 0.0 111.687 176.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -67.47 -34.17 76.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.97 2.108 . . . . 0.0 106.565 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 68.5 mt -68.72 -30.94 69.68 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 119.069 -2.269 . . . . 0.0 111.82 172.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 39.7 tttp -73.99 -42.34 60.57 Favored 'General case' 0 N--CA 1.453 -0.283 1 O-C-N 115.093 -4.754 . . . . 0.0 116.341 170.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -76.13 -21.6 56.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.84 1.256 . . . . 0.0 109.535 -170.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -124.69 -39.71 2.27 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 117.422 -1.275 . . . . 0.0 114.238 -170.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.326 5.6 mp -102.01 -15.56 16.75 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 115.869 -2.015 . . . . 0.0 109.588 -168.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . 0.425 ' O ' HG22 ' C' ' 79' ' ' ILE . . . 48.2 -131.11 19.58 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 128.433 2.921 . . . . 0.0 117.328 158.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.25 -22.28 33.1 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.575 -2.133 . . . . 0.0 111.926 -174.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.23 -15.13 81.85 Favored Glycine 0 CA--C 1.523 0.588 0 C-N-CA 127.065 2.269 . . . . 0.0 112.032 -169.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . 0.425 HG22 ' O ' ' C' ' 76' ' ' GLY . 17.5 tt -58.64 -33.84 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 125.535 1.534 . . . . 0.0 110.155 -178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.6 -32.7 74.19 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 120.897 -1.127 . . . . 0.0 113.505 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 2.9 m -62.79 -44.03 97.23 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 117.462 -3.274 . . . . 0.0 109.454 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 39.0 mm -88.36 -18.26 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 129.385 3.074 . . . . 0.0 112.054 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 71.7 p -110.93 -11.05 14.37 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 120.701 3.593 . . . . 0.0 120.701 174.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 43.3 mtp85 -115.29 156.1 26.07 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.426 -3.296 . . . . 0.0 113.335 174.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.86 172.22 45.61 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 128.034 2.73 . . . . 0.0 112.783 -177.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 97.2 p -89.86 10.08 25.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 116.976 -3.661 . . . . 0.0 117.776 -176.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -104.55 0.85 29.13 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 118.002 -2.936 . . . . 0.0 114.215 161.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 99.9 p -59.23 172.83 0.55 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 126.459 3.028 . . . . 0.0 115.753 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 26.5 tp -70.72 -12.44 61.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 111.015 -2.811 . . . . 0.0 111.3 -170.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -124.02 0.98 8.58 Favored 'General case' 0 N--CA 1.451 -0.376 1 O-C-N 116.262 -4.024 . . . . 0.0 110.328 177.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -113.36 -21.33 10.96 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 121.535 3.902 . . . . 0.0 121.535 173.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.42 157.78 4.62 Favored Pre-proline 0 N--CA 1.452 -0.352 0 C-N-CA 129.499 3.12 . . . . 0.0 112.994 170.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -56.98 129.05 32.47 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 N-CA-C 114.389 0.88 . . . . 0.0 114.389 173.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 61.8 t -59.78 -30.84 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 C-N-CA 128.907 2.883 . . . . 0.0 112.0 -162.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -62.59 -24.42 67.55 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 176.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 4.6 tp -68.35 -55.77 10.87 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 115.594 -2.146 . . . . 0.0 110.136 168.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 59.6 mtp180 -48.49 -40.79 27.83 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 128.593 2.757 . . . . 0.0 108.589 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -70.89 -52.84 17.71 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.613 1.965 . . . . 0.0 112.46 -179.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 32.8 t90 -46.7 -40.71 13.79 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 116.833 -3.667 . . . . 0.0 117.829 168.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 27.9 mt -75.46 -22.02 57.64 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.237 -175.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -78.64 -34.34 46.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 117.696 -1.145 . . . . 0.0 108.658 172.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -68.94 -18.57 64.11 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 125.245 1.418 . . . . 0.0 110.869 -178.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 96.9 t -105.58 -40.77 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 C-N-CA 127.819 2.448 . . . . 0.0 115.808 -177.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -103.51 -16.37 15.58 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 128.743 2.817 . . . . 0.0 111.728 -167.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 23.9 mt -120.44 -3.47 9.91 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 121.317 1.871 . . . . 0.0 112.427 -177.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 58.9 pttt . . . . . 0 N--CA 1.451 -0.391 0 O-C-N 118.242 -2.786 . . . . 0.0 117.754 -171.739 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 66.9 p . . . . . 0 N--CA 1.446 -0.625 0 CA-C-O 114.699 -2.572 . . . . 0.0 115.084 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -61.96 -19.55 66.39 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 CA-C-N 122.709 2.003 . . . . 0.0 117.239 172.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . 0.354 49.5 t80 -173.78 148.1 1.43 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.386 2.274 . . . . 0.0 106.804 171.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 11.9 t -62.19 128.64 37.07 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 103.236 -2.875 . . . . 0.0 103.236 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.42 -25.26 61.41 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 112.826 -1.988 . . . . 0.0 111.205 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.93 -36.4 83.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 119.072 -2.267 . . . . 0.0 114.457 165.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -66.63 -33.91 76.71 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 177.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . 0.28 . . -60.86 -35.41 76.51 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 118.257 -2.777 . . . . 0.0 109.602 175.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -70.85 -50.88 30.49 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.292 -2.13 . . . . 0.0 106.726 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -54.77 -46.23 74.37 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.28 2.232 . . . . 0.0 108.15 -170.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -31.36 71.32 Favored 'General case' 0 N--CA 1.45 -0.459 1 O-C-N 115.872 -4.268 . . . . 0.0 110.647 -168.594 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.6 t60 -76.56 -27.67 55.98 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 164.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -67.67 -33.21 74.47 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 118.017 -2.927 . . . . 0.0 116.139 169.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -74.99 -26.55 59.65 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 128.833 2.853 . . . . 0.0 115.196 167.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . 0.465 ' CZ2' ' HD2' ' C' ' 48' ' ' ARG . 5.1 t-105 -70.58 -48.26 56.13 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 116.939 -3.6 . . . . 0.0 110.371 165.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 93.6 mt -68.56 -25.22 64.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 120.52 -1.363 . . . . 0.0 110.14 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 17.4 ttt180 -62.37 -33.97 75.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 118.047 -0.978 . . . . 0.0 112.039 168.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . 0.451 88.1 t80 -70.68 -36.56 73.38 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 171.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.99 -45.47 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 O-C-N 119.144 -2.223 . . . . 0.0 110.396 172.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -74.91 -33.48 62.02 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 118.033 2.605 . . . . 0.0 118.033 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 17.3 tp -60.62 -43.05 97.92 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 124.353 2.025 . . . . 0.0 111.099 167.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 42.3 tp -60.91 -44.0 97.77 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 118.272 -2.767 . . . . 0.0 109.546 175.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -59.36 -55.62 32.46 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 120.092 1.315 . . . . 0.0 107.89 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -58.14 -30.56 66.43 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 126.483 2.364 . . . . 0.0 115.858 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.34 -24.95 62.2 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.899 0.88 . . . . 0.0 112.048 175.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -76.81 -26.16 54.1 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 119.516 1.053 . . . . 0.0 110.428 168.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -84.54 -19.06 33.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 118.185 -2.822 . . . . 0.0 113.421 -176.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 53.7 p30 -114.97 10.38 16.27 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 114.889 1.441 . . . . 0.0 114.889 172.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 49.63 42.42 23.19 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.601 1.188 . . . . 0.0 112.024 -176.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 47.1 mt -102.03 11.99 37.56 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 121.476 1.944 . . . . 0.0 112.824 167.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . 0.366 0.0 OUTLIER -49.71 -67.16 0.28 Allowed 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 119.876 3.287 . . . . 0.0 119.876 177.296 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 6.2 mt -58.2 -48.63 96.69 Favored Pre-proline 0 N--CA 1.449 -0.505 0 CA-C-O 114.745 -2.55 . . . . 0.0 110.554 -177.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.33 -25.49 71.45 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 CA-C-N 125.36 2.95 . . . . 0.0 112.912 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 14.8 tp -79.48 -40.23 30.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 125.535 3.789 . . . . 0.0 116.575 177.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 89.0 mt -68.34 -42.56 79.11 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 11.8 m-20 -71.5 -28.21 63.75 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 113.844 -2.979 . . . . 0.0 117.009 177.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 28.1 tp -57.6 -52.1 66.8 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 114.063 -2.875 . . . . 0.0 114.149 156.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 19.4 mmt -75.88 -25.66 56.32 Favored 'General case' 0 N--CA 1.448 -0.529 1 C-N-CA 131.823 4.049 . . . . 0.0 117.704 -173.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 14.6 mt -132.95 129.63 38.52 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 126.012 2.07 . . . . 0.0 110.476 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 71.6 p -77.25 167.23 38.21 Favored Pre-proline 0 N--CA 1.451 -0.412 0 CA-C-O 114.927 -2.463 . . . . 0.0 109.369 -167.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -45.23 -42.18 16.88 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 O-C-N 125.938 2.546 . . . . 0.0 116.15 -173.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -92.01 -7.65 48.28 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.765 1.626 . . . . 0.0 111.387 -169.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -88.5 -36.17 16.58 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 168.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -66.48 -38.64 87.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 127.199 2.2 . . . . 0.0 111.864 169.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -79.35 -37.39 37.55 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 119.747 -1.846 . . . . 0.0 108.955 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -49.44 -58.71 4.65 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 121.812 2.097 . . . . 0.0 108.93 163.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 49.0 mt -64.13 -44.09 93.25 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 117.786 -3.071 . . . . 0.0 111.406 -165.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -33.64 -50.3 0.57 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-O 114.48 -3.4 . . . . 0.0 121.551 149.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 28.7 m -73.57 -29.71 62.58 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 120.944 2.372 . . . . 0.0 109.262 177.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . 0.555 ' HA ' HD12 ' D' ' 57' ' ' ILE 0.262 96.9 mtt180 -64.42 -28.66 69.83 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 120.509 -1.369 . . . . 0.0 113.573 -176.676 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 10.8 t -56.62 -51.86 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 120.6 1.545 . . . . 0.0 112.037 162.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -77.08 -11.06 59.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 117.227 -1.789 . . . . 0.0 113.905 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . 0.555 HD12 ' HA ' ' D' ' 54' ' ' ARG . 36.9 mt -74.91 -47.73 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 122.223 2.283 . . . . 0.0 105.804 175.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . 0.408 HG22 HG23 ' D' ' 82' ' ' ILE . 91.3 t -65.03 -41.61 92.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 173.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -56.26 -31.18 63.34 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.684 -2.51 . . . . 0.0 115.204 173.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -84.56 -29.69 25.67 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 120.34 1.427 . . . . 0.0 114.543 -176.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 25.0 mt -67.06 -20.46 65.83 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.999 1.719 . . . . 0.0 113.628 161.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 27.6 mt -94.64 -21.22 18.94 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 120.118 -1.614 . . . . 0.0 111.559 171.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . 0.256 32.0 ttm180 -79.95 -40.46 28.03 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.898 0.856 . . . . 0.0 111.295 176.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 73.24 6.63 69.84 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 127.652 2.548 . . . . 0.0 117.98 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -93.48 -32.8 14.05 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 124.872 0.983 . . . . 0.0 113.304 -170.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 39.0 mtt -80.28 42.54 0.58 Allowed 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 127.383 3.468 . . . . 0.0 114.03 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 89.0 p -67.86 163.0 22.89 Favored 'General case' 0 N--CA 1.446 -0.669 1 O-C-N 115.664 -4.398 . . . . 0.0 113.966 -176.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 67.83 -55.21 0.49 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 114.564 -2.636 . . . . 0.0 115.917 163.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 ttt85 -125.05 -29.27 3.34 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 122.327 2.33 . . . . 0.0 116.49 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -77.16 -37.32 54.09 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 118.346 -2.721 . . . . 0.0 111.081 -173.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 11.7 mt -53.71 -30.34 43.43 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.0 1.857 . . . . 0.0 115.405 168.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -91.73 -7.24 50.3 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -136.18 -17.43 1.59 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 114.926 -2.464 . . . . 0.0 117.65 -175.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . 0.436 ' HB3' HD22 ' D' ' 75' ' ' LEU . 5.4 tp10 -90.59 -35.43 15.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 126.549 2.405 . . . . 0.0 112.015 163.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . 0.51 HD22 ' N ' ' D' ' 75' ' ' LEU 0.307 1.4 mm? -94.61 -57.2 2.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 127.352 2.261 . . . . 0.0 116.215 172.382 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.65 -162.83 44.43 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 116.249 -2.417 . . . . 0.0 114.612 174.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -33.3 -32.93 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 130.159 4.094 . . . . 0.0 118.084 -157.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.01 -19.43 56.7 Favored Glycine 0 C--N 1.337 0.632 1 C-N-CA 131.316 4.294 . . . . 0.0 110.491 174.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . 0.256 0.9 OUTLIER -58.65 -29.94 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 121.655 2.728 . . . . 0.0 114.778 175.508 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.62 -12.86 60.04 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 116.591 -1.671 . . . . 0.0 111.731 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 14.4 m -71.76 -37.16 70.54 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 118.322 2.712 . . . . 0.0 118.322 158.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . 0.408 HG23 HG22 ' D' ' 58' ' ' VAL . 25.8 mm -82.93 -27.06 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 CA-C-N 113.645 -1.616 . . . . 0.0 111.573 -173.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 71.5 p -102.31 -19.03 15.17 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 127.261 2.224 . . . . 0.0 110.625 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.322 16.3 mtp180 -119.79 154.25 34.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.297 -2.752 . . . . 0.0 113.531 178.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 109.38 146.41 11.49 Favored Glycine 0 C--N 1.338 0.692 0 C-N-CA 119.922 -1.132 . . . . 0.0 111.355 -159.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 84.5 p -72.68 -21.62 61.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 129.606 3.163 . . . . 0.0 112.907 -160.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -130.09 38.78 3.75 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 128.344 3.527 . . . . 0.0 113.397 175.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 29.1 p -57.46 169.59 0.63 Allowed 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 127.365 2.916 . . . . 0.0 117.374 173.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.373 0.7 OUTLIER -65.77 -3.48 5.0 Favored 'General case' 0 C--O 1.223 -0.297 1 O-C-N 115.59 -4.444 . . . . 0.0 119.443 159.122 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 66.2 tttt -76.68 -22.83 53.45 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 126.957 2.661 . . . . 0.0 114.625 162.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -105.21 -39.89 6.04 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 131.638 3.975 . . . . 0.0 115.448 -152.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . 0.628 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 55.33 85.49 0.19 Allowed Pre-proline 0 N--CA 1.448 -0.569 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 167.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . 0.628 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.357 0.0 OUTLIER 33.95 33.11 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.21 0 C-N-CA 119.468 -3.138 . . . . 0.0 118.857 40.047 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 91.8 t -65.32 -28.81 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 O-C-N 125.837 1.961 . . . . 0.0 107.215 -170.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . 0.519 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.263 0.1 OUTLIER -81.82 -42.78 19.18 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 130.066 3.346 . . . . 0.0 109.979 -170.131 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 9.0 tp -63.26 -40.99 98.97 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 118.501 0.591 . . . . 0.0 111.95 165.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 -55.53 -53.59 54.46 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 116.823 -1.56 . . . . 0.0 115.193 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -57.65 -34.63 69.56 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 126.192 2.183 . . . . 0.0 114.41 177.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 59.5 t90 -75.74 -45.51 36.09 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 117.932 -2.98 . . . . 0.0 111.74 175.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 94.1 mt -55.99 -37.13 68.7 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 118.597 -2.564 . . . . 0.0 114.541 174.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -70.8 -21.24 62.5 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 -174.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -89.37 -48.99 6.97 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 123.674 1.702 . . . . 0.0 111.398 171.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 89.7 t -63.17 -38.78 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 O-C-N 118.261 -2.774 . . . . 0.0 113.136 178.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 75.6 mt -84.94 -20.74 30.19 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 115.716 -2.394 . . . . 0.0 114.561 -174.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 55.0 mt -93.86 5.38 51.84 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 124.943 2.306 . . . . 0.0 116.078 177.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 19.1 pttp -60.93 147.28 43.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.657 1.983 . . . . 0.0 107.481 -172.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 34.3 m -65.88 -29.0 69.37 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 119.505 3.15 . . . . 0.0 119.505 -171.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 . . . . . 0 C--O 1.252 1.226 0 O-C-N 118.701 -2.5 . . . . 0.0 113.838 166.541 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.8 ttp . . . . . 0 N--CA 1.451 -0.415 0 N-CA-C 117.31 2.337 . . . . 0.0 117.31 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.04 -40.52 73.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 173.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -77.67 -39.8 43.73 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -42.23 -40.72 2.5 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 128.313 2.645 . . . . 0.0 113.048 168.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 67.0 mmt-85 -79.87 -25.71 40.58 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 125.401 1.688 . . . . 0.0 114.716 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 29.8 t60 -70.58 -39.16 74.04 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 121.63 2.014 . . . . 0.0 111.295 171.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -55.41 -43.13 74.99 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.108 1.363 . . . . 0.0 110.119 172.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -65.1 -37.47 87.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 118.362 2.727 . . . . 0.0 118.362 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 41.9 t-105 -65.94 -47.88 73.21 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.606 169.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 69.6 mt -57.68 -38.33 74.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 120.56 1.527 . . . . 0.0 109.693 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 43.5 ttt180 -62.75 -36.46 83.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 121.221 1.828 . . . . 0.0 114.658 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -61.76 -41.79 98.14 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 121.195 1.816 . . . . 0.0 108.8 173.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.5 t -67.42 -49.77 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 121.477 1.944 . . . . 0.0 105.912 -173.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -71.15 -32.27 68.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 118.997 -2.314 . . . . 0.0 113.899 -177.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 19.4 tp -55.68 -49.49 72.81 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.524 -2.61 . . . . 0.0 109.169 167.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.09 -31.3 72.44 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 118.649 -2.532 . . . . 0.0 114.331 176.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -57.96 -51.82 68.06 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.801 1.778 . . . . 0.0 115.801 169.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -60.8 -39.43 88.91 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 126.156 1.782 . . . . 0.0 112.93 173.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.72 -48.85 76.84 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 115.054 -2.403 . . . . 0.0 114.845 163.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -55.89 -43.42 77.23 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 124.338 3.244 . . . . 0.0 113.85 172.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -70.55 -21.23 62.73 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 125.071 1.482 . . . . 0.0 114.613 -177.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -95.7 5.87 50.32 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 118.95 2.945 . . . . 0.0 118.95 165.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.398 6.0 m-20 71.59 35.59 1.42 Allowed 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 118.467 -2.646 . . . . 0.0 113.769 -172.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.268 49.1 mt -125.61 14.26 8.13 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 119.975 -1.703 . . . . 0.0 112.86 -167.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -73.97 -41.73 61.53 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 118.715 -2.49 . . . . 0.0 114.81 -172.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.5 mt -64.58 -52.77 49.82 Favored Pre-proline 0 N--CA 1.448 -0.554 0 O-C-N 125.571 1.794 . . . . 0.0 110.386 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -71.67 -20.28 26.81 Favored 'Trans proline' 0 N--CA 1.448 -1.19 0 CA-C-N 121.132 1.44 . . . . 0.0 111.287 -170.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.6 tp -71.22 -56.62 5.68 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 129.132 2.973 . . . . 0.0 109.278 173.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.3 mt -61.3 -30.68 70.63 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 120.074 -1.641 . . . . 0.0 110.04 176.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -67.32 -10.87 55.19 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 117.055 -3.528 . . . . 0.0 113.977 176.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.4 tt -102.96 -36.94 8.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.448 1.499 . . . . 0.0 113.442 173.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 79.9 mmm -78.87 -33.16 46.04 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 127.733 2.413 . . . . 0.0 117.293 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.8 mt -119.03 143.05 47.3 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.948 2.899 . . . . 0.0 112.148 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.7 p -82.91 167.13 31.63 Favored Pre-proline 0 N--CA 1.45 -0.444 0 CA-C-O 115.748 -2.073 . . . . 0.0 114.44 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . 0.443 65.4 Cg_exo -47.24 -60.58 0.83 Allowed 'Trans proline' 0 N--CA 1.45 -1.083 0 N-CA-C 119.935 3.014 . . . . 0.0 119.935 -172.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -67.55 -6.15 18.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 119.585 3.18 . . . . 0.0 119.585 168.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -84.21 -49.28 8.96 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.061 2.209 . . . . 0.0 108.017 170.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.4 mtm-85 -46.34 -45.86 17.85 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.022 2.129 . . . . 0.0 112.861 163.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.24 -46.18 78.04 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.953 1.408 . . . . 0.0 112.279 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.88 -41.43 87.1 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 130.321 3.448 . . . . 0.0 109.071 170.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.1 mt -54.76 -34.42 62.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 124.552 3.342 . . . . 0.0 112.88 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.05 -49.26 76.85 Favored Glycine 0 N--CA 1.446 -0.66 1 C-N-CA 131.72 4.486 . . . . 0.0 113.282 168.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.9 m -70.87 -34.37 71.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.692 1.197 . . . . 0.0 109.551 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -61.38 -37.18 82.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 117.178 2.288 . . . . 0.0 117.178 177.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.5 t -59.29 -38.9 77.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 125.33 1.452 . . . . 0.0 109.188 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.2 mtp180 -66.34 -31.91 72.98 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 128.389 2.675 . . . . 0.0 111.921 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 85.8 mt -77.29 -35.67 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 125.865 1.666 . . . . 0.0 110.49 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.48 HG21 ' CE ' ' B' ' 42' ' ' MET . 71.8 t -67.02 -46.16 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-O 117.144 -1.408 . . . . 0.0 107.768 170.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -64.9 -36.53 84.68 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 121.219 1.827 . . . . 0.0 108.422 -170.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -84.59 -29.82 25.51 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.862 -2.399 . . . . 0.0 111.843 -175.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.277 50.0 mt -69.56 -31.53 69.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 118.432 -2.667 . . . . 0.0 113.046 164.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tt -77.54 -37.27 51.19 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 117.033 -1.867 . . . . 0.0 112.152 172.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -69.06 -31.16 69.72 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 128.261 2.624 . . . . 0.0 115.733 176.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.63 -23.73 8.42 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 121.203 3.241 . . . . 0.0 121.203 164.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -64.89 -51.29 62.77 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 176.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 37.8 ttm -90.94 135.9 33.43 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 -155.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 83.8 p -107.94 170.53 7.94 Favored 'General case' 0 CA--C 1.52 -0.191 0 O-C-N 119.499 -2.001 . . . . 0.0 113.627 -166.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -35.17 -61.55 0.42 Allowed 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 124.879 2.276 . . . . 0.0 110.582 -176.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.0 tpt85 -67.14 -14.98 63.43 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.57 3.148 . . . . 0.0 115.455 -174.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -97.93 -46.89 5.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 128.003 3.314 . . . . 0.0 109.608 175.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.2 mt -50.25 -40.17 47.05 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.3 tptp -46.68 -50.61 17.55 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 111.901 -2.409 . . . . 0.0 114.686 164.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -78.95 -24.89 43.64 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.839 2.056 . . . . 0.0 111.646 -177.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -103.01 -26.71 12.98 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 -171.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 37.1 mt -130.35 0.21 4.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.305 -2.747 . . . . 0.0 113.859 -173.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.57 4.2 17.6 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-N 111.936 -2.393 . . . . 0.0 113.868 -164.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.13 123.16 26.55 Favored 'General case' 0 N--CA 1.449 -0.517 1 O-C-N 115.895 -4.297 . . . . 0.0 110.487 -168.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.78 166.79 45.41 Favored Glycine 0 CA--C 1.524 0.595 1 CA-C-O 128.388 4.327 . . . . 0.0 113.392 173.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 60.3 mt -65.48 -27.44 41.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 110.73 -2.735 . . . . 0.0 109.805 -172.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.73 -37.59 73.5 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 120.414 1.461 . . . . 0.0 111.744 -175.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.6 p -86.94 -16.56 35.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.267 40.8 mm -71.07 -56.5 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 C-N-CA 129.939 3.296 . . . . 0.0 108.978 162.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.4 m -53.71 -44.47 69.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 121.573 1.988 . . . . 0.0 116.219 175.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.5 ttt180 -70.85 -54.59 10.98 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 123.142 1.449 . . . . 0.0 108.928 174.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -51.75 -25.74 15.87 Favored Glycine 0 C--N 1.337 0.608 0 O-C-N 118.647 -2.533 . . . . 0.0 116.797 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.3 m -75.59 -48.28 22.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.805 2.842 . . . . 0.0 110.717 171.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -76.73 -25.04 53.08 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 124.142 0.901 . . . . 0.0 112.079 -176.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 74.8 m -70.19 -35.76 74.16 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 126.22 1.808 . . . . 0.0 115.201 163.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 tp -68.49 -33.38 74.04 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 116.277 -4.014 . . . . 0.0 113.839 167.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -70.37 -43.01 71.03 Favored 'General case' 0 N--CA 1.45 -0.463 1 O-C-N 115.944 -4.223 . . . . 0.0 111.388 175.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.01 -11.22 27.03 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 174.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.421 ' HB1' HD23 ' A' ' 96' ' ' LEU . . . -60.86 157.12 42.16 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -61.2 153.23 66.43 Favored 'Trans proline' 0 N--CA 1.449 -1.09 1 C-N-CA 128.6 6.2 . . . . 0.0 115.27 160.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 31.2 m -78.7 -29.92 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 117.399 -1.72 . . . . 0.0 115.63 -165.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -61.38 -28.02 68.94 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.975 3.31 . . . . 0.0 112.651 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.421 HD23 ' HB1' ' A' ' 92' ' ' ALA . 30.0 tp -65.61 -48.72 71.31 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.921 2.088 . . . . 0.0 111.106 178.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 80.0 mtm-85 -74.98 -35.98 62.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.117 -2.864 . . . . 0.0 113.946 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -70.04 -17.8 63.27 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 119.079 -2.263 . . . . 0.0 110.519 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 43.8 t90 -91.09 -44.86 9.02 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 85.2 mt -57.88 -38.16 75.27 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -41.55 -41.46 2.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 119.297 3.073 . . . . 0.0 119.297 159.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -96.84 -26.71 15.01 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 123.018 1.39 . . . . 0.0 109.85 -162.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.5 t -86.35 -44.07 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 128.902 2.881 . . . . 0.0 111.531 174.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.6 mt -89.37 -45.1 9.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.766 -1.834 . . . . 0.0 114.611 -171.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.1 mt -103.2 -26.4 13.0 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -167.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? . . . . . 0 N--CA 1.447 -0.583 0 O-C-N 119.688 -1.883 . . . . 0.0 111.911 177.973 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.383 0 CA-C-O 115.068 -2.396 . . . . 0.0 113.649 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 19.4 mtt -69.07 -35.24 76.31 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 126.983 2.677 . . . . 0.0 111.79 168.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.9 -32.25 69.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 122.565 2.438 . . . . 0.0 109.174 -175.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -73.51 -30.84 63.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 116.056 -1.926 . . . . 0.0 108.09 174.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -76.92 -31.47 56.69 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.794 1.179 . . . . 0.0 109.007 -175.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -71.0 -31.05 67.47 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 127.71 2.404 . . . . 0.0 113.517 173.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 45.3 t60 -66.61 -36.09 81.76 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.933 1.693 . . . . 0.0 112.186 164.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -83.63 -10.54 58.15 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 118.8 -2.437 . . . . 0.0 113.678 174.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -90.36 -23.31 21.13 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 118.3 -2.75 . . . . 0.0 110.12 171.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 1.8 t-105 -76.52 -34.96 58.55 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 120.097 1.317 . . . . 0.0 112.378 167.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 19.5 mt -70.11 -9.98 57.28 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 119.06 -1.056 . . . . 0.0 112.631 175.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -79.38 -32.28 43.07 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 129.024 2.93 . . . . 0.0 115.944 162.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -68.16 -29.84 68.81 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 115.066 -2.654 . . . . 0.0 112.939 163.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 98.1 t -73.37 -43.75 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 120.897 -1.127 . . . . 0.0 113.812 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -60.31 -52.72 64.05 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 171.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 14.4 tp -58.24 -34.87 70.92 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 114.737 -2.554 . . . . 0.0 110.994 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 55.5 tp -64.2 -57.07 10.57 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 128.762 2.825 . . . . 0.0 108.396 176.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.417 ' HE3' HE22 ' B' ' 31' ' ' GLN . 33.7 ttpt -47.04 -53.24 13.04 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 119.102 -2.249 . . . . 0.0 115.396 167.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -56.09 -40.82 74.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 117.7 -1.6 . . . . 0.0 110.507 177.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.28 -35.05 76.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.368 1.08 . . . . 0.0 113.471 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -60.61 -47.27 86.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 127.249 2.219 . . . . 0.0 111.963 173.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.417 HE22 ' HE3' ' B' ' 27' ' ' LYS . 40.8 mt-30 -56.87 -24.5 52.14 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 170.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -108.73 -3.45 17.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 131.264 3.825 . . . . 0.0 112.933 -171.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 61.17 35.67 18.4 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 126.463 2.352 . . . . 0.0 117.29 -174.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.8 mt -123.35 12.82 9.48 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 127.645 2.378 . . . . 0.0 116.219 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -59.9 -38.2 81.59 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 119.39 3.107 . . . . 0.0 119.39 175.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 2.0 mt -71.96 -48.15 11.11 Favored Pre-proline 0 N--CA 1.451 -0.414 0 O-C-N 124.728 1.268 . . . . 0.0 114.421 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -63.21 -27.83 72.73 Favored 'Trans proline' 0 N--CA 1.447 -1.218 0 C-N-CA 123.971 3.114 . . . . 0.0 112.528 172.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.6 tp -67.26 -47.26 71.25 Favored 'General case' 0 N--CA 1.449 -0.522 1 O-C-N 115.007 -4.808 . . . . 0.0 112.883 167.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 89.2 mt -65.43 -16.9 64.11 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.505 1.522 . . . . 0.0 115.066 170.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -81.92 -28.97 32.53 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 130.458 3.503 . . . . 0.0 110.332 166.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 60.5 tp -89.52 -26.24 20.99 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 118.776 -1.17 . . . . 0.0 112.956 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . 0.48 ' CE ' HG21 ' A' ' 58' ' ' VAL 0.259 15.4 mmt -95.97 -16.37 21.74 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 119.408 3.114 . . . . 0.0 119.408 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 31.9 mt -123.68 143.94 49.95 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.232 2.613 . . . . 0.0 109.797 174.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . 0.602 ' HB ' ' CD ' ' B' ' 45' ' ' PRO . 40.0 p -93.95 174.88 3.39 Favored Pre-proline 0 N--CA 1.452 -0.353 0 O-C-N 126.754 2.534 . . . . 0.0 112.134 177.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . 0.602 ' CD ' ' HB ' ' B' ' 44' ' ' THR . 37.4 Cg_exo -62.61 -46.42 11.6 Favored 'Trans proline' 0 N--CA 1.449 -1.1 0 CA-C-O 123.9 1.542 . . . . 0.0 112.714 -170.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -53.46 -40.6 65.4 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 116.108 -1.901 . . . . 0.0 115.329 172.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -75.36 -35.37 61.13 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 127.503 3.002 . . . . 0.0 117.305 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 43.9 mtm-85 -65.73 -47.93 73.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.245 2.218 . . . . 0.0 109.444 173.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -63.95 -35.86 82.08 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 176.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.98 -50.9 71.94 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.011 1.724 . . . . 0.0 113.629 160.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 30.6 mt -56.62 -45.59 81.43 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 116.396 -1.764 . . . . 0.0 107.531 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.51 -39.8 75.49 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-O 126.104 3.058 . . . . 0.0 119.717 174.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.5 m -74.61 -35.48 62.94 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 110.565 -2.817 . . . . 0.0 111.749 173.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . 0.305 96.6 mtt180 -56.58 -32.08 64.87 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 123.611 2.914 . . . . 0.0 112.971 170.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . 0.415 13.6 t -51.2 -51.46 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 120.619 1.554 . . . . 0.0 109.712 166.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -76.1 -33.09 59.49 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 117.308 2.336 . . . . 0.0 117.308 -174.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.43 ' HA ' HD13 ' B' ' 75' ' ' LEU . 42.1 mt -68.26 -39.62 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 CA-C-O 114.376 -2.726 . . . . 0.0 104.82 173.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.279 53.4 t -77.5 -35.44 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 1 CA-C-N 127.647 4.748 . . . . 0.0 112.08 -179.66 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -60.44 -34.0 73.35 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 125.736 2.684 . . . . 0.0 117.946 165.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -83.73 -33.73 25.02 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 114.185 -2.816 . . . . 0.0 107.84 -176.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 27.2 mt -43.15 -46.44 5.91 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 124.424 3.283 . . . . 0.0 114.43 157.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 17.1 mt -83.01 -21.09 33.97 Favored 'General case' 0 N--CA 1.451 -0.424 1 N-CA-C 122.756 4.354 . . . . 0.0 122.756 172.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 32.2 ttm105 -69.23 -49.22 58.4 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.83 47.36 8.68 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 118.417 2.127 . . . . 0.0 118.417 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . 0.284 66.4 mm-40 -117.66 -37.1 3.52 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 116.937 -1.506 . . . . 0.0 108.485 -171.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 90.8 mtp -100.12 123.3 44.2 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 123.623 2.92 . . . . 0.0 113.736 -162.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 97.4 p -64.18 162.66 14.07 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 125.077 1.486 . . . . 0.0 113.669 173.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -45.08 -33.66 2.25 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.659 1.984 . . . . 0.0 115.147 165.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -67.73 -52.01 42.55 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 127.062 3.315 . . . . 0.0 108.884 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -53.5 -48.12 69.25 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 118.073 -2.892 . . . . 0.0 116.237 173.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 59.8 mt -57.18 -39.22 74.91 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 123.316 1.532 . . . . 0.0 111.548 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 32.3 tptt -77.25 -51.79 10.32 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 112.036 -2.347 . . . . 0.0 109.724 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -82.54 -4.03 56.92 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 117.002 2.223 . . . . 0.0 117.002 -169.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -137.03 -12.02 1.69 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 113.241 -1.8 . . . . 0.0 111.442 -169.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' B' ' 57' ' ' ILE . 26.8 mt -134.53 7.73 3.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 113.388 -3.196 . . . . 0.0 111.74 177.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 60.65 16.66 46.07 Favored Glycine 0 CA--C 1.522 0.488 0 C-N-CA 129.742 3.544 . . . . 0.0 112.013 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.07 108.92 18.38 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 121.731 3.975 . . . . 0.0 121.731 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.0 175.54 53.07 Favored Glycine 0 CA--C 1.523 0.577 0 O-C-N 119.317 -2.114 . . . . 0.0 113.857 -174.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 6.4 mt -50.34 -43.16 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 O-C-N 120.061 -1.847 . . . . 0.0 115.361 176.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.76 -38.87 90.24 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.467 -2.645 . . . . 0.0 111.955 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 37.8 m -67.69 -52.04 42.56 Favored 'General case' 0 N--CA 1.444 -0.744 0 O-C-N 126.268 2.23 . . . . 0.0 109.223 -176.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 37.5 mm -65.91 -41.52 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-O 115.472 -2.204 . . . . 0.0 110.51 176.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 98.3 m -54.71 -65.63 0.54 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 124.034 3.107 . . . . 0.0 109.344 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -49.85 -42.03 46.57 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 117.215 2.302 . . . . 0.0 117.215 167.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -39.09 -60.86 1.51 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 118.634 2.214 . . . . 0.0 118.634 162.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 91.6 p -75.46 -21.06 58.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 128.902 2.881 . . . . 0.0 110.806 -175.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -71.54 -33.86 69.51 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 117.206 2.298 . . . . 0.0 117.206 163.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 2.4 m -72.7 -30.82 64.53 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 116.519 -1.705 . . . . 0.0 109.998 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 11.6 mt -59.59 -52.64 64.69 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 124.391 3.269 . . . . 0.0 116.473 166.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 50.5 tttm -63.81 -19.81 65.3 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -176.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.46 -22.1 32.68 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 114.842 -2.504 . . . . 0.0 116.892 167.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.99 151.01 97.58 Favored Pre-proline 0 N--CA 1.451 -0.394 0 CA-C-N 121.868 2.122 . . . . 0.0 114.629 -169.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . 0.274 52.4 Cg_exo -49.85 133.98 34.33 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 124.844 3.696 . . . . 0.0 114.154 163.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.418 HG12 ' NH1' ' B' ' 97' ' ' ARG . 22.4 m -73.41 -25.61 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -158.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 12.9 pm0 -62.09 -31.48 71.93 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 118.018 -0.992 . . . . 0.0 109.55 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 33.7 tp -74.27 -46.31 42.14 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 120.09 1.314 . . . . 0.0 107.472 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . 0.418 ' NH1' HG12 ' B' ' 94' ' ' VAL . 19.3 mtm-85 -59.26 -34.06 71.8 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -71.41 -27.28 63.19 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 30.3 t90 -81.78 -50.1 9.63 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 131.454 3.902 . . . . 0.0 111.978 173.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 40.0 mt -69.29 -19.71 63.9 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 116.518 -1.706 . . . . 0.0 115.55 -170.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -60.29 -36.6 78.25 Favored 'General case' 0 N--CA 1.452 -0.355 1 CA-C-O 111.663 -4.018 . . . . 0.0 114.91 174.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -86.17 -36.88 19.24 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 123.574 2.897 . . . . 0.0 112.422 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 37.5 t -49.97 -61.74 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 126.292 1.837 . . . . 0.0 108.566 169.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 80.4 mt -78.16 -48.62 15.52 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 118.168 -1.413 . . . . 0.0 111.13 -165.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 57.4 mt -88.86 27.86 1.26 Allowed 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.886 -2.384 . . . . 0.0 110.642 -164.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -130.01 7.42 5.1 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 128.244 2.618 . . . . 0.0 111.983 171.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 71.2 m -87.73 -9.4 54.14 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.347 2.659 . . . . 0.0 115.098 163.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.683 2.793 . . . . 0.0 109.596 168.636 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 44.4 ttm . . . . . 0 N--CA 1.474 0.732 0 CA-C-O 117.787 -1.102 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.38 136.77 57.44 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.421 1.488 . . . . 0.0 110.296 175.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -104.27 163.15 12.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.969 2.508 . . . . 0.0 112.951 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -158.72 146.08 17.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 116.914 -3.616 . . . . 0.0 108.896 -169.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 59.0 p -154.66 173.81 4.44 Favored Pre-proline 0 N--CA 1.452 -0.326 0 C-N-CA 127.796 2.439 . . . . 0.0 117.512 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -69.62 -29.6 24.27 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 120.926 1.084 . . . . 0.0 113.412 171.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -150.1 145.99 26.66 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.696 2.398 . . . . 0.0 111.763 -171.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t -153.44 129.25 10.16 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 170.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.41 -24.98 67.7 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 114.783 -2.532 . . . . 0.0 112.138 176.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.27 -21.72 66.29 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 116.521 -1.704 . . . . 0.0 114.867 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 58.9 mtt -85.77 -34.35 21.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 127.179 2.799 . . . . 0.0 109.386 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.09 -33.06 75.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 123.347 1.546 . . . . 0.0 110.565 173.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -78.22 -23.75 47.32 Favored 'General case' 0 N--CA 1.449 -0.495 1 O-C-N 115.375 -4.578 . . . . 0.0 114.294 178.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -84.2 -38.11 20.99 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.685 -1.15 . . . . 0.0 111.797 175.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -37.78 82.42 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 118.603 0.638 . . . . 0.0 112.174 169.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -59.58 -35.68 74.76 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 116.637 -2.025 . . . . 0.0 113.762 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -75.04 -35.93 61.88 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 130.002 3.321 . . . . 0.0 110.056 -176.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -67.9 -50.53 55.68 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.559 1.144 . . . . 0.0 111.796 173.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 17.5 t-105 -58.39 -46.09 87.05 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 117.673 2.471 . . . . 0.0 117.673 167.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -66.11 -21.94 66.38 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 113.607 -3.092 . . . . 0.0 114.279 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -60.67 -44.76 96.1 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 122.148 2.249 . . . . 0.0 112.947 165.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -57.0 -44.03 82.33 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 128.108 2.563 . . . . 0.0 105.321 -176.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 34.2 t -67.2 -34.24 68.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 116.828 -1.558 . . . . 0.0 113.682 -177.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -84.19 -43.53 14.85 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 125.859 1.974 . . . . 0.0 109.139 -172.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 21.1 tp -56.97 -37.47 71.62 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 117.159 -1.4 . . . . 0.0 109.779 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 17.1 tp -76.83 -31.84 57.16 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 120.014 1.279 . . . . 0.0 109.529 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -59.2 -46.14 89.2 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 126.725 2.01 . . . . 0.0 114.989 169.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -60.96 -36.86 80.51 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 129.768 3.227 . . . . 0.0 113.644 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.28 -25.42 62.44 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 128.253 2.621 . . . . 0.0 114.271 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -61.52 -25.65 67.42 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.896 2.078 . . . . 0.0 112.754 169.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -93.44 -0.92 56.28 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 118.44 -2.663 . . . . 0.0 113.097 -174.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -134.97 18.42 3.47 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 120.759 1.618 . . . . 0.0 114.139 165.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 67.02 20.12 10.46 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.865 1.266 . . . . 0.0 113.885 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 94.2 mt -85.35 10.5 12.49 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 174.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -74.68 -40.11 61.59 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 118.243 -2.785 . . . . 0.0 112.872 -171.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.285 26.0 mt -62.61 -52.94 61.35 Favored Pre-proline 0 N--CA 1.446 -0.644 0 C-N-CA 129.405 3.082 . . . . 0.0 113.692 167.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -55.28 -41.93 73.51 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 N-CA-C 117.563 2.101 . . . . 0.0 117.563 170.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 64.0 tp -56.48 -37.85 70.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.132 1.373 . . . . 0.0 112.935 171.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 32.7 mt -92.08 -5.87 51.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -84.03 -21.51 31.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.463 1.905 . . . . 0.0 110.017 163.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 27.4 tp -83.26 -45.02 14.31 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 126.696 3.141 . . . . 0.0 116.524 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . 0.412 ' C ' HD12 ' C' ' 43' ' ' LEU . 3.9 mmt -87.2 -7.52 57.85 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 111.616 -2.538 . . . . 0.0 114.899 -162.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . 0.412 HD12 ' C ' ' C' ' 42' ' ' MET . 10.0 mp -137.28 161.09 37.18 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 127.247 2.219 . . . . 0.0 109.28 -175.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . 0.441 ' HB ' ' HD2' ' C' ' 45' ' ' PRO . 23.3 p -100.38 164.97 15.29 Favored Pre-proline 0 N--CA 1.449 -0.495 0 O-C-N 119.231 -2.168 . . . . 0.0 110.465 172.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . 0.441 ' HD2' ' HB ' ' C' ' 44' ' ' THR . 4.6 Cg_exo -41.28 -46.55 5.57 Favored 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 123.352 2.701 . . . . 0.0 115.036 171.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.75 -13.54 58.89 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 127.162 2.789 . . . . 0.0 115.286 -174.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -87.78 -30.22 20.42 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 131.229 3.812 . . . . 0.0 112.132 174.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 87.5 mtm-85 -71.33 -43.03 67.79 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 116.762 -1.589 . . . . 0.0 113.738 163.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -64.21 -23.69 67.4 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 125.083 1.489 . . . . 0.0 111.759 172.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.45 -50.36 70.07 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 127.652 2.381 . . . . 0.0 109.838 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 17.0 mt -77.57 -32.44 53.78 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 118.174 -2.828 . . . . 0.0 114.364 176.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.58 -44.73 85.93 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 118.677 -1.725 . . . . 0.0 115.157 164.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 26.9 m -73.15 -30.73 63.79 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 113.932 -2.937 . . . . 0.0 114.421 169.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 23.0 mtt180 -68.71 -36.14 78.06 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 125.891 3.95 . . . . 0.0 115.288 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 14.3 t -57.24 -36.54 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 129.253 3.021 . . . . 0.0 108.786 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 24.1 mtp180 -78.7 -24.07 45.22 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 121.49 0.662 . . . . 0.0 110.545 -176.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 61.8 mt -65.95 -49.4 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 O-C-N 117.691 -3.13 . . . . 0.0 108.174 174.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 96.6 t -53.57 -53.25 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 C-N-CA 128.512 2.725 . . . . 0.0 112.637 173.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -58.56 -39.3 79.9 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.433 1.493 . . . . 0.0 112.333 174.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -80.11 -37.33 33.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 120.927 1.694 . . . . 0.0 111.918 -177.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 80.8 mt -59.43 -36.8 76.58 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 169.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 70.8 mt -84.47 -36.2 22.46 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 125.05 1.469 . . . . 0.0 111.378 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' C' ' 63' ' ' ARG . 34.1 ttm180 -52.69 -60.76 2.87 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 117.579 -3.201 . . . . 0.0 110.357 173.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.7 49.29 6.19 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 130.65 3.976 . . . . 0.0 114.594 174.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -123.95 18.85 9.3 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 126.132 2.873 . . . . 0.0 113.372 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 14.5 mtt -116.45 131.91 56.82 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 117.07 -3.519 . . . . 0.0 110.015 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 54.2 p -95.37 162.78 13.52 Favored 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 132.424 4.29 . . . . 0.0 110.935 175.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -50.03 -33.28 17.63 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 116.65 2.093 . . . . 0.0 116.65 -169.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -72.59 -40.03 66.89 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.032 0.933 . . . . 0.0 111.336 177.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -68.08 -36.95 80.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 172.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 48.3 mt -55.67 -37.73 68.68 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.072 1.749 . . . . 0.0 112.066 164.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . 0.363 83.7 tttt -66.75 -63.33 1.09 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.114 0.566 . . . . 0.0 112.45 170.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -70.14 -42.56 72.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 115.284 -2.293 . . . . 0.0 111.154 -169.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -86.41 -48.81 8.11 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 122.391 2.359 . . . . 0.0 116.025 176.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.413 5.3 mp -74.28 -46.4 41.53 Favored 'General case' 0 N--CA 1.451 -0.377 1 CA-C-N 126.611 4.278 . . . . 0.0 113.62 -173.09 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.23 -160.74 52.55 Favored Glycine 0 C--N 1.338 0.639 0 C-N-CA 129.574 3.464 . . . . 0.0 113.12 -175.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -52.77 -27.77 19.42 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 116.352 1.982 . . . . 0.0 116.352 171.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.58 -19.19 26.21 Favored Glycine 0 C--N 1.338 0.661 1 CA-C-O 110.691 -5.505 . . . . 0.0 115.127 175.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 6.3 tt -55.36 -33.66 32.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 1 O-C-N 130.606 4.357 . . . . 0.0 110.683 176.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.54 -40.62 61.59 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.901 -2.999 . . . . 0.0 113.195 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 22.0 m -47.52 -30.53 3.58 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 116.907 2.188 . . . . 0.0 116.907 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 30.8 mm -109.32 -6.63 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 128.318 2.647 . . . . 0.0 115.481 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.9 p -118.94 -17.58 9.03 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 118.483 2.771 . . . . 0.0 118.483 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -105.4 134.51 48.4 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.441 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 108.08 171.55 21.63 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 125.895 1.712 . . . . 0.0 114.584 168.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 89.3 p -65.94 -21.76 66.45 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.163 2.481 . . . . 0.0 116.868 -171.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 57.1 m-80 -95.45 13.44 25.92 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 127.136 2.772 . . . . 0.0 115.754 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 48.7 p -77.73 172.22 13.75 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 128.459 3.981 . . . . 0.0 113.607 -173.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 40.9 tp -59.91 -28.94 68.02 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 117.621 -3.174 . . . . 0.0 113.737 -165.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -108.2 13.04 26.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.214 -2.179 . . . . 0.0 111.4 -177.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -132.09 -33.86 1.3 Allowed 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -27.92 149.14 0.03 OUTLIER Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 127.514 2.326 . . . . 0.0 115.199 147.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -62.27 153.81 67.58 Favored 'Trans proline' 0 N--CA 1.45 -1.077 0 CA-C-O 125.577 2.241 . . . . 0.0 110.722 -175.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 47.8 t -69.08 -50.53 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 C-N-CA 129.91 3.284 . . . . 0.0 106.762 -172.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -46.19 -36.96 6.49 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 123.301 1.524 . . . . 0.0 113.277 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 23.1 tp -76.07 -43.26 44.49 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 117.443 -3.286 . . . . 0.0 108.474 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -66.1 -37.85 86.79 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 115.042 -2.409 . . . . 0.0 106.428 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -66.05 -55.81 14.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 128.707 2.803 . . . . 0.0 110.003 178.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -52.64 -47.36 67.11 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 128.193 3.433 . . . . 0.0 112.362 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 45.3 mt -61.31 -35.76 78.23 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 129.212 3.005 . . . . 0.0 111.913 173.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -72.21 -42.52 65.67 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 116.781 -3.699 . . . . 0.0 112.64 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -56.48 -47.23 79.69 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 129.52 3.128 . . . . 0.0 106.368 176.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 96.4 t -82.2 -62.12 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 124.631 2.158 . . . . 0.0 113.602 -173.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 69.0 mt -71.42 -14.64 62.22 Favored 'General case' 0 N--CA 1.443 -0.775 0 O-C-N 117.318 -3.364 . . . . 0.0 118.214 -172.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 70.6 mt -129.73 39.83 3.66 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 115.375 1.621 . . . . 0.0 115.375 -177.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 46.6 pttt . . . . . 0 N--CA 1.449 -0.502 0 O-C-N 120.966 -1.084 . . . . 0.0 113.766 -173.385 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 61.2 p . . . . . 0 N--CA 1.447 -0.624 0 CA-C-O 114.026 -2.892 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -74.67 -54.97 0.08 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.039 0 CA-C-N 124.473 2.633 . . . . 0.0 108.127 -172.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -125.33 146.56 49.52 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-O 116.674 -1.632 . . . . 0.0 111.403 147.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 38.4 t -76.49 133.45 39.79 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 115.778 -2.058 . . . . 0.0 109.778 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.24 -15.3 0.89 Allowed 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 117.904 2.557 . . . . 0.0 117.904 162.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . 0.262 . . -81.95 -35.81 28.65 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 128.257 3.885 . . . . 0.0 113.727 177.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 2.0 mmm -79.59 -31.07 41.74 Favored 'General case' 0 N--CA 1.452 -0.34 1 O-C-N 116.177 -4.077 . . . . 0.0 113.182 167.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.45 94.94 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 118.205 -2.809 . . . . 0.0 112.793 173.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -46.3 -54.66 8.51 Favored 'General case' 0 N--CA 1.45 -0.425 1 CA-C-O 130.069 4.747 . . . . 0.0 115.953 165.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -64.67 -39.94 94.56 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 109.563 -3.471 . . . . 0.0 113.362 -169.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -16.23 63.08 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 176.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -85.0 -35.86 21.68 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -94.43 -29.36 15.01 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.603 1.961 . . . . 0.0 113.517 -166.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -69.02 -10.15 56.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 113.91 -2.948 . . . . 0.0 110.442 156.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . 0.35 2.7 t-105 -82.8 -38.04 23.67 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 124.4 3.273 . . . . 0.0 110.501 173.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' D' ' 20' ' ' LEU . 41.7 mt -71.14 -20.01 62.36 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 113.306 -1.77 . . . . 0.0 111.379 174.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 36.2 ttt180 -64.11 -35.34 80.45 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 121.356 1.889 . . . . 0.0 112.855 167.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -72.85 -47.2 48.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.591 1.957 . . . . 0.0 111.455 168.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . 0.439 18.4 t -58.25 -41.48 81.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 O-C-N 117.447 -3.283 . . . . 0.0 107.782 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -71.7 -31.66 66.99 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 176.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 22.6 tp -70.94 -36.59 72.66 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 123.587 1.661 . . . . 0.0 113.553 171.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 25.1 tp -68.51 -38.72 81.18 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 119.535 -1.978 . . . . 0.0 112.302 172.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 ttpp -58.75 -50.89 72.23 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.749 -3.095 . . . . 0.0 111.009 174.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -60.17 -21.08 61.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.181 -2.199 . . . . 0.0 115.677 175.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . 0.609 ' HB1' ' HA ' ' D' ' 35' ' ' HIS . . . -79.64 -46.47 17.13 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 127.004 2.122 . . . . 0.0 110.012 174.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -58.29 -21.8 50.29 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 121.706 2.048 . . . . 0.0 112.943 173.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -85.46 -14.68 45.35 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.156 1.382 . . . . 0.0 114.587 -171.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -128.3 10.12 6.23 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 120.163 -1.585 . . . . 0.0 113.915 173.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 52.45 38.14 24.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 -172.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 21.1 mt -99.2 16.9 21.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 119.175 3.028 . . . . 0.0 119.175 159.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . 0.609 ' HA ' ' HB1' ' D' ' 29' ' ' ALA . 18.1 p-80 -67.58 -60.88 2.2 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.319 3.448 . . . . 0.0 108.839 -171.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.98 -29.6 3.17 Favored Pre-proline 0 N--CA 1.449 -0.511 0 CA-C-O 116.372 -1.775 . . . . 0.0 114.104 -174.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.286 53.9 Cg_exo -68.13 -29.89 32.48 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 N-CA-C 116.044 1.517 . . . . 0.0 116.044 164.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 18.7 tp -71.77 -46.87 57.0 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 115.445 -2.217 . . . . 0.0 112.49 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 20.4 mt -55.28 -44.03 75.28 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 126.144 2.153 . . . . 0.0 116.577 170.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -77.32 -27.65 52.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.833 3.208 . . . . 0.0 112.153 -176.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 23.9 tp -54.39 -50.3 67.86 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 117.209 -3.432 . . . . 0.0 111.76 162.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 16.9 mmt -73.19 -39.42 65.61 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 119.604 3.187 . . . . 0.0 119.604 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 21.5 mt -114.52 129.73 56.69 Favored 'General case' 0 N--CA 1.447 -0.587 1 O-C-N 116.056 -4.153 . . . . 0.0 109.695 -167.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . 0.414 ' HB ' ' HD2' ' D' ' 45' ' ' PRO . 70.8 p -77.38 159.44 77.5 Favored Pre-proline 0 N--CA 1.449 -0.518 0 C-N-CA 126.526 1.93 . . . . 0.0 109.545 176.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . 0.414 ' HD2' ' HB ' ' D' ' 44' ' ' THR . 72.2 Cg_exo -46.37 -38.38 20.56 Favored 'Trans proline' 0 N--CA 1.449 -1.11 1 C-N-CA 125.982 4.455 . . . . 0.0 116.557 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -76.2 -29.09 57.49 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 117.58 -3.2 . . . . 0.0 110.953 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -70.94 -43.85 67.32 Favored 'General case' 0 N--CA 1.446 -0.665 1 O-C-N 116.091 -4.13 . . . . 0.0 104.376 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 13.4 mtm-85 -61.69 -37.64 84.86 Favored 'General case' 0 N--CA 1.448 -0.54 1 O-C-N 114.985 -4.822 . . . . 0.0 114.012 169.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -69.88 -38.35 76.35 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.11 -28.32 66.37 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 116.604 -1.665 . . . . 0.0 111.019 165.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . 0.271 21.3 mt -74.26 -39.46 62.99 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 123.921 3.055 . . . . 0.0 113.699 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -56.0 -39.51 79.51 Favored Glycine 0 C--N 1.333 0.385 0 CA-C-O 122.445 1.025 . . . . 0.0 113.885 167.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 73.7 m -80.17 -28.02 38.86 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.574 -0.813 . . . . 0.0 110.813 -174.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -71.04 -20.87 62.33 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 116.99 -3.569 . . . . 0.0 112.074 175.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.95 -45.52 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 166.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.579 2.7 ptm180 -68.74 -37.34 79.35 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 128.05 2.54 . . . . 0.0 115.698 173.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 27.8 mt -60.1 -46.21 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 119.945 -1.722 . . . . 0.0 108.3 172.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 47.0 t -66.0 -38.54 82.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 CA-C-N 122.669 2.486 . . . . 0.0 113.387 178.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -62.65 -40.9 98.49 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.343 -1.313 . . . . 0.0 109.179 -177.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -82.31 -22.92 35.41 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 115.189 -2.339 . . . . 0.0 108.32 -176.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 25.9 mt -62.65 -37.6 87.03 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 120.774 1.624 . . . . 0.0 111.219 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 32.1 mt -70.3 -43.63 69.99 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 125.653 1.846 . . . . 0.0 114.3 172.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . 0.37 32.0 ttm180 -74.1 -37.9 64.01 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 128.437 2.695 . . . . 0.0 111.744 -172.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 48.31 46.04 28.32 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 122.593 3.797 . . . . 0.0 122.593 170.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -126.94 -35.99 2.23 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 127.485 2.314 . . . . 0.0 110.032 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 20.5 mtt -74.7 51.1 0.46 Allowed 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 147.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 49.6 p -76.13 -172.88 2.18 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -173.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.333 35.5 tp60 68.23 -78.33 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 115.545 -2.169 . . . . 0.0 114.73 159.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 20.1 ttt85 -106.09 -35.76 7.14 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 128.918 2.887 . . . . 0.0 111.668 176.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -76.64 -18.4 58.61 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -168.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -38.61 65.34 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 124.591 1.182 . . . . 0.0 109.217 176.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -78.25 -21.79 49.35 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 118.181 -2.824 . . . . 0.0 115.941 172.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -121.8 -7.31 9.03 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 126.905 2.628 . . . . 0.0 113.503 -156.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -119.0 -41.02 2.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 128.489 2.716 . . . . 0.0 109.607 168.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.08 -29.1 27.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 119.246 0.93 . . . . 0.0 109.344 177.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 76.76 179.53 48.04 Favored Glycine 0 CA--C 1.523 0.545 0 O-C-N 118.899 -2.376 . . . . 0.0 114.296 157.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.06 -8.49 30.78 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.546 -2.738 . . . . 0.0 116.229 -148.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.75 -19.19 73.02 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-O 117.22 -1.878 . . . . 0.0 108.793 173.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 11.5 tt -47.95 -18.44 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 121.15 2.475 . . . . 0.0 114.715 167.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.2 -25.19 12.56 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 118.777 -2.452 . . . . 0.0 109.061 -168.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 7.6 m -64.6 -35.9 82.49 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 116.995 -3.566 . . . . 0.0 113.767 150.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 19.0 mm -82.64 -14.63 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 118.266 -2.771 . . . . 0.0 112.867 -171.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 77.6 p -120.68 -16.86 8.16 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.621 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -99.46 173.53 6.71 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 123.241 2.746 . . . . 0.0 106.811 169.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.01 151.67 26.9 Favored Glycine 0 C--N 1.337 0.612 0 O-C-N 119.979 -1.701 . . . . 0.0 113.566 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 5.7 p -69.46 -11.37 60.77 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 118.976 -2.485 . . . . 0.0 115.437 -151.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -150.27 42.46 0.84 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 127.164 3.364 . . . . 0.0 112.427 -176.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 1.4 p -64.2 168.82 5.07 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 127.42 2.288 . . . . 0.0 115.057 166.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.316 7.0 tt -64.16 -30.51 71.57 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 120.11 -1.619 . . . . 0.0 112.933 171.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 62.5 tttt -62.32 -38.46 89.54 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 127.581 2.352 . . . . 0.0 108.977 169.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -85.28 -27.27 26.09 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 120.477 -1.389 . . . . 0.0 111.383 -163.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . 0.738 ' HB1' HG22 ' D' ' 94' ' ' VAL 0.285 . . 62.67 77.79 0.32 Allowed Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 127.075 2.15 . . . . 0.0 108.453 163.078 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . 0.471 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 95.8 Cg_exo 21.62 29.29 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.18 0 N-CA-C 122.223 3.893 . . . . 0.0 122.223 46.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . 0.738 HG22 ' HB1' ' D' ' 92' ' ' ALA . 2.9 t -57.09 -36.42 51.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 C-N-CA 130.717 3.607 . . . . 0.0 110.546 -171.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.61 -40.28 49.87 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 113.217 -1.81 . . . . 0.0 114.225 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 48.3 tp -52.19 -53.15 46.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 130.667 3.587 . . . . 0.0 106.857 165.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -50.42 -45.63 55.86 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 174.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -63.35 -32.31 73.7 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 128.373 2.669 . . . . 0.0 114.126 -176.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 77.2 t90 -80.85 -44.08 18.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 125.69 2.662 . . . . 0.0 114.47 -178.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 70.1 mt -61.94 -32.19 72.58 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 117.236 -3.415 . . . . 0.0 111.324 165.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -69.59 -19.58 63.66 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 118.902 2.927 . . . . 0.0 118.902 178.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -90.02 -44.93 9.51 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 119.164 -2.21 . . . . 0.0 108.856 171.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 37.6 t -84.42 -34.33 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 O-C-N 119.517 -1.99 . . . . 0.0 110.682 -168.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 64.2 mt -90.34 -34.41 15.7 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 117.848 -3.033 . . . . 0.0 110.225 -172.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 22.5 mt -91.2 15.58 11.57 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 128.494 2.717 . . . . 0.0 111.328 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 7.4 pttp -55.32 158.88 2.92 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 130.6 3.56 . . . . 0.0 108.294 154.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 75.1 m -116.4 23.26 12.22 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 116.854 -1.546 . . . . 0.0 109.812 -164.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 C--O 1.25 1.097 0 C-N-CA 129.409 3.084 . . . . 0.0 115.232 153.98 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 41.2 ttp . . . . . 0 N--CA 1.448 -0.538 0 CA-C-O 113.949 -2.929 . . . . 0.0 111.915 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -50.56 -48.36 57.44 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 121.731 2.06 . . . . 0.0 112.554 169.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -67.86 -39.41 83.79 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 126.157 2.884 . . . . 0.0 113.471 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -62.72 -42.96 99.91 Favored 'General case' 0 N--CA 1.449 -0.491 1 O-C-N 116.196 -4.065 . . . . 0.0 112.239 -178.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.3 22.6 mmt180 -74.38 -38.14 63.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 125.597 1.811 . . . . 0.0 111.723 -171.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -53.76 -40.52 66.27 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 161.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -40.98 96.47 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 117.422 -3.299 . . . . 0.0 111.998 177.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -60.73 -27.37 67.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.835 1.654 . . . . 0.0 112.395 177.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 8.6 t-105 -83.84 -49.52 8.97 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.777 1.631 . . . . 0.0 111.77 171.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.9 mt -58.17 -24.73 60.0 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.946 -1.721 . . . . 0.0 113.447 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -63.74 -45.16 91.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 114.527 -1.215 . . . . 0.0 112.013 173.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -61.26 -45.04 96.18 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 124.649 1.218 . . . . 0.0 109.52 172.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.5 t -60.55 -32.0 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 125.23 1.581 . . . . 0.0 111.58 -176.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.91 -38.01 69.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 118.841 2.904 . . . . 0.0 118.841 160.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 28.1 tp -57.54 -49.69 75.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.359 1.063 . . . . 0.0 110.263 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 54.0 tp -70.22 -31.45 68.88 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 113.645 -3.074 . . . . 0.0 113.998 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -61.58 -44.43 97.03 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 128.165 3.416 . . . . 0.0 111.527 168.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -71.33 -26.82 62.99 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 114.022 -1.444 . . . . 0.0 113.05 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.1 -40.56 78.31 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 118.887 -2.383 . . . . 0.0 112.215 167.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.429 ' CE1' ' CD2' ' A' ' 35' ' ' HIS . 53.8 m-85 -55.58 -40.53 72.1 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 116.454 -3.904 . . . . 0.0 113.999 159.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -64.0 -32.97 74.7 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.71 2.05 . . . . 0.0 112.359 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -109.09 10.68 25.99 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 128.376 2.671 . . . . 0.0 114.64 -172.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 63.65 25.26 14.22 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 124.191 1.948 . . . . 0.0 114.911 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.9 mt -107.14 20.98 18.24 Favored 'General case' 0 N--CA 1.449 -0.488 1 O-C-N 116.13 -4.106 . . . . 0.0 115.866 164.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.429 ' CD2' ' CE1' ' A' ' 30' ' ' TYR . 46.7 p-80 -67.62 -32.63 73.47 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.824 -3.048 . . . . 0.0 113.483 175.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.286 14.4 mt -73.0 -43.63 7.87 Favored Pre-proline 0 N--CA 1.448 -0.553 0 CA-C-O 114.636 -2.602 . . . . 0.0 110.588 176.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -59.19 -37.84 89.46 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 CA-C-N 123.195 2.177 . . . . 0.0 111.993 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.0 tp -64.34 -40.54 96.09 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 116.241 -1.837 . . . . 0.0 112.631 175.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.8 mt -77.5 -17.09 58.31 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 121.573 1.988 . . . . 0.0 114.661 -171.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -74.96 -29.89 61.05 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 169.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tt -88.44 -42.87 11.87 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.933 -2.461 . . . . 0.0 106.747 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.4 mmm -67.55 -25.01 65.6 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 113.474 -3.155 . . . . 0.0 118.433 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.2 mt -129.25 140.62 51.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 126.279 2.237 . . . . 0.0 109.435 177.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.2 p -72.44 157.35 89.24 Favored Pre-proline 0 N--CA 1.452 -0.369 0 C-N-CA 127.103 2.161 . . . . 0.0 111.608 175.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -51.18 -42.85 51.87 Favored 'Trans proline' 0 N--CA 1.447 -1.253 1 C-N-CA 127.51 5.473 . . . . 0.0 117.746 172.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -70.73 -39.81 73.15 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 116.49 -1.719 . . . . 0.0 115.543 169.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . 0.299 71.9 mt-10 -50.52 -54.26 23.72 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 168.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.7 mtm-85 -61.67 -41.91 98.2 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 117.584 -3.197 . . . . 0.0 112.352 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -73.3 -10.12 59.42 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 120.473 1.488 . . . . 0.0 108.607 -176.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.43 -35.15 12.46 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 119.469 -2.02 . . . . 0.0 113.425 170.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.14 -24.63 62.3 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 178.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.03 -40.62 99.16 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 118.133 -1.984 . . . . 0.0 115.862 157.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 74.8 m -74.18 -29.55 61.81 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 118.634 1.217 . . . . 0.0 111.421 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -59.75 -29.18 67.98 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 116.513 -3.867 . . . . 0.0 112.213 171.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.8 t -75.74 -36.93 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-N 119.87 1.214 . . . . 0.0 109.512 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.2 mtp180 -59.1 -40.94 86.88 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 118.886 -2.384 . . . . 0.0 109.752 168.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.271 74.9 mt -65.18 -50.07 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 C-N-CA 126.163 1.785 . . . . 0.0 110.485 -177.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.1 -39.64 86.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 120.399 -1.438 . . . . 0.0 109.747 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -52.93 -55.37 23.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 121.51 1.959 . . . . 0.0 111.209 173.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -67.95 -22.72 65.03 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 117.159 -3.463 . . . . 0.0 110.638 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.8 mt -87.75 -24.4 23.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 177.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.311 29.3 tp -81.25 -22.94 38.35 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.999 2.12 . . . . 0.0 115.062 163.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . 0.292 45.7 ttm180 -77.57 -55.16 5.6 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.687 -2.508 . . . . 0.0 112.615 175.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.92 10.17 84.39 Favored Glycine 0 CA--C 1.521 0.432 1 N-CA-C 123.72 4.248 . . . . 0.0 123.72 -175.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.306 74.6 mm-40 -106.48 -24.4 12.22 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -172.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.7 ttm -78.27 126.43 30.78 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 126.418 2.324 . . . . 0.0 111.158 155.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.3 p -81.01 162.66 23.72 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 119.389 -2.069 . . . . 0.0 115.667 177.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -55.21 -35.29 64.71 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 120.67 1.577 . . . . 0.0 111.078 172.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.7 tpt85 -72.99 -21.75 60.79 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 119.122 -2.236 . . . . 0.0 110.318 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -86.79 -33.11 20.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 122.028 2.194 . . . . 0.0 110.428 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.3 mt -63.27 -30.88 71.94 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 118.62 -2.55 . . . . 0.0 109.45 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -62.65 -31.15 71.97 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 128.594 2.758 . . . . 0.0 111.133 176.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -101.22 -37.58 8.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 121.72 2.054 . . . . 0.0 112.563 175.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -98.03 -20.53 17.33 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 119.149 -2.219 . . . . 0.0 110.412 -157.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.6 mt -114.27 -8.92 12.88 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 127.72 2.408 . . . . 0.0 110.018 162.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 86.73 10.56 72.57 Favored Glycine 0 CA--C 1.523 0.539 1 O-C-N 114.822 -4.924 . . . . 0.0 115.676 170.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -96.17 121.32 37.82 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 130.401 3.48 . . . . 0.0 115.894 -162.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.16 153.33 51.87 Favored Glycine 0 C--N 1.339 0.713 0 N-CA-C 118.79 2.276 . . . . 0.0 118.79 -176.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 14.5 mt -58.5 -34.92 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 O-C-N 117.036 -3.626 . . . . 0.0 114.202 -164.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.04 -34.06 50.73 Favored 'General case' 0 N--CA 1.452 -0.363 1 O-C-N 115.944 -4.223 . . . . 0.0 116.085 -168.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 48.3 p -78.14 -30.69 49.43 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 119.713 -1.867 . . . . 0.0 108.548 173.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.286 14.5 mm -65.18 -48.17 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 O-C-N 126.04 2.088 . . . . 0.0 110.224 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 45.7 m -58.51 -43.73 89.21 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.047 -0.977 . . . . 0.0 112.824 170.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -61.14 -50.47 73.05 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 -176.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -59.96 -35.94 88.65 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-N 122.336 2.335 . . . . 0.0 113.097 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 71.0 m -60.93 -45.67 93.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -58.22 -43.4 87.68 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 117.139 -3.475 . . . . 0.0 114.784 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.0 m -63.85 -26.44 68.61 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.888 1.675 . . . . 0.0 111.421 176.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.3 tp -83.28 -35.33 25.38 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 113.114 -3.327 . . . . 0.0 109.015 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -70.34 -29.26 65.91 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 127.894 3.247 . . . . 0.0 112.662 170.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.74 3.01 56.41 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.667 1.187 . . . . 0.0 110.71 173.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.99 145.4 77.39 Favored Pre-proline 0 N--CA 1.447 -0.578 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.65 152.37 78.09 Favored 'Trans proline' 0 N--CA 1.451 -0.99 0 C-N-CA 117.17 -1.42 . . . . 0.0 114.628 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -57.76 -42.04 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-O 115.665 -2.112 . . . . 0.0 114.212 -174.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -48.11 -40.98 25.16 Favored 'General case' 0 N--CA 1.453 -0.289 1 O-C-N 130.585 4.928 . . . . 0.0 115.794 173.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 39.3 tp -75.71 -50.01 16.62 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.974 1.368 . . . . 0.0 111.248 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -57.02 -46.76 82.1 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 117.971 -2.956 . . . . 0.0 111.317 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -66.09 -34.51 78.22 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 120.467 -1.395 . . . . 0.0 111.128 -174.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 60.2 t90 -77.34 -34.69 55.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.425 -2.672 . . . . 0.0 109.336 -178.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.7 mt -78.66 -22.98 46.0 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 117.951 -2.968 . . . . 0.0 104.856 -174.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -63.59 -32.61 74.13 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 128.74 2.816 . . . . 0.0 111.733 170.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -87.78 -19.21 27.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 129.098 2.959 . . . . 0.0 112.431 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.8 t -101.37 -61.83 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 80.3 mt -87.4 -19.93 27.39 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 118.006 -2.934 . . . . 0.0 115.331 -162.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.2 mt -106.67 0.51 24.38 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 118.707 -2.496 . . . . 0.0 114.809 178.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.0 tttp . . . . . 0 N--CA 1.45 -0.475 0 N-CA-C 117.669 2.47 . . . . 0.0 117.669 -176.565 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.727 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 38.6 mtt -69.06 -35.32 76.43 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 121.681 2.037 . . . . 0.0 110.245 168.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.22 -35.87 80.23 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.048 0.928 . . . . 0.0 111.681 178.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -64.6 -52.99 54.64 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 115.715 -2.088 . . . . 0.0 112.632 164.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 42.6 tp60 -60.53 -28.09 68.14 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 123.598 2.908 . . . . 0.0 117.192 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -77.22 -38.3 51.59 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 126.333 2.968 . . . . 0.0 117.096 172.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -52.24 -51.72 56.71 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.007 -2.933 . . . . 0.0 107.812 169.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -53.79 -36.14 62.11 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 126.468 2.355 . . . . 0.0 115.301 166.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -76.92 -35.25 57.46 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 117.191 -3.443 . . . . 0.0 114.534 -175.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . 0.253 47.9 t-105 -57.68 -50.74 72.19 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.334 -1.479 . . . . 0.0 113.375 158.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 70.8 mt -68.41 -12.16 60.73 Favored 'General case' 0 N--CA 1.452 -0.375 0 O-C-N 116.841 -3.662 . . . . 0.0 110.219 -176.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -83.12 -26.42 31.03 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 122.477 2.399 . . . . 0.0 111.53 169.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -71.25 -42.17 69.18 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.021 160.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 53.6 t -69.02 -43.24 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 1 O-C-N 115.917 -4.239 . . . . 0.0 113.582 -178.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -63.87 -47.51 80.4 Favored 'General case' 0 N--CA 1.454 -0.265 1 C-N-CA 131.997 4.119 . . . . 0.0 111.643 169.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.76 -40.86 85.16 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 120.606 1.548 . . . . 0.0 111.211 176.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 67.8 tp -72.27 -36.69 69.06 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 119.316 -2.115 . . . . 0.0 105.5 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -58.83 -47.8 83.56 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 116.27 -1.824 . . . . 0.0 108.176 175.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -76.97 -30.35 55.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 122.707 2.503 . . . . 0.0 114.314 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.8 -45.86 88.93 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 170.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . 0.264 41.0 m-85 -47.8 -39.39 18.07 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 119.73 3.233 . . . . 0.0 119.73 166.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -66.93 -35.59 80.33 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.724 1.21 . . . . 0.0 109.211 177.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -94.35 -0.7 54.74 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 123.24 1.495 . . . . 0.0 113.127 -173.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.334 8.3 m-20 56.6 36.52 27.75 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 127.726 2.411 . . . . 0.0 116.482 -166.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 61.8 mt -100.26 4.86 44.47 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 29.1 p-80 -61.48 -38.74 88.39 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 128.714 2.806 . . . . 0.0 116.232 -173.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 14.7 mt -70.04 -49.37 19.05 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-O 114.492 -2.671 . . . . 0.0 110.477 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -58.01 -33.32 97.09 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 O-C-N 125.758 2.452 . . . . 0.0 117.228 174.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 37.8 tp -74.62 -45.82 42.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 113.433 -3.175 . . . . 0.0 114.814 173.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 56.8 mt -54.24 -42.3 69.73 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 126.387 2.304 . . . . 0.0 115.927 168.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -62.45 -41.25 98.61 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 31.5 tp -72.47 -36.19 68.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 115.392 -2.242 . . . . 0.0 111.928 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 22.3 mmt -88.78 -19.46 25.99 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 115.656 -2.116 . . . . 0.0 112.52 -170.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 17.1 mt -134.99 146.11 48.75 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 126.761 2.538 . . . . 0.0 111.236 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . 0.641 ' HB ' ' HD2' ' B' ' 45' ' ' PRO . 30.0 p -88.18 158.1 49.95 Favored Pre-proline 0 N--CA 1.449 -0.482 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -176.056 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . 0.641 ' HD2' ' HB ' ' B' ' 44' ' ' THR . 74.6 Cg_exo -36.58 -47.46 1.31 Allowed 'Trans proline' 0 N--CA 1.447 -1.207 1 C-N-CA 127.046 5.164 . . . . 0.0 115.823 173.317 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.89 -29.74 63.4 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 173.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -70.13 -42.49 72.52 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 126.903 3.24 . . . . 0.0 110.911 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -66.13 -51.37 58.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.452 -2.655 . . . . 0.0 112.967 178.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -55.45 -41.2 72.55 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.796 2.438 . . . . 0.0 114.457 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.0 -28.88 60.71 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.5 mt -67.11 -44.14 80.7 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 116.162 1.912 . . . . 0.0 116.162 169.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.86 -46.01 69.12 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.584 166.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 17.9 m -63.6 -51.96 62.98 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 113.834 -2.984 . . . . 0.0 107.627 -175.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -40.9 -33.82 0.34 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.585 2.754 . . . . 0.0 112.424 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 40.7 t -65.1 -42.17 93.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-O 116.27 -1.824 . . . . 0.0 107.302 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 38.4 mtp180 -72.31 -33.06 67.09 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 120.172 1.351 . . . . 0.0 111.334 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 59.5 mt -54.17 -62.62 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 123.449 2.84 . . . . 0.0 112.007 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.338 77.1 t -66.7 -33.07 61.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 C-N-CA 126.212 1.805 . . . . 0.0 110.77 -170.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.93 -28.49 68.97 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 115.223 -2.322 . . . . 0.0 116.928 165.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . 0.291 20.7 tp10 -90.07 -27.36 19.73 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 127.929 3.268 . . . . 0.0 113.157 -179.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 56.9 mt -65.87 -30.41 71.01 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 114.989 -1.005 . . . . 0.0 112.153 166.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 24.0 mt -77.85 -41.74 35.92 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.126 1.371 . . . . 0.0 113.66 170.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 28.5 ttm105 -77.13 -64.07 1.22 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 115.144 -2.36 . . . . 0.0 113.612 -174.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.66 93.25 0.04 OUTLIER Glycine 0 CA--C 1.521 0.45 0 C-N-CA 129.847 3.594 . . . . 0.0 114.172 -165.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -134.48 -60.04 0.8 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 130.762 3.625 . . . . 0.0 114.505 168.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 38.6 mtt -64.08 139.27 58.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 115.875 1.805 . . . . 0.0 115.875 -164.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 82.9 p -72.45 161.5 30.73 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 118.124 2.639 . . . . 0.0 118.124 156.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -54.16 -32.5 55.53 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 117.677 2.473 . . . . 0.0 117.677 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -65.39 -46.77 78.75 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 114.614 -2.612 . . . . 0.0 111.046 173.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -62.48 -43.92 97.65 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 127.063 2.727 . . . . 0.0 116.795 172.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 70.3 mt -56.27 -39.67 73.01 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 117.765 -1.112 . . . . 0.0 112.092 174.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -83.84 -20.91 32.33 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 121.417 1.917 . . . . 0.0 112.648 -171.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -111.67 -34.98 5.89 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 115.57 -2.157 . . . . 0.0 109.113 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -91.29 -24.63 19.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 18.6 mt -112.35 -7.84 13.95 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 130.616 3.566 . . . . 0.0 111.375 169.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.59 18.67 72.19 Favored Glycine 0 C--N 1.336 0.564 0 CA-C-N 121.815 2.098 . . . . 0.0 114.556 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.03 130.1 46.99 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -165.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.85 165.91 44.34 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 128.265 2.84 . . . . 0.0 115.276 169.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 43.1 mt -61.43 -50.7 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-O 118.483 -0.77 . . . . 0.0 112.459 -170.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.13 73.65 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.004 1.483 . . . . 0.0 115.004 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 16.1 m -62.41 -44.37 96.59 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 116.244 -1.836 . . . . 0.0 111.03 174.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 36.2 mm -73.15 -38.97 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 CA-C-N 121.911 2.141 . . . . 0.0 112.449 -178.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 30.2 m -62.38 -45.52 92.76 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 125.199 1.4 . . . . 0.0 111.878 178.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -53.77 -26.05 21.79 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 130.502 3.521 . . . . 0.0 109.751 171.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.14 -43.96 62.13 Favored Glycine 0 C--N 1.337 0.617 0 CA-C-O 124.817 2.343 . . . . 0.0 116.392 177.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . 0.381 7.1 p -61.26 -39.88 91.99 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 117.81 2.522 . . . . 0.0 117.81 175.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -67.79 -25.89 65.82 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.191 2.182 . . . . 0.0 112.899 168.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 44.9 m -78.64 -41.34 31.68 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 103.792 -2.67 . . . . 0.0 103.792 -174.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 mt -68.84 -27.2 65.62 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 117.123 -3.486 . . . . 0.0 108.901 178.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -65.1 -46.22 81.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 124.334 3.243 . . . . 0.0 115.976 174.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.33 -4.28 50.15 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 108.678 -3.874 . . . . 0.0 114.85 174.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.23 156.39 81.42 Favored Pre-proline 0 N--CA 1.449 -0.479 0 CA-C-N 122.66 2.482 . . . . 0.0 114.512 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -59.99 129.88 32.25 Favored 'Trans proline' 0 N--CA 1.45 -1.045 1 C-N-CA 126.345 4.697 . . . . 0.0 110.353 164.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.253 2.7 m -72.29 -17.09 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 116.174 -1.869 . . . . 0.0 114.314 -171.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 13.8 pm0 -74.15 -21.86 59.68 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 125.445 1.715 . . . . 0.0 113.583 171.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.6 tp -70.32 -42.0 72.52 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 118.276 -1.37 . . . . 0.0 112.624 173.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -52.47 -51.64 58.32 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 128.113 2.565 . . . . 0.0 109.371 177.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -56.27 -41.93 76.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.056 -1.429 . . . . 0.0 112.385 172.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 17.1 t90 -70.59 -42.66 70.73 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 118.32 -2.738 . . . . 0.0 112.933 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' B' ' 100' ' ' LEU . 17.4 mt -78.03 -25.42 47.86 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -168.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -49.6 -34.93 19.22 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.674 1.99 . . . . 0.0 113.296 158.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -100.4 -32.11 10.98 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 118.853 0.751 . . . . 0.0 112.643 -175.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 56.7 t -91.87 -8.91 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -177.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 40.4 mt -103.58 -43.39 5.39 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 120.293 -1.504 . . . . 0.0 114.302 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 57.5 mt -90.07 -24.7 21.08 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.848 -154.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.46 -11.79 60.58 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 113.574 -3.107 . . . . 0.0 111.356 168.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 51.2 m -76.08 5.58 6.52 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 123.533 2.879 . . . . 0.0 115.027 169.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 . . . . . 0 C--O 1.249 1.05 0 N-CA-C 121.58 3.919 . . . . 0.0 121.58 174.992 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 53.2 ttm . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 125.853 2.74 . . . . 0.0 108.229 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -53.87 139.8 32.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 -159.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -100.95 126.17 47.58 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 116.955 -3.59 . . . . 0.0 116.413 -158.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -130.24 122.27 27.74 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 129.574 3.15 . . . . 0.0 111.589 -168.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 80.7 p -151.5 146.2 18.66 Favored Pre-proline 0 N--CA 1.45 -0.429 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -171.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.45 -30.58 72.11 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 122.751 2.3 . . . . 0.0 112.987 175.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -139.49 156.56 46.85 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 117.797 -3.064 . . . . 0.0 111.316 171.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 10.7 t -148.11 132.19 17.28 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.23 -1.804 . . . . 0.0 110.674 171.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.26 -28.06 59.68 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.846 -1.549 . . . . 0.0 112.164 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.23 -38.86 88.92 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.437 1.926 . . . . 0.0 112.757 172.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 57.3 mtt -70.27 -40.07 74.56 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.158 0.983 . . . . 0.0 108.796 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.45 -24.1 60.18 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 119.998 3.333 . . . . 0.0 119.998 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -71.56 -45.79 61.27 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.131 0.972 . . . . 0.0 110.605 163.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -59.16 -32.68 70.11 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 123.888 1.804 . . . . 0.0 111.817 174.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -38.94 65.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 117.466 -3.271 . . . . 0.0 113.782 169.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -54.16 -43.15 70.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 118.44 2.755 . . . . 0.0 118.44 164.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -69.21 -39.12 78.78 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 116.102 -1.904 . . . . 0.0 112.444 172.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -60.39 -43.03 97.02 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.172 -1.871 . . . . 0.0 110.152 174.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . 0.498 ' CZ2' ' HD2' ' D' ' 48' ' ' ARG . 19.9 t-105 -69.3 -40.89 77.4 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 122.179 2.263 . . . . 0.0 111.661 176.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.62 -17.01 64.03 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 119.255 -2.153 . . . . 0.0 114.728 173.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -65.7 -34.68 78.76 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 118.552 2.797 . . . . 0.0 118.552 159.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -59.24 -43.72 92.38 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 121.762 2.074 . . . . 0.0 115.583 176.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 11.7 t -56.9 -53.59 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 O-C-N 124.41 1.069 . . . . 0.0 112.606 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -75.1 -30.93 61.04 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 126.894 2.621 . . . . 0.0 110.747 -171.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 43.3 tp -67.94 -36.09 79.52 Favored 'General case' 0 N--CA 1.453 -0.321 1 O-C-N 116.061 -4.149 . . . . 0.0 112.531 170.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . 0.284 53.4 tp -74.62 -28.57 60.94 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 130.573 3.549 . . . . 0.0 108.339 174.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -60.58 -34.33 74.03 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 124.858 3.481 . . . . 0.0 110.844 168.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -73.24 -36.88 66.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 125.787 2.708 . . . . 0.0 112.434 176.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.68 -24.4 58.78 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 112.852 -1.976 . . . . 0.0 113.331 -169.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -65.09 -21.42 66.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 119.442 -2.036 . . . . 0.0 111.797 171.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -71.78 -33.74 68.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 119.955 1.252 . . . . 0.0 113.065 -178.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -123.98 33.45 5.29 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 124.557 2.123 . . . . 0.0 115.379 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.34 0.5 OUTLIER 59.76 13.38 3.47 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 118.704 2.853 . . . . 0.0 118.704 178.01 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' C' ' 34' ' ' LEU . 18.0 mt -87.59 6.58 33.78 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 123.804 0.69 . . . . 0.0 110.399 -177.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -67.71 -32.17 72.63 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.081 0.952 . . . . 0.0 110.239 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 mt -80.18 -50.44 1.16 Allowed Pre-proline 0 N--CA 1.453 -0.298 0 O-C-N 117.346 -3.346 . . . . 0.0 111.627 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -50.23 -44.32 39.01 Favored 'Trans proline' 0 N--CA 1.446 -1.273 1 C-N-CA 126.6 4.867 . . . . 0.0 112.629 171.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 33.2 tp -63.72 -51.31 65.53 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 121.562 -0.711 . . . . 0.0 112.448 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 75.7 mt -49.05 -34.76 14.2 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 121.377 3.843 . . . . 0.0 121.377 160.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -71.22 -25.52 62.53 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 121.036 1.744 . . . . 0.0 114.704 167.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 33.3 tp -76.19 -55.5 5.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 21.1 mmt -68.86 -35.17 76.6 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 123.752 1.739 . . . . 0.0 114.696 -165.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 3.8 mp -113.33 130.53 56.25 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 119.411 -2.055 . . . . 0.0 107.113 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 49.8 p -54.83 155.9 7.42 Favored Pre-proline 0 N--CA 1.448 -0.538 0 O-C-N 128.551 3.657 . . . . 0.0 111.931 164.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . 0.305 2.1 Cg_endo -54.86 -26.92 50.68 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 124.347 3.365 . . . . 0.0 116.466 168.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -61.65 -57.06 13.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 124.321 1.013 . . . . 0.0 111.148 166.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -65.39 -27.44 68.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 -178.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 69.8 mtm-85 -77.08 -47.3 20.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 123.133 1.444 . . . . 0.0 107.188 174.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -55.55 -36.72 67.1 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.586 -3.196 . . . . 0.0 113.61 171.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.16 -45.09 86.35 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 119.852 -1.78 . . . . 0.0 112.679 176.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . 0.521 HD13 ' CE1' ' D' ' 22' ' ' PHE . 32.5 mt -65.12 -31.05 72.06 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 121.995 2.179 . . . . 0.0 111.918 175.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.71 -17.31 66.92 Favored Glycine 0 N--CA 1.444 -0.809 0 O-C-N 117.77 -3.081 . . . . 0.0 119.459 163.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 6.6 m -89.54 -43.53 10.74 Favored 'General case' 0 N--CA 1.45 -0.425 0 O-C-N 127.147 2.322 . . . . 0.0 109.069 178.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -67.44 -26.96 66.66 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 115.578 1.695 . . . . 0.0 115.578 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 4.6 t -62.75 -24.39 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 120.415 1.461 . . . . 0.0 111.066 168.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -97.81 -27.83 14.13 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 117.657 -3.152 . . . . 0.0 109.148 -175.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . 0.294 9.9 mt -49.23 -51.04 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 C-N-CA 127.045 2.138 . . . . 0.0 114.419 159.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 82.6 t -59.79 -64.12 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-N 113.482 -1.69 . . . . 0.0 109.839 170.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -43.87 -50.21 8.05 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 114.907 -2.473 . . . . 0.0 117.07 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -73.8 -19.24 60.81 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 112.798 -3.477 . . . . 0.0 115.712 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 16.4 mt -73.88 -36.15 64.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 128.333 2.653 . . . . 0.0 114.269 162.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 94.8 mt -73.02 -39.36 66.06 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.897 2.079 . . . . 0.0 111.318 169.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 38.0 ttm105 -70.31 -44.21 68.76 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 116.082 -1.913 . . . . 0.0 112.477 171.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.44 15.73 68.55 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 126.101 1.81 . . . . 0.0 116.425 171.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -85.26 42.45 0.95 Allowed 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 116.716 -3.814 . . . . 0.0 113.016 -177.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 46.6 mtt -125.36 143.69 50.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 117.509 2.411 . . . . 0.0 117.509 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 7.3 p -72.89 175.54 6.48 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 119.716 -1.865 . . . . 0.0 108.828 171.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -65.3 -34.9 79.44 Favored 'General case' 0 N--CA 1.45 -0.449 1 O-C-N 116.177 -4.077 . . . . 0.0 111.116 172.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 20.6 ttp-105 -55.98 -60.63 3.2 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 130.704 3.602 . . . . 0.0 110.525 172.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -60.25 -35.54 75.72 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 125.726 1.61 . . . . 0.0 115.291 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 48.5 mt -56.09 -51.84 66.46 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 125.705 1.878 . . . . 0.0 112.579 167.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -67.11 -33.12 74.78 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 118.132 -2.855 . . . . 0.0 113.356 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -95.61 14.34 23.26 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.973 -171.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -150.6 -40.06 0.13 Allowed 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 116.39 -3.944 . . . . 0.0 111.688 -165.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mp -84.29 -33.23 24.02 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.909 -1.12 . . . . 0.0 113.105 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 52.97 -159.29 3.54 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 115.34 -2.922 . . . . 0.0 117.832 -173.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.57 -18.61 62.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 120.483 3.512 . . . . 0.0 120.483 -174.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.7 -20.84 62.25 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 129.542 3.448 . . . . 0.0 114.039 172.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 19.3 tt -46.73 -29.88 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 126.656 2.033 . . . . 0.0 116.4 171.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -85.24 -8.47 58.53 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.563 3.145 . . . . 0.0 108.339 -173.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 70.0 m -76.46 -43.64 39.08 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.564 -3.21 . . . . 0.0 112.469 172.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 31.4 mm -81.99 -39.61 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 112.508 -2.133 . . . . 0.0 115.11 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . 0.292 13.9 p -95.72 -11.8 26.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 120.774 3.62 . . . . 0.0 120.774 -175.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -114.09 146.26 40.49 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 117.526 -3.234 . . . . 0.0 109.988 175.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 99.48 -175.91 28.42 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 129.724 3.535 . . . . 0.0 117.276 169.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 3.6 m -68.78 -21.21 64.36 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 126.57 1.948 . . . . 0.0 116.243 -168.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -101.81 -3.0 28.76 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 25.5 p -67.39 162.19 23.54 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 124.04 1.876 . . . . 0.0 112.167 -163.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 7.8 tp -52.82 -39.38 62.38 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 120.365 3.468 . . . . 0.0 120.365 -164.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.353 90.5 mttt -69.97 -28.9 65.92 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 118.693 -2.505 . . . . 0.0 116.551 168.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.49 -24.94 17.08 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -166.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.23 163.2 19.12 Favored Pre-proline 0 N--CA 1.447 -0.594 0 C-N-CA 128.148 2.579 . . . . 0.0 113.44 -159.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.62 134.46 46.73 Favored 'Trans proline' 0 N--CA 1.445 -1.377 0 CA-C-N 126.066 3.202 . . . . 0.0 112.069 176.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 18.1 t -53.17 -37.9 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 130.495 3.518 . . . . 0.0 109.384 -177.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pm0 -79.01 -14.09 59.4 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 128.809 2.844 . . . . 0.0 113.353 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 37.2 tp -86.99 -47.51 8.89 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 118.971 -2.33 . . . . 0.0 111.76 166.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 34.4 mtp-105 -56.93 -43.41 81.46 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 113.03 -1.896 . . . . 0.0 114.2 171.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . 0.28 90.4 mt-30 -59.1 -26.56 64.77 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 117.135 -3.478 . . . . 0.0 117.543 168.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -86.17 -47.89 9.07 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 116.3 -4.0 . . . . 0.0 110.936 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 32.4 mt -53.07 -31.93 44.32 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 116.818 -3.676 . . . . 0.0 114.235 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -75.64 -31.25 59.75 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 122.47 2.396 . . . . 0.0 112.349 172.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -75.42 -22.18 57.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 125.178 2.418 . . . . 0.0 115.165 178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 39.2 t -98.34 -49.95 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 O-C-N 117.295 -3.378 . . . . 0.0 114.927 172.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 60.6 mt -82.42 -19.29 39.32 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 116.075 -1.917 . . . . 0.0 113.97 -171.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 88.0 mt -127.97 18.32 6.65 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 125.639 1.837 . . . . 0.0 109.456 -174.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 47.5 pttt . . . . . 0 N--CA 1.449 -0.517 0 N-CA-C 119.712 3.227 . . . . 0.0 119.712 178.053 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 54.0 p . . . . . 0 N--CA 1.453 -0.283 0 CA-C-O 115.213 -2.327 . . . . 0.0 113.602 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -82.07 -37.74 0.23 Allowed 'Trans proline' 0 N--CA 1.448 -1.185 0 C-N-CA 124.326 3.351 . . . . 0.0 114.42 -177.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -143.68 139.37 29.51 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 114.656 -2.592 . . . . 0.0 114.192 -172.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 14.5 t -59.24 123.95 18.38 Favored 'General case' 0 N--CA 1.451 -0.396 1 CA-C-N 126.513 4.233 . . . . 0.0 114.359 171.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.32 -28.85 69.6 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 128.313 2.645 . . . . 0.0 109.749 173.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.8 -50.33 51.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 130.889 3.676 . . . . 0.0 105.587 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 11.1 mmt -61.45 -37.4 83.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.7 -42.43 83.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 117.999 -1.0 . . . . 0.0 113.468 174.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -65.24 -62.47 1.52 Allowed 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 168.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -44.71 -30.83 1.01 Allowed 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 120.511 1.505 . . . . 0.0 114.841 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.385 0.0 OUTLIER -83.72 -14.74 50.93 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 118.789 -2.444 . . . . 0.0 116.569 -174.401 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -82.76 -32.8 27.63 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 127.249 2.22 . . . . 0.0 111.869 157.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -74.82 -40.46 61.07 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 126.044 2.09 . . . . 0.0 111.023 -175.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -69.9 -6.99 36.65 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 125.92 2.013 . . . . 0.0 115.678 169.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -85.27 -52.7 5.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 128.735 2.814 . . . . 0.0 110.715 170.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 65.6 mt -57.07 -18.5 14.65 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 118.996 2.962 . . . . 0.0 118.996 168.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 59.5 ttt180 -66.94 -31.2 71.63 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 127.531 2.332 . . . . 0.0 109.197 169.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . 0.521 ' CE1' HD13 ' C' ' 51' ' ' LEU . 86.5 t80 -87.59 -30.03 20.8 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 126.715 2.51 . . . . 0.0 108.89 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 81.5 t -65.78 -33.72 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 118.144 -2.848 . . . . 0.0 110.948 169.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -73.16 -46.07 52.95 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 127.918 2.487 . . . . 0.0 112.343 169.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 15.5 tp -56.74 -40.77 76.35 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 120.653 1.57 . . . . 0.0 113.626 175.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 tp -77.95 -39.54 42.29 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 115.744 -2.074 . . . . 0.0 114.849 175.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp -53.12 -57.24 11.12 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 122.362 2.346 . . . . 0.0 117.249 165.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -57.95 -32.81 68.19 Favored 'General case' 0 N--CA 1.446 -0.634 1 O-C-N 129.913 4.508 . . . . 0.0 111.456 173.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.48 -23.8 50.3 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 121.285 1.857 . . . . 0.0 113.525 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -64.34 -34.15 77.49 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 124.08 3.127 . . . . 0.0 110.72 162.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -89.23 3.5 51.79 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 129.677 3.191 . . . . 0.0 114.279 -173.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 57.3 p30 -135.28 13.68 3.53 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 119.331 0.968 . . . . 0.0 112.945 155.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.262 0.6 OUTLIER 54.24 38.6 29.62 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 117.114 -1.422 . . . . 0.0 111.471 -178.704 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 92.6 mt -86.0 13.68 7.27 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.404 2.366 . . . . 0.0 116.778 155.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.21 -47.7 55.86 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 125.395 1.478 . . . . 0.0 112.086 -164.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 3.6 mt -64.14 -52.32 56.12 Favored Pre-proline 0 N--CA 1.448 -0.53 0 CA-C-O 114.733 -2.556 . . . . 0.0 111.283 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.61 -34.21 14.74 Favored 'Trans proline' 0 N--CA 1.447 -1.233 0 C-N-CA 124.487 3.458 . . . . 0.0 116.642 166.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 51.9 tp -85.8 -34.04 21.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.863 2.172 . . . . 0.0 116.863 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 19.9 mt -71.34 -34.31 70.41 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 126.436 3.017 . . . . 0.0 111.676 169.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 19.5 m-20 -72.68 -35.31 67.64 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 117.626 -3.171 . . . . 0.0 111.913 174.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 14.6 tp -68.2 -38.72 82.27 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 123.746 1.736 . . . . 0.0 109.584 169.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.2 mmt -79.03 -38.15 37.26 Favored 'General case' 0 N--CA 1.452 -0.371 1 O-C-N 116.171 -4.081 . . . . 0.0 115.198 -176.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 17.2 mt -109.94 140.22 44.17 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.251 1.42 . . . . 0.0 112.839 -179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 64.0 p -68.51 168.12 15.73 Favored Pre-proline 0 N--CA 1.453 -0.282 0 C-N-CA 128.1 2.56 . . . . 0.0 112.451 167.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -57.8 -42.24 61.33 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.552 3.501 . . . . 0.0 115.831 177.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -81.99 -18.27 43.98 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 126.2 2.187 . . . . 0.0 114.791 -175.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -71.12 -44.21 66.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 170.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . 0.498 ' HD2' ' CZ2' ' C' ' 19' ' ' TRP . 41.1 mtm-85 -68.36 -40.42 81.47 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 171.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.06 -38.28 79.04 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 116.377 1.991 . . . . 0.0 116.377 167.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.329 . . -61.51 -43.23 99.24 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.956 -1.715 . . . . 0.0 113.135 168.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.27 -45.77 92.15 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.773 -1.829 . . . . 0.0 115.282 175.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.26 -40.12 91.28 Favored Glycine 0 CA--C 1.525 0.658 0 O-C-N 126.762 2.539 . . . . 0.0 114.279 169.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 8.1 m -61.7 -43.53 98.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.286 1.835 . . . . 0.0 114.661 166.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.274 96.7 mtt180 -59.69 -41.98 91.93 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 175.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . 0.426 ' H ' HG23 ' D' ' 55' ' ' VAL . 9.1 t -41.28 -59.87 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 O-C-N 120.316 -1.49 . . . . 0.0 113.851 164.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -72.32 -24.11 61.26 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 55.9 mt -71.0 -46.22 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 C-N-CA 127.338 2.255 . . . . 0.0 107.545 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . 0.322 18.7 t -62.68 -39.19 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 174.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -66.91 -52.1 47.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 119.666 -1.896 . . . . 0.0 111.57 170.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -62.38 -31.18 71.8 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 33.1 mt -61.28 -40.45 94.18 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 118.126 2.639 . . . . 0.0 118.126 167.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 42.1 mt -69.84 -34.47 73.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 116.953 -3.592 . . . . 0.0 111.241 167.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' D' ' 63' ' ' ARG . 30.5 ttm180 -64.96 -47.56 77.18 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 117.351 -3.343 . . . . 0.0 114.945 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 44.93 62.57 2.93 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-O 124.512 2.173 . . . . 0.0 116.884 -174.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -124.63 -35.37 2.74 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.0 -3.059 . . . . 0.0 112.888 170.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 28.6 mtt -75.97 58.75 1.21 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 124.284 3.22 . . . . 0.0 106.797 155.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 88.5 p -82.3 168.1 17.92 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 119.542 -1.974 . . . . 0.0 113.785 -175.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.298 8.0 tp60 69.54 -53.62 0.6 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 120.842 3.645 . . . . 0.0 120.842 167.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . 0.285 74.1 ttt180 -120.92 -33.12 3.82 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.396 2.279 . . . . 0.0 112.567 171.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.77 -26.73 40.58 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 122.675 2.489 . . . . 0.0 112.557 -167.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mt -63.23 -52.78 60.82 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.949 0.9 . . . . 0.0 111.39 174.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -68.19 -26.55 65.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 116.604 -3.81 . . . . 0.0 115.156 173.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -109.86 -26.1 9.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 124.977 3.535 . . . . 0.0 118.502 -173.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -104.52 -44.9 4.78 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 116.422 -1.751 . . . . 0.0 115.599 176.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.77 -41.09 88.27 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 124.29 0.994 . . . . 0.0 110.666 158.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 93.6 -171.05 31.56 Favored Glycine 0 C--N 1.337 0.597 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 155.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -40.13 -32.39 0.17 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 129.281 3.032 . . . . 0.0 117.357 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.73 -23.13 49.29 Favored Glycine 0 C--N 1.338 0.676 0 CA-C-O 116.52 -2.267 . . . . 0.0 118.334 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 6.5 tt -50.01 -16.25 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 131.163 3.785 . . . . 0.0 117.611 170.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . 0.276 . . -84.75 -42.46 15.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 116.546 -3.846 . . . . 0.0 114.052 174.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 96.8 m -59.17 -27.55 65.78 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 125.348 2.499 . . . . 0.0 111.754 171.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 39.0 mm -100.12 -25.32 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 O-C-N 120.204 -1.56 . . . . 0.0 112.262 -170.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 44.9 p -109.54 5.19 22.94 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 173.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 41.4 mtp85 -125.05 159.96 30.13 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.664 0.745 . . . . 0.0 109.844 172.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 87.98 151.66 22.58 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-O 125.247 2.582 . . . . 0.0 113.236 -170.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 35.7 p -84.68 2.47 41.63 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 109.58 -3.31 . . . . 0.0 116.971 -153.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -123.41 29.5 6.62 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.268 1.027 . . . . 0.0 112.888 159.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 2.1 p -63.16 173.86 1.34 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 117.198 -1.801 . . . . 0.0 114.571 169.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.6 -21.82 54.39 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 119.846 3.276 . . . . 0.0 119.846 163.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -78.49 -12.41 60.01 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 122.78 1.276 . . . . 0.0 113.328 169.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -123.75 1.07 8.76 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 113.331 -1.759 . . . . 0.0 112.536 -169.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . 0.472 ' HB1' HG22 ' D' ' 94' ' ' VAL . . . 39.55 95.86 0.04 OUTLIER Pre-proline 0 N--CA 1.451 -0.392 0 C-N-CA 127.727 2.411 . . . . 0.0 108.76 144.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . 0.47 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 84.9 Cg_exo 32.15 35.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.257 0 N-CA-C 119.587 2.88 . . . . 0.0 119.587 32.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . 0.472 HG22 ' HB1' ' D' ' 92' ' ' ALA . 39.8 t -60.32 -25.9 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-O 117.263 -1.351 . . . . 0.0 107.665 -176.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.9 -25.21 28.08 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 126.252 2.22 . . . . 0.0 110.886 -171.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 29.4 tp -72.42 -35.75 68.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 124.038 0.836 . . . . 0.0 113.092 162.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -62.61 -53.15 58.93 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 123.205 1.478 . . . . 0.0 113.789 176.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -51.88 -39.94 59.83 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 118.776 -2.453 . . . . 0.0 111.031 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -73.4 -33.39 64.97 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 120.44 -1.412 . . . . 0.0 108.298 -166.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 61.2 mt -81.11 -31.98 34.05 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -174.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.19 -31.12 72.18 Favored 'General case' 0 N--CA 1.447 -0.577 1 CA-C-O 111.471 -4.109 . . . . 0.0 109.828 175.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -89.76 -36.71 15.0 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 126.727 2.517 . . . . 0.0 111.12 -177.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.377 41.8 t -78.8 -36.0 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 C-N-CA 128.508 2.723 . . . . 0.0 113.509 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 60.5 mt -96.15 -39.09 9.87 Favored 'General case' 0 N--CA 1.447 -0.61 1 CA-C-O 111.285 -4.198 . . . . 0.0 108.109 -175.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 17.6 mt -90.93 14.74 12.96 Favored 'General case' 0 N--CA 1.452 -0.347 1 CA-C-N 127.333 4.606 . . . . 0.0 113.453 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -44.46 156.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 162.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -7.76 52.48 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 127.917 3.722 . . . . 0.0 117.148 -160.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 129.555 3.142 . . . . 0.0 109.434 -179.772 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.6 ttp . . . . . 0 N--CA 1.45 -0.442 0 N-CA-C 111.216 0.08 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.58 -54.44 45.9 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -51.15 -44.04 61.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.229 2.611 . . . . 0.0 114.054 166.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -66.7 -41.02 88.7 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 113.317 -3.23 . . . . 0.0 111.951 173.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -67.47 -23.27 65.48 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 122.756 2.525 . . . . 0.0 112.647 168.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 25.1 t60 -71.82 -44.38 64.0 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 119.06 2.985 . . . . 0.0 119.06 177.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -56.15 -26.64 51.16 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 166.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -70.85 -36.9 73.07 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 123.308 2.776 . . . . 0.0 111.302 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -58.92 -42.6 90.09 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 125.944 1.698 . . . . 0.0 114.845 166.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.8 mt -70.3 -8.69 52.34 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 -71.45 -36.74 71.35 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.784 1.633 . . . . 0.0 107.996 177.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.66 -51.24 58.39 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.977 1.711 . . . . 0.0 111.886 174.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 t -57.39 -41.07 77.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 117.952 2.575 . . . . 0.0 117.952 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -61.19 -50.45 73.1 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 118.29 2.7 . . . . 0.0 118.29 161.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.9 tp -58.28 -36.55 73.45 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.115 -1.857 . . . . 0.0 109.589 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 54.2 tp -72.98 -43.93 61.66 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 116.345 -1.788 . . . . 0.0 108.846 -177.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -44.62 -60.8 1.82 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.854 1.262 . . . . 0.0 109.42 167.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -71.32 -19.2 62.34 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -171.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.54 -33.06 62.66 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 117.708 -3.12 . . . . 0.0 111.861 173.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -63.43 -26.07 68.56 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 116.762 -1.59 . . . . 0.0 112.823 170.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -91.38 12.95 18.87 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.128 1.786 . . . . 0.0 111.48 -176.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -137.9 3.16 2.44 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 130.14 3.376 . . . . 0.0 112.695 173.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 61.77 32.12 18.29 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 120.564 -1.335 . . . . 0.0 111.765 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.274 28.6 mt -105.54 -0.78 25.51 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 126.045 1.738 . . . . 0.0 114.306 172.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -58.35 -42.01 85.92 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 114.941 -2.457 . . . . 0.0 116.212 -176.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.292 6.5 mt -66.54 -47.89 56.45 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-N 123.281 2.764 . . . . 0.0 111.618 172.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -49.2 -46.63 25.05 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 122.496 2.13 . . . . 0.0 115.616 163.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . 0.265 26.4 tp -68.63 -41.23 79.74 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.986 1.374 . . . . 0.0 110.741 -177.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.8 mt -74.8 -14.36 60.68 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 117.975 -2.953 . . . . 0.0 116.862 175.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . 0.351 3.9 m-80 -72.44 -23.99 61.15 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 117.503 -3.248 . . . . 0.0 112.727 163.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.0 tt -85.7 -52.49 5.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 128.863 2.865 . . . . 0.0 112.808 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.323 83.4 mmm -68.42 -42.84 78.37 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 109.891 -3.322 . . . . 0.0 112.46 -168.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.9 mt -110.4 142.51 42.01 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.939 1.296 . . . . 0.0 109.406 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 p -84.75 151.64 58.48 Favored Pre-proline 0 N--CA 1.447 -0.579 0 C-N-CA 127.888 2.475 . . . . 0.0 113.787 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -58.34 -40.71 73.07 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 CA-C-N 126.351 3.304 . . . . 0.0 116.756 -157.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -65.34 -16.31 63.46 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 116.901 -3.624 . . . . 0.0 113.483 172.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -87.64 -28.66 21.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 119.796 1.18 . . . . 0.0 112.711 169.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 38.0 mtm-85 -75.18 -44.93 43.83 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 124.523 1.139 . . . . 0.0 108.225 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.72 -38.48 69.79 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 116.341 1.978 . . . . 0.0 116.341 167.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.64 -37.95 62.63 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.451 HD22 ' CE2' ' B' ' 22' ' ' PHE . 73.5 mt -62.3 -32.98 73.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 114.796 -2.526 . . . . 0.0 115.058 166.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.72 -32.0 68.74 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 123.065 2.666 . . . . 0.0 109.614 168.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.1 m -89.62 -28.42 19.53 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 115.578 -2.449 . . . . 0.0 110.149 -164.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -62.48 -21.23 65.31 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 126.152 2.158 . . . . 0.0 111.244 174.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.81 -49.39 82.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 115.178 -2.344 . . . . 0.0 109.76 169.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -68.33 -24.66 64.86 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 126.272 2.233 . . . . 0.0 116.711 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 55.8 mt -73.26 -47.57 46.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 116.539 -1.696 . . . . 0.0 109.267 168.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 17.1 t -65.12 -20.52 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 122.784 2.538 . . . . 0.0 110.958 171.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -74.73 -49.84 19.62 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 117.982 -2.949 . . . . 0.0 109.64 167.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -79.39 -25.67 42.08 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 120.375 1.443 . . . . 0.0 111.168 -169.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.31 -43.1 98.78 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.081 1.352 . . . . 0.0 111.266 161.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 51.7 tp -76.29 -38.69 55.78 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 123.083 2.674 . . . . 0.0 109.037 -172.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.1 ttm105 -60.34 -31.68 70.54 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 117.254 2.316 . . . . 0.0 117.254 165.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.27 2.36 4.03 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 120.877 3.111 . . . . 0.0 120.877 177.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -85.48 -47.78 9.59 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 129.927 3.291 . . . . 0.0 110.695 -166.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 36.3 ttm -73.65 142.29 46.47 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 126.509 2.38 . . . . 0.0 110.484 167.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.2 p -102.27 170.1 8.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 119.581 3.178 . . . . 0.0 119.581 175.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -58.12 -38.14 75.94 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 113.707 1.002 . . . . 0.0 113.707 -174.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -63.48 -39.84 95.51 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 116.879 2.177 . . . . 0.0 116.879 175.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -70.73 -35.14 72.55 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 127.495 2.318 . . . . 0.0 113.493 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . 0.285 56.0 mt -63.15 -40.94 99.04 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 123.284 1.516 . . . . 0.0 111.795 175.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -63.5 -17.72 63.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 114.049 -2.881 . . . . 0.0 111.251 -175.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -89.63 -64.34 1.15 Allowed 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 120.54 1.518 . . . . 0.0 109.5 158.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -65.98 -21.0 66.38 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 118.472 2.768 . . . . 0.0 118.472 -159.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.5 mt -130.49 7.33 4.89 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.875 1.27 . . . . 0.0 110.77 168.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.33 31.73 80.32 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-O 114.852 -3.193 . . . . 0.0 113.132 173.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -94.21 118.48 31.64 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.084 2.554 . . . . 0.0 110.18 -168.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.09 125.78 38.48 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 128.655 3.026 . . . . 0.0 108.477 172.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 92.3 mt -54.84 -47.08 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 120.3 2.05 . . . . 0.0 112.055 -163.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -50.73 -41.0 55.9 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 122.197 2.271 . . . . 0.0 114.564 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 19.1 p -69.83 -25.89 63.97 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 127.61 2.364 . . . . 0.0 113.719 -174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 25.7 mm -76.5 -40.16 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 165.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.6 m -62.66 -31.36 72.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.695 -2.503 . . . . 0.0 109.21 -173.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -78.81 -40.05 33.97 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 124.878 2.275 . . . . 0.0 111.962 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.61 -26.14 72.87 Favored Glycine 0 N--CA 1.449 -0.491 0 O-C-N 119.653 -1.904 . . . . 0.0 114.393 175.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.5 m -64.45 -48.33 75.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.496 2.318 . . . . 0.0 112.807 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.461 ' HA ' ' HB2' ' A' ' 90' ' ' LYS . 75.2 m-20 -75.49 -21.08 58.35 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 114.711 -2.796 . . . . 0.0 114.514 173.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.3 m -73.69 -28.93 61.99 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 117.601 -3.187 . . . . 0.0 114.571 168.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.3 tp -77.52 -27.38 51.72 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 117.631 -3.168 . . . . 0.0 109.138 172.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.461 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 41.3 mttm -69.05 -20.43 64.11 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 112.138 -3.792 . . . . 0.0 108.398 166.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -99.37 -26.9 13.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 125.579 3.809 . . . . 0.0 119.27 177.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.27 140.81 97.75 Favored Pre-proline 0 N--CA 1.449 -0.481 0 O-C-N 125.685 1.866 . . . . 0.0 108.56 168.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -83.83 158.42 13.89 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 121.537 1.491 . . . . 0.0 111.974 -165.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.6 m -61.11 -35.08 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 114.572 -2.632 . . . . 0.0 112.887 178.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.446 24.2 pm0 -53.05 -33.7 53.12 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 122.409 2.368 . . . . 0.0 116.378 163.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 15.6 tp -81.69 -51.12 8.52 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.908 -2.995 . . . . 0.0 108.453 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.3 mtm180 -60.35 -49.67 76.67 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.385 1.564 . . . . 0.0 112.933 -173.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.03 -17.8 64.93 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 126.288 2.947 . . . . 0.0 114.05 -177.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -91.44 -27.64 18.16 Favored 'General case' 0 N--CA 1.447 -0.602 1 O-C-N 114.885 -4.884 . . . . 0.0 110.366 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.5 mt -68.65 -18.01 64.21 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 118.11 2.633 . . . . 0.0 118.11 161.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -67.06 -28.04 67.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 120.36 1.437 . . . . 0.0 111.676 176.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -82.82 -4.51 58.13 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 118.757 -1.177 . . . . 0.0 113.99 -176.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 42.5 t -114.0 -47.71 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 124.443 1.097 . . . . 0.0 113.25 -173.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.5 mt -97.42 -23.67 15.97 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.319 1.048 . . . . 0.0 111.611 -172.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 14.5 mt -112.59 -25.57 9.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.1 tttp . . . . . 0 N--CA 1.45 -0.471 0 CA-C-N 122.245 2.293 . . . . 0.0 114.435 -165.033 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 116.767 2.136 . . . . 0.0 116.767 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 27.4 mtt -67.99 -36.1 79.43 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 122.228 2.285 . . . . 0.0 114.216 165.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.08 -49.37 60.8 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 118.216 2.673 . . . . 0.0 118.216 167.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 tp10 -57.48 -42.18 82.13 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 112.719 -2.037 . . . . 0.0 113.968 168.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -63.39 -42.49 98.8 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 112.657 -3.544 . . . . 0.0 112.028 176.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -69.88 -34.76 73.99 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.673 2.483 . . . . 0.0 114.405 174.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -60.61 -36.61 79.0 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.039 1.745 . . . . 0.0 110.998 170.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -83.85 -31.16 25.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 126.2 1.8 . . . . 0.0 109.635 -174.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -72.92 -34.22 66.46 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 115.491 -2.195 . . . . 0.0 107.902 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -67.34 -25.81 66.18 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 122.329 2.331 . . . . 0.0 112.975 167.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 49.7 mt -65.18 -23.04 66.99 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 123.212 2.733 . . . . 0.0 115.095 176.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -72.49 -20.86 61.3 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.119 1.767 . . . . 0.0 113.208 174.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . 0.451 ' CE2' HD22 ' A' ' 51' ' ' LEU . 84.7 t80 -71.61 -47.87 51.76 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 117.571 -1.205 . . . . 0.0 112.11 168.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 33.8 t -61.96 -41.57 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 C-N-CA 126.439 1.896 . . . . 0.0 113.908 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -68.28 -45.18 73.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 173.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 37.2 tp -61.88 -42.28 98.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 -174.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 25.9 tp -76.21 -31.4 58.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.749 2.02 . . . . 0.0 108.628 -177.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -50.41 -42.72 54.22 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 123.406 2.821 . . . . 0.0 112.767 168.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -89.38 -9.42 50.4 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 127.452 2.97 . . . . 0.0 115.102 -177.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.59 -42.85 21.54 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.826 2.05 . . . . 0.0 110.261 178.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -63.36 -34.94 78.8 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 118.041 -2.912 . . . . 0.0 107.262 170.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -75.77 4.36 8.09 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 118.846 -2.409 . . . . 0.0 116.305 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -128.91 -1.03 5.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 113.889 -1.505 . . . . 0.0 110.235 168.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.417 46.5 m-20 64.7 23.04 12.71 Favored 'General case' 0 N--CA 1.447 -0.582 2 O-C-N 115.117 -4.739 . . . . 0.0 116.749 -168.33 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.278 83.4 mt -99.02 5.48 47.08 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.063 1.745 . . . . 0.0 111.793 174.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 14.3 p-80 -58.14 -54.31 48.36 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.797 1.239 . . . . 0.0 113.435 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 28.0 mt -62.88 -47.82 86.29 Favored Pre-proline 0 N--CA 1.448 -0.526 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.67 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -60.02 -24.03 75.17 Favored 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 124.497 3.465 . . . . 0.0 116.057 171.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . 0.329 43.2 tp -76.03 -52.07 10.97 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 125.594 1.809 . . . . 0.0 114.779 169.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . 0.307 17.3 mt -53.28 -49.69 66.42 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 124.925 1.391 . . . . 0.0 110.833 174.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -64.64 -17.77 64.34 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 119.898 -1.751 . . . . 0.0 112.831 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 12.0 tp -93.67 -30.28 15.0 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 9.0 mmt -84.05 -26.13 29.31 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 5.0 mt -126.75 134.38 50.65 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 126.288 1.835 . . . . 0.0 111.688 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 81.5 p -85.17 160.3 54.99 Favored Pre-proline 0 N--CA 1.45 -0.434 0 C-N-CA 126.006 1.723 . . . . 0.0 107.758 176.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -52.11 -30.66 41.78 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 N-CA-C 121.111 3.466 . . . . 0.0 121.111 -172.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.62 -32.66 64.17 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 124.579 1.174 . . . . 0.0 110.788 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.33 -32.7 62.92 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.567 1.947 . . . . 0.0 109.339 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 -70.6 -45.04 66.03 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 127.663 2.385 . . . . 0.0 110.102 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -63.98 -38.36 90.79 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.6 1.56 . . . . 0.0 114.014 168.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.31 -53.56 56.9 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 120.632 1.56 . . . . 0.0 112.879 167.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 27.4 mt -52.22 -38.87 59.24 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 114.631 -2.604 . . . . 0.0 117.33 175.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.75 -56.65 24.11 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 127.679 2.561 . . . . 0.0 111.768 166.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 13.6 m -74.67 -22.82 58.68 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 124.419 2.057 . . . . 0.0 113.927 -169.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 58.8 mtt180 -58.38 -37.14 74.64 Favored 'General case' 0 N--CA 1.449 -0.486 1 O-C-N 114.887 -4.883 . . . . 0.0 113.352 169.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 97.9 t -68.91 -36.81 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 124.057 0.943 . . . . 0.0 109.757 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -75.72 -33.3 60.29 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.038 -1.039 . . . . 0.0 110.304 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 54.0 mt -69.62 -47.14 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 120.401 1.455 . . . . 0.0 110.611 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.258 59.5 t -74.86 -21.01 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 O-C-N 124.479 1.112 . . . . 0.0 113.527 177.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -72.44 -38.53 68.29 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 119.286 -2.134 . . . . 0.0 113.01 175.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -61.71 -30.62 70.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.562 1.145 . . . . 0.0 109.127 171.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 1.1 mt -78.49 -26.19 45.93 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 117.893 -3.004 . . . . 0.0 111.153 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 89.4 mt -83.93 -19.92 33.86 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 119.606 3.188 . . . . 0.0 119.606 166.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 23.5 ttm105 -89.53 -71.75 0.59 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 115.976 -1.964 . . . . 0.0 111.022 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.59 75.11 1.22 Allowed Glycine 0 C--N 1.335 0.478 0 C-N-CA 125.928 1.728 . . . . 0.0 109.68 -171.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -140.5 9.62 2.24 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 121.04 2.42 . . . . 0.0 112.338 173.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 22.1 mtt -119.02 143.77 46.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 116.368 -3.957 . . . . 0.0 114.266 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 26.7 p -77.61 162.25 27.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 130.71 3.604 . . . . 0.0 112.739 164.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . 0.258 45.4 mt-30 -67.08 -33.5 75.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 -171.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -58.86 -45.31 90.45 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 160.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -59.71 -36.9 77.46 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 121.075 1.761 . . . . 0.0 112.53 171.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.417 HD23 HD12 ' B' ' 75' ' ' LEU . 90.9 mt -63.49 -33.04 74.7 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.458 175.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -84.72 -31.5 24.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.91 2.084 . . . . 0.0 112.956 -177.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -130.54 -19.69 3.01 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 117.61 -3.181 . . . . 0.0 114.422 -167.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -87.17 -13.37 44.2 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 160.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.417 HD12 HD23 ' B' ' 71' ' ' LEU . 96.6 mt -132.56 -43.74 0.91 Allowed 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.671 -3.143 . . . . 0.0 114.848 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 98.69 4.04 57.09 Favored Glycine 0 CA--C 1.522 0.476 0 CA-C-O 124.136 1.964 . . . . 0.0 110.257 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.72 80.02 6.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 117.218 -3.519 . . . . 0.0 113.066 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.42 -179.33 5.22 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-O 126.593 3.33 . . . . 0.0 110.97 159.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 45.5 mt -61.68 -40.5 86.98 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 O-C-N 117.354 -3.439 . . . . 0.0 112.407 -168.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.26 87.77 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 120.667 -1.271 . . . . 0.0 114.208 171.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 21.6 m -66.43 -34.83 78.83 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.927 1.291 . . . . 0.0 114.121 -178.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mm -81.36 -41.01 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 115.278 -2.296 . . . . 0.0 106.731 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 4.7 m -64.25 -47.54 79.24 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 131.256 3.823 . . . . 0.0 113.055 174.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 19.4 ttt180 -57.59 -51.09 70.89 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 117.237 -1.785 . . . . 0.0 114.691 167.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -45.63 -44.87 12.33 Favored Glycine 0 C--N 1.334 0.471 0 CA-C-O 115.508 -2.829 . . . . 0.0 114.94 173.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 4.3 p -77.86 -36.93 49.3 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 126.542 1.966 . . . . 0.0 112.37 -176.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -62.63 -37.57 86.83 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 106.552 -1.648 . . . . 0.0 106.552 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 68.5 m -67.31 -29.03 68.5 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 126.934 3.254 . . . . 0.0 114.712 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 70.6 mt -77.7 -38.44 47.38 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 117.706 -3.121 . . . . 0.0 116.377 173.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 52.6 tttm -64.48 -41.76 96.28 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.309 1.444 . . . . 0.0 108.801 168.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.15 -23.08 62.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 118.591 -2.568 . . . . 0.0 113.474 177.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.41 147.56 98.56 Favored Pre-proline 0 N--CA 1.448 -0.575 0 CA-C-N 121.6 2.0 . . . . 0.0 113.474 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -72.03 162.11 42.79 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 123.989 3.126 . . . . 0.0 113.315 167.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 28.0 m -82.86 -16.31 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 1 O-C-N 115.586 -4.446 . . . . 0.0 117.274 -170.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -65.24 -8.15 16.28 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.779 1.632 . . . . 0.0 114.23 163.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 31.7 tp -112.66 -52.14 2.8 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 104.457 -2.423 . . . . 0.0 104.457 -177.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . 0.275 17.8 mtp180 -58.16 -37.29 74.41 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 124.437 1.086 . . . . 0.0 112.42 -175.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -79.41 -33.91 42.24 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 127.281 2.233 . . . . 0.0 112.822 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 81.3 t90 -71.59 -39.39 70.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 121.284 -0.885 . . . . 0.0 112.359 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 86.8 mt -63.3 -30.34 71.49 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.659 170.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -54.73 -40.75 69.59 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 119.192 3.034 . . . . 0.0 119.192 169.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -97.09 -1.61 44.91 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.521 1.528 . . . . 0.0 113.797 -170.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 25.8 t -113.59 -36.9 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 O-C-N 118.226 -2.797 . . . . 0.0 109.174 176.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 55.7 mt -84.26 -75.71 0.33 Allowed 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 119.979 -1.701 . . . . 0.0 107.18 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 20.9 mt -47.73 -41.1 22.17 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 -165.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.01 3.32 4.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 115.048 -2.406 . . . . 0.0 113.674 178.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 56.4 m -94.92 9.12 40.5 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 115.213 1.561 . . . . 0.0 115.213 166.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 . . . . . 0 C--O 1.251 1.146 0 O-C-N 117.709 -3.12 . . . . 0.0 115.433 164.584 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 22.6 ttt . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.66 172.58 10.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 118.097 2.629 . . . . 0.0 118.097 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -89.67 152.27 21.45 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 66.3 tt0 -130.66 141.13 50.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 120.623 1.556 . . . . 0.0 113.464 155.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 7.9 p -124.74 148.73 60.23 Favored Pre-proline 0 N--CA 1.448 -0.53 0 O-C-N 120.076 -1.64 . . . . 0.0 114.567 -173.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -67.18 -19.8 50.35 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.259 1.973 . . . . 0.0 115.848 169.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -156.02 148.48 23.72 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 128.546 2.738 . . . . 0.0 111.36 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.8 t -147.81 127.72 13.56 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 125.301 1.626 . . . . 0.0 113.021 174.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.78 62.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 126.953 2.658 . . . . 0.0 110.807 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.53 -22.48 63.57 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 129.368 3.067 . . . . 0.0 114.034 167.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 23.0 mtt -81.57 -44.3 17.48 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 118.123 -2.861 . . . . 0.0 113.202 164.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.55 69.18 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 118.998 2.962 . . . . 0.0 118.998 177.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -76.62 -38.67 54.33 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 113.808 -1.542 . . . . 0.0 113.213 168.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -56.54 -43.41 79.86 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.909 -2.369 . . . . 0.0 113.9 170.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -47.74 83.86 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 130.107 3.363 . . . . 0.0 113.538 168.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -45.78 -49.36 15.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 162.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -69.9 -33.98 72.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 176.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.22 -27.7 67.45 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 115.955 -2.298 . . . . 0.0 113.462 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -73.13 -52.75 13.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 126.671 1.988 . . . . 0.0 112.869 169.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . 0.272 1.0 OUTLIER -62.03 -18.91 62.11 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 115.551 -2.166 . . . . 0.0 110.085 178.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -81.55 -44.23 17.61 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 114.935 -2.46 . . . . 0.0 112.644 176.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -48.89 -38.84 23.78 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 118.629 2.826 . . . . 0.0 118.629 171.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 43.7 t -75.04 -34.65 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 C-N-CA 127.526 2.33 . . . . 0.0 113.673 177.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -74.86 -39.54 61.5 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 122.662 2.483 . . . . 0.0 115.908 172.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 37.4 tp -55.59 -34.18 64.61 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 117.631 -3.168 . . . . 0.0 114.661 169.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . 0.283 30.5 tp -71.72 -32.52 67.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.52 1.928 . . . . 0.0 113.166 170.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -69.15 -34.3 74.76 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 125.603 1.814 . . . . 0.0 111.911 172.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 30.1 m-20 -73.17 -38.17 66.27 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 116.448 -3.907 . . . . 0.0 109.627 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.4 -32.64 65.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.723 2.809 . . . . 0.0 118.171 176.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -68.11 -18.25 64.59 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.642 1.977 . . . . 0.0 115.341 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -76.08 -23.32 55.0 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -174.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 19.5 p-10 -141.06 39.08 1.78 Allowed 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 127.417 2.287 . . . . 0.0 112.432 -166.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.345 0.8 OUTLIER 31.86 46.86 0.06 Allowed 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 118.405 2.743 . . . . 0.0 118.405 -176.073 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 27.3 mt -99.3 -2.49 36.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.619 2.081 . . . . 0.0 116.619 163.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 -58.28 -49.73 76.11 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 126.726 3.155 . . . . 0.0 110.875 -174.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 18.6 mt -74.03 -41.1 5.16 Favored Pre-proline 0 N--CA 1.447 -0.604 0 O-C-N 116.325 -3.985 . . . . 0.0 110.633 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -56.93 -39.87 88.25 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 124.26 3.306 . . . . 0.0 108.536 170.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 54.7 tp -77.96 -29.14 49.68 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 117.554 2.428 . . . . 0.0 117.554 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 51.5 mt -67.03 -23.31 65.89 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 117.254 -1.355 . . . . 0.0 113.758 161.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -91.31 -25.12 19.59 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 118.773 -1.171 . . . . 0.0 111.605 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.32 -54.34 46.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 119.029 -2.294 . . . . 0.0 112.038 159.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 21.5 mmt -72.05 -36.92 69.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 119.169 3.025 . . . . 0.0 119.169 -171.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.2 mp -105.66 144.21 32.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 117.837 2.532 . . . . 0.0 117.837 -175.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 67.0 p -78.38 161.7 69.02 Favored Pre-proline 0 N--CA 1.448 -0.527 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 166.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -47.8 -43.31 29.39 Favored 'Trans proline' 0 N--CA 1.447 -1.255 0 C-N-CA 124.81 3.673 . . . . 0.0 112.725 166.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -58.0 -42.49 85.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 172.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -68.6 -35.43 77.33 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 127.296 3.427 . . . . 0.0 114.239 -174.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 39.5 mtm-85 -73.52 -37.64 65.58 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 118.901 -2.374 . . . . 0.0 111.735 172.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -66.04 -36.59 83.64 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 125.444 1.715 . . . . 0.0 114.818 170.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.08 96.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 128.998 2.919 . . . . 0.0 107.975 177.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 57.4 mt -84.86 -31.73 23.61 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 117.19 -3.444 . . . . 0.0 111.969 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.52 -37.85 50.38 Favored Glycine 0 CA--C 1.526 0.725 0 O-C-N 126.768 2.542 . . . . 0.0 115.049 158.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 25.8 m -77.49 -40.11 44.08 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 33.5 mtt180 -72.99 -24.95 60.83 Favored 'General case' 0 N--CA 1.448 -0.525 1 CA-C-O 110.55 -4.548 . . . . 0.0 113.405 -173.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 80.3 t -62.54 -41.93 93.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 122.623 2.465 . . . . 0.0 111.991 163.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -76.06 -29.58 58.05 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 118.574 2.805 . . . . 0.0 118.574 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 63.5 mt -59.14 -42.1 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 O-C-N 118.805 -2.434 . . . . 0.0 111.942 166.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 66.8 t -59.41 -49.26 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 C-N-CA 126.176 1.791 . . . . 0.0 111.591 174.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -64.51 -38.5 91.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 113.172 -1.831 . . . . 0.0 110.585 -172.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -73.08 -33.7 65.77 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 117.391 -3.318 . . . . 0.0 114.93 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 87.1 mt -76.36 -13.57 60.13 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 169.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 55.7 mt -93.07 -15.92 25.56 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 120.738 1.608 . . . . 0.0 108.759 170.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -94.41 -34.91 12.57 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 120.51 1.505 . . . . 0.0 113.121 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.71 3.9 74.48 Favored Glycine 0 C--N 1.339 0.739 1 CA-C-O 110.552 -5.582 . . . . 0.0 113.827 165.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -93.24 58.36 2.85 Favored 'General case' 0 N--CA 1.444 -0.758 1 CA-C-N 124.327 4.064 . . . . 0.0 112.365 -154.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 20.3 mtt -147.16 144.4 28.95 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 125.073 1.483 . . . . 0.0 111.62 -167.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . 0.275 83.0 p -64.83 162.2 16.69 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 158.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -52.21 -41.74 62.95 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 129.44 3.096 . . . . 0.0 112.952 166.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 34.0 ttp-105 -53.2 -62.98 1.3 Allowed 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 128.644 3.715 . . . . 0.0 110.022 170.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -51.84 -51.82 53.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 123.931 0.77 . . . . 0.0 113.034 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 53.7 mt -50.94 -48.46 60.86 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 121.417 1.917 . . . . 0.0 114.278 174.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 54.5 tttt -62.31 -46.78 87.2 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 121.465 1.939 . . . . 0.0 106.536 -171.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -77.18 -35.45 55.82 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 115.784 -2.055 . . . . 0.0 116.535 -177.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -79.67 -36.95 36.91 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 118.155 2.65 . . . . 0.0 118.155 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.252 7.3 mp -94.39 -27.81 15.86 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 126.011 2.07 . . . . 0.0 110.728 -176.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.18 -149.33 49.94 Favored Glycine 0 CA--C 1.523 0.581 0 O-C-N 119.946 -1.721 . . . . 0.0 113.134 -175.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -52.82 -23.06 6.19 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 116.062 1.875 . . . . 0.0 116.062 163.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.28 -7.61 84.96 Favored Glycine 0 C--N 1.337 0.595 0 CA-C-O 114.855 -3.192 . . . . 0.0 112.794 -169.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 7.4 tt -59.05 -44.15 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 1 CA-C-O 111.512 -4.089 . . . . 0.0 113.155 167.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.53 -22.66 60.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 124.682 3.401 . . . . 0.0 113.871 172.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 8.5 m -64.66 -39.14 93.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.882 1.273 . . . . 0.0 107.665 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 36.8 mm -83.11 -33.73 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 119.327 -2.108 . . . . 0.0 114.384 170.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.6 p -105.06 9.56 34.31 Favored 'General case' 0 N--CA 1.449 -0.482 1 N-CA-C 122.846 4.387 . . . . 0.0 122.846 -164.152 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 20.7 mtp85 -128.14 145.56 50.98 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 118.032 -2.917 . . . . 0.0 113.086 -178.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 96.01 166.95 34.46 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 67.3 m -65.29 -30.97 71.88 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -171.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -98.79 6.48 46.87 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -173.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 51.6 p -55.86 158.67 3.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 130.946 3.699 . . . . 0.0 114.627 165.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 48.9 tp -61.81 -32.57 72.89 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 129.664 3.186 . . . . 0.0 111.066 -151.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.25 87.1 mttt -98.59 12.39 35.43 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 120.006 3.336 . . . . 0.0 120.006 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -136.19 -11.45 1.93 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 130.457 3.503 . . . . 0.0 115.217 -179.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.5 161.38 0.33 Allowed Pre-proline 0 N--CA 1.45 -0.47 0 C-N-CA 129.815 3.246 . . . . 0.0 113.14 166.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -49.66 138.61 32.4 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 123.745 2.964 . . . . 0.0 113.46 162.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 87.5 t -61.89 -31.7 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 128.841 2.856 . . . . 0.0 110.021 -177.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 12.7 pm0 -67.44 -34.6 77.54 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 116.853 -3.654 . . . . 0.0 114.288 -176.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 9.2 tp -73.0 -42.91 62.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.689 1.996 . . . . 0.0 110.1 174.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 70.0 mtp180 -61.53 -49.43 76.72 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 125.654 1.846 . . . . 0.0 112.082 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -73.51 -37.69 65.6 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 127.406 2.282 . . . . 0.0 109.289 -176.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.1 t90 -51.6 -56.9 10.93 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 163.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' C' ' 100' ' ' LEU . 55.6 mt -65.75 -17.51 64.67 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 120.107 -1.621 . . . . 0.0 111.975 -174.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -88.98 -25.95 21.75 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 122.819 2.554 . . . . 0.0 114.954 166.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.46 -12.89 61.28 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 169.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.16 -48.7 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 C-N-CA 127.005 2.122 . . . . 0.0 113.659 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 96.1 mt -85.12 -31.02 23.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 121.888 2.131 . . . . 0.0 112.635 -169.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.1 27.74 8.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 121.034 1.743 . . . . 0.0 113.695 -168.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 14.8 pttp . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 117.214 -1.374 . . . . 0.0 113.049 -169.1 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 53.6 p . . . . . 0 N--CA 1.445 -0.697 0 CA-C-O 117.718 -1.134 . . . . 0.0 110.767 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . 0.275 15.7 Cg_exo -68.01 -24.25 39.46 Favored 'Trans proline' 0 N--CA 1.451 -0.992 1 C-N-CA 125.851 4.367 . . . . 0.0 114.147 177.171 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -149.75 145.32 26.58 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-O 113.449 -3.167 . . . . 0.0 109.362 169.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 1.9 t -79.8 130.39 35.28 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 127.424 2.952 . . . . 0.0 108.112 173.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.37 -40.58 59.5 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 128.011 3.319 . . . . 0.0 110.905 162.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.03 -36.06 77.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 115.938 1.829 . . . . 0.0 115.938 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.269 14.0 mmt -62.05 -39.79 93.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.718 -1.134 . . . . 0.0 109.746 165.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.21 -20.46 62.81 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 122.371 2.35 . . . . 0.0 116.504 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -88.6 -44.6 10.52 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 119.152 -2.218 . . . . 0.0 107.381 171.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -62.0 -44.0 97.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.045 -1.659 . . . . 0.0 110.703 -172.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -27.97 69.78 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.27 1.952 . . . . 0.0 116.27 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -74.65 -34.21 62.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.107 1.763 . . . . 0.0 109.2 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -81.73 -23.11 36.91 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 118.003 -2.936 . . . . 0.0 112.123 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . 0.253 59.4 mt-10 -70.39 -26.03 63.52 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 117.836 -3.04 . . . . 0.0 111.848 161.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 5.9 t-105 -82.04 -35.89 28.31 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 117.019 -1.467 . . . . 0.0 113.44 174.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.49 -25.99 68.51 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 117.0 -1.476 . . . . 0.0 110.336 173.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -73.55 -20.77 60.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 130.58 3.552 . . . . 0.0 107.949 177.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -97.52 -24.66 15.47 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 120.965 1.711 . . . . 0.0 113.014 167.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 79.6 t -65.14 -41.65 92.3 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 O-C-N 117.936 -2.977 . . . . 0.0 110.252 169.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -65.95 -40.62 91.51 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 121.945 2.157 . . . . 0.0 115.351 171.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 16.3 tp -57.76 -43.84 85.74 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 120.095 -1.628 . . . . 0.0 111.274 174.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 23.8 tp -60.02 -45.75 91.76 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 ttpp -56.05 -45.0 79.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 126.564 3.078 . . . . 0.0 110.809 176.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -69.9 -15.67 63.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 112.139 -2.3 . . . . 0.0 114.574 174.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . 0.44 ' HB1' ' HA ' ' D' ' 35' ' ' HIS . . . -83.03 -34.87 26.17 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 127.911 2.484 . . . . 0.0 117.404 167.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -62.84 -33.45 75.28 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 121.049 -1.032 . . . . 0.0 111.416 170.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -73.8 -25.98 60.4 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 129.595 3.158 . . . . 0.0 115.489 -171.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.9 p30 -116.79 1.35 12.73 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.907 1.379 . . . . 0.0 112.788 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 70.01 29.01 4.0 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 129.825 3.25 . . . . 0.0 115.019 -178.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 61.3 mt -99.29 10.31 41.66 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 119.979 -1.701 . . . . 0.0 109.896 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . 0.44 ' HA ' ' HB1' ' D' ' 29' ' ' ALA . 0.0 OUTLIER -54.91 -57.95 9.55 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 3.1 mt -64.95 -36.93 17.93 Favored Pre-proline 0 N--CA 1.449 -0.509 0 O-C-N 121.221 -0.925 . . . . 0.0 110.786 -172.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.81 -40.25 65.18 Favored 'Trans proline' 0 N--CA 1.447 -1.221 0 N-CA-C 119.207 2.734 . . . . 0.0 119.207 162.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 16.5 tp -68.41 -43.07 78.02 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 117.073 -3.517 . . . . 0.0 112.096 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 77.1 mt -57.52 -48.38 79.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 126.515 2.384 . . . . 0.0 110.137 171.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -78.96 -29.24 43.8 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 117.439 -3.288 . . . . 0.0 108.734 -166.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.38 -54.8 41.24 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.181 0.992 . . . . 0.0 109.348 161.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 5.1 mmt -57.53 -49.16 77.24 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 114.424 -2.703 . . . . 0.0 114.624 -177.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 23.0 mt -111.09 133.03 53.78 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.464 1.906 . . . . 0.0 114.212 -164.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 76.5 p -68.1 151.0 97.53 Favored Pre-proline 0 N--CA 1.448 -0.543 0 O-C-N 126.061 2.101 . . . . 0.0 112.016 173.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -46.46 -43.82 21.64 Favored 'Trans proline' 0 N--CA 1.447 -1.215 1 C-N-CA 129.252 6.634 . . . . 0.0 114.904 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.89 -24.07 62.42 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 174.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -73.46 -25.3 60.43 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 114.187 -2.816 . . . . 0.0 112.986 166.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 26.0 mtm180 -89.31 -26.58 21.04 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 125.072 3.578 . . . . 0.0 111.743 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -51.78 -48.89 63.58 Favored 'General case' 0 N--CA 1.45 -0.455 1 C-N-CA 132.703 4.401 . . . . 0.0 111.761 159.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.3 -38.39 35.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 126.552 2.407 . . . . 0.0 115.272 -179.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.18 -34.74 78.29 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 118.214 2.672 . . . . 0.0 118.214 165.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.34 -41.62 99.74 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-O 117.665 -1.631 . . . . 0.0 115.86 166.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 52.1 m -59.58 -46.8 87.86 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 123.658 1.694 . . . . 0.0 110.016 168.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -59.16 -31.94 69.44 Favored 'General case' 0 N--CA 1.45 -0.453 2 O-C-N 114.297 -5.252 . . . . 0.0 111.011 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 99.0 t -57.37 -57.5 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 CA-C-N 122.116 2.234 . . . . 0.0 110.38 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -68.94 -27.24 65.56 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 115.63 -2.128 . . . . 0.0 114.451 176.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 79.6 mt -54.26 -66.14 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-N 121.27 1.85 . . . . 0.0 106.803 167.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 61.2 t -42.87 -51.01 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 O-C-N 120.818 -1.176 . . . . 0.0 113.765 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.36 -48.75 76.19 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . 0.43 ' HA ' ' HB3' ' D' ' 63' ' ' ARG . 29.3 mm-40 -68.35 -22.51 64.67 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 117.474 -1.251 . . . . 0.0 113.505 177.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 31.8 mt -77.33 -3.13 38.41 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 125.397 2.522 . . . . 0.0 116.96 174.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 77.6 mt -104.01 -28.63 11.42 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.573 1.949 . . . . 0.0 111.946 168.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . 0.43 ' HB3' ' HA ' ' D' ' 60' ' ' GLU . 39.4 ttm105 -77.49 -51.11 11.29 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.882 -3.011 . . . . 0.0 113.313 175.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.37 41.51 91.0 Favored Glycine 0 C--N 1.337 0.637 0 CA-C-O 116.173 -2.46 . . . . 0.0 111.362 163.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -115.95 -42.07 3.12 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 121.342 2.571 . . . . 0.0 108.212 -174.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 15.0 mmt -77.73 61.37 2.4 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 113.584 -1.644 . . . . 0.0 111.67 159.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 75.2 p -93.42 -176.49 4.13 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.192 1.397 . . . . 0.0 114.032 -173.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.371 2.8 tp-100 69.22 -109.0 0.08 Allowed 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 119.193 -2.192 . . . . 0.0 114.903 165.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -73.88 -37.29 64.78 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 116.545 -1.693 . . . . 0.0 110.477 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -69.84 -45.1 68.54 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 130.477 3.511 . . . . 0.0 113.631 -169.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.03 -18.03 59.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 113.824 -2.989 . . . . 0.0 111.377 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -106.25 -12.27 15.77 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 123.07 2.668 . . . . 0.0 116.318 174.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -119.76 -15.62 8.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 118.885 2.92 . . . . 0.0 118.885 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -124.59 -17.9 5.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 123.123 2.692 . . . . 0.0 112.204 172.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' D' ' 75' ' ' LEU . 4.4 mm? -84.99 -52.9 5.65 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.604 -1.665 . . . . 0.0 111.652 161.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 109.19 -167.14 12.81 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 119.257 -1.449 . . . . 0.0 112.206 146.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.09 -34.79 63.94 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -173.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -38.16 -24.14 0.02 OUTLIER Glycine 0 CA--C 1.523 0.548 0 CA-C-O 117.023 -1.987 . . . . 0.0 114.966 165.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 19.8 tt -60.64 -25.77 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 120.373 2.086 . . . . 0.0 112.847 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.85 -33.54 34.43 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 117.293 -1.337 . . . . 0.0 109.03 -176.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 33.9 m -70.57 -20.24 62.8 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 122.159 2.254 . . . . 0.0 109.929 170.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 25.1 mm -95.49 -30.64 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -173.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 7.1 p -105.19 -26.01 12.23 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 114.495 -2.669 . . . . 0.0 113.883 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.275 22.9 mtp85 -82.6 168.77 16.99 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 125.376 3.716 . . . . 0.0 112.493 167.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.92 154.24 29.37 Favored Glycine 0 C--N 1.337 0.618 0 CA-C-O 122.952 1.306 . . . . 0.0 114.617 177.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 92.5 p -74.17 -16.66 60.98 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.974 -1.113 . . . . 0.0 111.448 -147.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -135.3 64.48 1.58 Allowed 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 125.612 2.625 . . . . 0.0 107.735 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 24.8 p -97.62 -169.4 1.83 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 127.106 2.163 . . . . 0.0 112.389 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.21 -21.39 56.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 119.25 -2.156 . . . . 0.0 111.479 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 19.6 tttt -84.96 0.07 52.55 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.953 2.901 . . . . 0.0 109.748 174.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.45 -34.43 6.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 120.28 -1.513 . . . . 0.0 110.854 175.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 53.1 76.52 0.52 Allowed Pre-proline 0 N--CA 1.449 -0.519 0 CA-C-N 122.794 2.543 . . . . 0.0 111.389 164.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.283 98.5 Cg_exo 17.2 40.53 0.0 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.002 0 N-CA-C 116.941 1.862 . . . . 0.0 116.941 53.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 72.8 t -43.61 -26.33 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 128.564 2.746 . . . . 0.0 115.897 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.49 -30.29 8.01 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.695 1.998 . . . . 0.0 110.337 -160.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 24.2 tp -57.5 -46.4 83.81 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.744 -2.472 . . . . 0.0 111.223 147.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -60.38 -43.82 96.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 115.742 1.756 . . . . 0.0 115.742 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -62.62 -36.58 83.22 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.116 2.167 . . . . 0.0 113.616 166.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 80.6 t90 -65.45 -44.42 87.34 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 118.351 -2.718 . . . . 0.0 110.137 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . 0.4 ' HB3' HD12 ' D' ' 104' ' ' LEU . 47.2 mt -60.69 -36.3 78.45 Favored 'General case' 0 N--CA 1.446 -0.663 1 O-C-N 116.103 -4.123 . . . . 0.0 109.744 179.023 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -57.41 -29.26 63.97 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -101.74 -22.14 14.47 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 129.712 3.205 . . . . 0.0 110.79 -173.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 50.6 t -86.69 -38.53 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-O 123.78 1.752 . . . . 0.0 111.761 175.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . 0.4 HD12 ' HB3' ' D' ' 100' ' ' LEU 0.294 15.3 mt -96.58 -28.73 14.23 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 114.002 -2.904 . . . . 0.0 116.062 -175.479 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 12.3 mt -102.05 34.71 2.6 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.754 1.615 . . . . 0.0 107.883 172.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . 0.313 17.6 pttp -62.15 165.69 5.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.828 178.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.37 -42.48 15.05 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.668 3.587 . . . . 0.0 113.232 -177.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.249 1.032 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 176.756 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 17.0 ttp . . . . . 0 N--CA 1.451 -0.417 0 CA-C-O 122.74 1.257 . . . . 0.0 111.805 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.44 -31.62 68.87 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 114.121 -2.847 . . . . 0.0 110.499 -173.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.271 26.6 tp10 -58.97 -43.63 91.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 125.85 1.969 . . . . 0.0 114.334 168.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -59.8 -50.7 72.77 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 125.783 2.706 . . . . 0.0 114.554 174.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -62.78 -24.74 67.88 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 117.253 -3.404 . . . . 0.0 114.396 170.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . 0.271 1.8 t60 -66.99 -43.17 83.66 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.433 1.493 . . . . 0.0 113.38 171.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -76.38 -30.71 57.64 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 125.955 2.034 . . . . 0.0 107.749 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -65.86 -41.59 91.48 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 122.053 2.206 . . . . 0.0 111.448 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 12.8 t-105 -70.0 -52.96 19.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 127.651 2.38 . . . . 0.0 108.063 176.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 mt -62.17 -21.45 65.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 114.264 -2.779 . . . . 0.0 115.378 177.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -53.28 -43.04 67.15 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 118.439 2.755 . . . . 0.0 118.439 161.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -62.38 -39.31 92.77 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 129.17 2.988 . . . . 0.0 107.429 172.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.4 t -79.68 -24.11 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 120.465 1.484 . . . . 0.0 109.997 -176.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . 0.26 6.1 m-20 -59.92 -61.25 2.75 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 116.716 -3.74 . . . . 0.0 115.937 160.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 47.9 tp -44.73 -53.22 7.56 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 131.533 3.933 . . . . 0.0 114.154 173.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.6 tp -67.24 -36.29 81.32 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -64.73 -38.37 90.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.349 176.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -75.06 -32.8 61.6 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 114.956 -2.45 . . . . 0.0 111.516 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.96 -25.14 52.46 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 120.763 1.62 . . . . 0.0 114.863 172.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -59.8 -44.85 93.77 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 122.361 2.346 . . . . 0.0 112.042 162.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -78.31 16.68 0.74 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 113.978 -2.915 . . . . 0.0 113.348 176.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -131.76 7.39 4.42 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 121.461 1.937 . . . . 0.0 113.659 162.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.28 14.3 m-20 46.58 32.6 1.71 Allowed 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 128.138 2.575 . . . . 0.0 117.576 -165.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.1 mt -90.09 4.42 50.37 Favored 'General case' 0 N--CA 1.452 -0.368 1 O-C-N 115.877 -4.264 . . . . 0.0 113.235 166.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 p-80 -58.11 -43.73 87.31 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 116.968 -3.583 . . . . 0.0 115.164 -177.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 56.7 mt -64.06 -47.02 80.53 Favored Pre-proline 0 N--CA 1.452 -0.326 0 CA-C-O 117.087 -1.435 . . . . 0.0 111.676 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 15.0 Cg_exo -53.09 -40.2 77.54 Favored 'Trans proline' 0 N--CA 1.448 -1.187 1 C-N-CA 125.667 4.245 . . . . 0.0 114.471 174.512 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 24.7 tp -74.19 -39.4 63.19 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 117.196 -3.44 . . . . 0.0 110.277 -175.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.8 mt -83.44 3.06 33.63 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 126.334 2.271 . . . . 0.0 112.837 176.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -103.96 -9.04 19.17 Favored 'General case' 0 N--CA 1.446 -0.635 1 O-C-N 115.398 -4.564 . . . . 0.0 116.225 162.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 tt -97.0 -55.77 2.76 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.827 2.051 . . . . 0.0 108.385 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 57.8 mmm -72.69 -10.9 60.34 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 123.693 1.711 . . . . 0.0 115.41 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.5 mt -134.82 135.07 41.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 118.404 -2.685 . . . . 0.0 110.62 -176.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 74.2 p -87.27 162.18 43.9 Favored Pre-proline 0 N--CA 1.448 -0.536 0 O-C-N 116.744 -3.723 . . . . 0.0 111.64 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -56.7 -51.83 8.22 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 124.139 3.226 . . . . 0.0 112.593 -169.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -68.94 -16.76 63.83 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 127.454 2.302 . . . . 0.0 113.452 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -87.14 -39.41 15.56 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 118.237 -2.789 . . . . 0.0 112.344 170.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.266 78.5 mtm-85 -64.2 -40.5 96.2 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 117.386 -3.321 . . . . 0.0 114.205 167.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.44 ' HG3' ' HD2' ' B' ' 15' ' ' ARG . 23.2 tt0 -61.4 -45.65 93.44 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 116.054 -1.927 . . . . 0.0 111.946 176.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.28 -37.78 78.03 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 128.778 3.799 . . . . 0.0 112.247 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 70.6 mt -69.34 -26.08 64.52 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 121.236 1.834 . . . . 0.0 114.401 172.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.84 -45.49 57.58 Favored Glycine 0 C--N 1.336 0.537 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 173.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.1 m -64.15 -30.26 71.34 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 115.795 -2.05 . . . . 0.0 113.18 171.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.484 HH12 ' CD ' ' B' ' 47' ' ' GLU . 32.0 ttm180 -56.8 -34.78 68.02 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 120.438 1.472 . . . . 0.0 113.099 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 65.5 t -59.03 -37.41 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 116.411 -1.757 . . . . 0.0 113.019 172.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -67.63 -31.84 72.14 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 122.749 2.522 . . . . 0.0 114.236 171.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.276 64.4 mt -63.57 -39.42 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 O-C-N 120.019 -1.676 . . . . 0.0 107.846 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.6 t -79.13 -37.19 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 127.648 2.379 . . . . 0.0 113.369 -177.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -47.16 -60.9 2.16 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 125.711 1.882 . . . . 0.0 110.87 158.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -70.6 -14.05 62.33 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 126.685 3.136 . . . . 0.0 116.204 -175.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.406 HD21 HG22 ' A' ' 82' ' ' ILE . 93.9 mt -82.45 -39.35 22.68 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 116.739 -3.726 . . . . 0.0 111.673 167.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 tp -68.96 -47.48 65.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.354 1.433 . . . . 0.0 111.439 172.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.1 ttm105 -57.21 -62.19 1.94 Allowed 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.521 -3.237 . . . . 0.0 108.39 173.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.06 7.53 64.05 Favored Glycine 0 CA--C 1.522 0.506 0 O-C-N 119.756 -1.84 . . . . 0.0 117.404 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -97.11 -12.7 22.82 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 -165.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 22.1 ttm -138.41 134.68 34.42 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 127.394 2.933 . . . . 0.0 114.285 -167.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -97.56 157.9 15.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.099 -2.251 . . . . 0.0 115.845 -152.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -48.67 -37.19 17.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -174.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.3 tpt85 -75.83 -13.78 60.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 118.18 -2.825 . . . . 0.0 113.509 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -102.0 -36.56 8.55 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 117.159 -3.463 . . . . 0.0 105.778 -173.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 29.0 mt -67.78 -22.11 65.21 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 117.87 -3.019 . . . . 0.0 116.32 170.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.0 tptt -50.44 -29.98 11.53 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 115.502 1.668 . . . . 0.0 115.502 159.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -103.94 -50.74 3.31 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 174.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -66.46 -16.0 63.78 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 116.89 2.181 . . . . 0.0 116.89 -175.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 95.7 mt -129.63 -5.54 4.67 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 115.313 -2.279 . . . . 0.0 112.299 170.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 73.79 6.48 72.52 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-N 119.989 1.268 . . . . 0.0 115.839 -172.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.15 157.09 22.91 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 124.321 2.01 . . . . 0.0 113.404 -160.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.71 130.12 9.61 Favored Glycine 0 N--CA 1.446 -0.689 0 O-C-N 120.436 -1.415 . . . . 0.0 115.971 172.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 16.4 mt -61.32 -38.32 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 128.346 2.658 . . . . 0.0 114.12 -168.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.12 -13.15 62.27 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 117.686 2.476 . . . . 0.0 117.686 171.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.0 p -82.67 -48.3 11.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 120.83 -1.169 . . . . 0.0 111.992 169.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.406 HG22 HD21 ' A' ' 61' ' ' LEU . 6.5 mm -49.13 -39.42 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 123.147 1.451 . . . . 0.0 114.013 164.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.0 m -68.55 -49.2 61.31 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 120.74 -1.225 . . . . 0.0 108.496 -174.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.9 ttt180 -64.2 -37.32 87.04 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 125.411 1.695 . . . . 0.0 113.816 174.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.38 -47.48 62.3 Favored Glycine 0 C--N 1.338 0.64 0 C-N-CA 127.18 2.324 . . . . 0.0 109.791 172.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.6 m -58.99 -54.19 49.92 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 118.966 2.95 . . . . 0.0 118.966 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -59.13 -27.53 65.7 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 126.126 1.77 . . . . 0.0 113.49 168.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 56.1 m -67.0 -43.88 81.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 120.931 1.696 . . . . 0.0 112.011 168.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 89' ' ' LEU . 12.7 tp -62.33 -41.94 98.97 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.811 2.044 . . . . 0.0 109.2 176.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -60.37 -34.97 74.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 124.405 3.275 . . . . 0.0 110.29 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.33 -5.72 59.23 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.735 -1.853 . . . . 0.0 115.956 177.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.86 140.52 58.42 Favored Pre-proline 0 N--CA 1.449 -0.521 0 O-C-N 125.207 1.567 . . . . 0.0 110.605 -176.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -57.98 139.12 89.29 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 C-N-CA 125.218 3.946 . . . . 0.0 110.037 173.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.9 m -57.23 -29.52 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 119.705 -1.872 . . . . 0.0 111.738 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -70.16 -36.49 74.75 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 124.362 1.039 . . . . 0.0 113.145 -177.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 14.8 tp -60.18 -49.61 76.93 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 166.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -54.15 -42.52 69.66 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.61 1.564 . . . . 0.0 107.928 177.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -74.53 -31.1 62.03 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 123.571 1.653 . . . . 0.0 114.131 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . 0.296 65.4 t90 -70.73 -42.42 70.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 116.411 -3.93 . . . . 0.0 109.884 173.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.1 mt -60.83 -37.28 81.5 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 118.75 -2.469 . . . . 0.0 116.88 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . 0.274 44.2 mt-10 -60.65 -14.06 18.3 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 118.407 2.743 . . . . 0.0 118.407 -178.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -99.38 -12.81 19.94 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.433 2.293 . . . . 0.0 113.782 176.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.4 t -117.99 -31.98 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 O-C-N 118.106 -2.871 . . . . 0.0 116.807 -174.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.2 mt -84.08 -35.04 24.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 126.309 2.957 . . . . 0.0 118.808 174.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.283 21.3 mt -112.02 -18.83 12.53 Favored 'General case' 0 N--CA 1.448 -0.553 1 N-CA-C 122.516 4.265 . . . . 0.0 122.516 -160.289 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.6 tttt . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 117.843 2.535 . . . . 0.0 117.843 -176.943 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.275 . . . . . . . 0 N--CA 1.453 -0.308 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 90.4 mtp -74.67 -47.58 30.98 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 120.503 -1.373 . . . . 0.0 110.204 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.4 -37.73 70.53 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 170.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -73.88 -33.62 64.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.779 2.082 . . . . 0.0 116.133 172.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -55.58 -59.11 5.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 163.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.44 ' HD2' ' HG3' ' A' ' 49' ' ' GLU . 35.4 mmt180 -48.75 -33.19 9.82 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 120.462 3.504 . . . . 0.0 120.462 172.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -60.27 -40.27 89.78 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 121.269 1.85 . . . . 0.0 112.664 170.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -72.6 -38.61 67.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 118.06 2.615 . . . . 0.0 118.06 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -59.87 -23.49 63.47 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.263 -0.975 . . . . 0.0 113.532 169.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 6.4 t-105 -82.22 -46.74 13.33 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.72 2.408 . . . . 0.0 109.167 172.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 76.9 mt -57.82 -27.21 62.96 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 119.567 -1.958 . . . . 0.0 115.727 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -59.5 -45.32 92.04 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 119.154 -2.216 . . . . 0.0 111.963 174.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -59.31 -51.58 69.32 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 114.942 -2.456 . . . . 0.0 110.96 176.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 89.1 t -67.6 -27.54 38.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 O-C-N 127.957 3.286 . . . . 0.0 110.327 -173.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -77.21 -39.74 47.6 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 116.547 -3.846 . . . . 0.0 111.397 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 31.7 tp -70.07 -37.24 75.44 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 117.659 -3.151 . . . . 0.0 110.961 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.61 -47.57 85.05 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 118.793 2.886 . . . . 0.0 118.793 165.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -61.02 -29.66 69.85 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 128.338 3.524 . . . . 0.0 111.698 173.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -91.57 -24.69 19.52 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 117.073 2.249 . . . . 0.0 117.073 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.41 -26.34 63.15 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.253 1.946 . . . . 0.0 116.253 164.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -61.56 -32.09 72.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 126.205 1.802 . . . . 0.0 115.547 169.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -81.64 -2.16 49.29 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 123.744 1.735 . . . . 0.0 111.52 -170.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -128.71 7.96 5.75 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 119.039 -2.288 . . . . 0.0 109.893 -173.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.392 14.5 m-20 58.36 21.58 8.49 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 119.732 -1.855 . . . . 0.0 115.144 -167.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 mt -102.26 20.02 17.61 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 120.582 3.549 . . . . 0.0 120.582 178.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -76.52 -46.46 26.46 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 118.692 -2.505 . . . . 0.0 112.779 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 25.7 mt -63.57 -41.66 67.66 Favored Pre-proline 0 N--CA 1.448 -0.569 0 CA-C-N 121.737 2.062 . . . . 0.0 113.18 174.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.287 40.1 Cg_exo -49.08 -47.97 19.93 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 124.941 3.76 . . . . 0.0 115.887 162.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -65.78 -35.01 79.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.267 -2.771 . . . . 0.0 108.688 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 57.2 mt -70.04 -40.75 74.95 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 118.087 2.625 . . . . 0.0 118.087 177.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -52.03 -25.54 8.77 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.4 1.88 . . . . 0.0 113.129 162.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 19.0 tp -91.96 -35.31 14.07 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.587 1.555 . . . . 0.0 112.853 178.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 21.8 mmt -94.46 -8.88 37.22 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 118.507 2.78 . . . . 0.0 118.507 -176.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 53.4 mt -141.94 126.85 18.24 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.786 1.634 . . . . 0.0 113.501 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 44.7 p -61.08 154.93 58.37 Favored Pre-proline 0 N--CA 1.449 -0.501 1 O-C-N 113.841 -5.537 . . . . 0.0 110.541 169.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -50.28 -22.8 8.96 Favored 'Trans proline' 0 N--CA 1.447 -1.213 0 N-CA-C 120.498 3.23 . . . . 0.0 120.498 174.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -81.68 -36.77 28.36 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 117.483 -3.261 . . . . 0.0 114.554 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . 0.484 ' CD ' HH12 ' A' ' 54' ' ' ARG . 19.5 mt-10 -62.23 -43.63 98.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 114.469 -2.682 . . . . 0.0 111.366 162.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -65.81 -33.99 77.13 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 125.587 1.804 . . . . 0.0 112.045 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -60.48 -43.45 96.94 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.885 -1.052 . . . . 0.0 113.276 168.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . 0.347 . . -65.91 -56.56 11.15 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 115.72 -2.086 . . . . 0.0 109.677 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.302 10.6 mt -59.0 -30.95 68.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 121.196 1.816 . . . . 0.0 111.427 -178.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.03 -52.86 44.65 Favored Glycine 0 CA--C 1.523 0.582 0 CA-C-O 114.747 -3.252 . . . . 0.0 110.929 170.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 25.8 m -66.78 -28.63 68.54 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.189 2.195 . . . . 0.0 108.713 -174.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -63.08 -26.03 68.64 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.937 1.695 . . . . 0.0 111.809 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 79.6 t -64.89 -48.89 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 125.032 1.457 . . . . 0.0 111.225 169.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 24.7 mtp180 -66.33 -33.53 75.95 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 118.121 -2.862 . . . . 0.0 109.624 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 85.2 mt -64.07 -59.27 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 O-C-N 121.022 -1.049 . . . . 0.0 111.7 172.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 39.6 t -56.33 -40.01 63.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 O-C-N 121.399 -0.813 . . . . 0.0 111.449 178.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -67.01 -32.43 73.65 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.228 -0.92 . . . . 0.0 111.828 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -80.79 -18.78 46.45 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.828 1.299 . . . . 0.0 108.935 176.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . 0.334 76.1 mt -88.93 10.18 22.28 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 114.699 -2.572 . . . . 0.0 110.95 170.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 15.1 mt -112.8 -29.33 7.44 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 118.931 2.937 . . . . 0.0 118.931 150.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.37 21.5 ttm105 -58.83 -70.0 0.17 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 127.533 2.333 . . . . 0.0 111.639 176.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.67 27.89 9.35 Favored Glycine 0 C--N 1.336 0.538 1 CA-C-O 112.905 -4.275 . . . . 0.0 112.273 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -113.41 -22.19 10.5 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 119.496 3.147 . . . . 0.0 119.496 -176.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . 0.277 13.5 mtt -84.82 147.48 26.8 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 126.364 2.29 . . . . 0.0 111.313 -174.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 87.4 p -95.1 169.55 10.03 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 116.799 -1.961 . . . . 0.0 112.322 168.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -62.56 -31.85 72.73 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 116.883 -1.532 . . . . 0.0 112.51 -176.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 31.3 ttt180 -63.1 -50.88 68.77 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 126.345 2.278 . . . . 0.0 106.052 176.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -61.53 -44.39 97.14 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 127.672 2.389 . . . . 0.0 109.232 -174.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 31.1 mt -63.49 -46.42 86.2 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.82 -1.086 . . . . 0.0 113.48 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -63.93 -43.14 96.78 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.725 1.266 . . . . 0.0 110.954 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -68.58 -59.35 3.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.102 0.961 . . . . 0.0 110.421 -176.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -93.21 -61.11 1.64 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.42 -1.276 . . . . 0.0 111.444 -161.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 30.1 mt -74.23 -14.66 60.96 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 92.89 -1.29 70.76 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-O 124.188 1.993 . . . . 0.0 112.033 162.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.07 114.72 26.67 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -162.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.7 171.1 53.65 Favored Glycine 0 C--N 1.332 0.312 0 O-C-N 119.42 -2.05 . . . . 0.0 116.074 -176.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 11.4 mm -52.91 -43.62 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-O 115.319 -2.276 . . . . 0.0 111.368 -174.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.58 -27.52 62.24 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 123.366 2.803 . . . . 0.0 113.91 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 30.3 m -67.45 -49.62 62.88 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 121.252 1.842 . . . . 0.0 112.822 173.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 15.6 mm -64.5 -39.6 86.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 C-N-CA 125.827 1.651 . . . . 0.0 112.777 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 98.3 m -49.25 -52.63 25.98 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 162.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 42.5 ttt180 -63.22 -34.56 77.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 125.91 1.684 . . . . 0.0 114.498 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -60.49 -46.76 93.76 Favored Glycine 0 CA--C 1.521 0.438 0 O-C-N 126.125 2.141 . . . . 0.0 114.198 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 2.4 p -76.02 -27.36 57.32 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.614 1.166 . . . . 0.0 107.855 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -67.26 -43.09 82.74 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 119.71 1.141 . . . . 0.0 112.314 170.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . 0.26 51.5 m -79.66 -22.6 43.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.728 2.411 . . . . 0.0 109.886 -168.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 15.0 mt -78.13 -39.92 39.68 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 118.993 -2.317 . . . . 0.0 109.102 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 47.8 tttm -70.44 -24.32 62.88 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.873 1.269 . . . . 0.0 110.483 -172.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.9 -23.67 31.11 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 115.25 -2.309 . . . . 0.0 113.502 166.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.93 150.2 88.48 Favored Pre-proline 0 N--CA 1.45 -0.46 0 CA-C-N 121.391 1.905 . . . . 0.0 115.098 -164.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -46.52 132.56 16.17 Favored 'Trans proline' 0 N--CA 1.451 -1.024 0 O-C-N 122.944 0.971 . . . . 0.0 110.641 163.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.422 ' H ' HG13 ' B' ' 94' ' ' VAL . 1.1 m -61.93 -26.38 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 O-C-N 119.583 -1.948 . . . . 0.0 113.322 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pm0 -67.84 -25.04 65.35 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 124.372 2.034 . . . . 0.0 114.829 176.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 21.3 tp -73.33 -46.94 46.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 117.046 -3.534 . . . . 0.0 109.478 167.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 48.8 mtp85 -60.75 -38.63 85.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 126.743 2.527 . . . . 0.0 115.386 -175.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -60.45 -45.14 94.78 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.967 2.107 . . . . 0.0 112.182 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -77.28 -46.19 23.88 Favored 'General case' 0 N--CA 1.449 -0.525 1 C-N-CA 131.731 4.013 . . . . 0.0 108.264 -170.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 38.3 mt -54.77 -49.23 71.39 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 174.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -49.24 -55.35 12.87 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 126.099 2.125 . . . . 0.0 109.614 172.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -72.59 -18.03 61.64 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 121.037 3.717 . . . . 0.0 121.037 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 56.3 t -87.8 -42.28 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 115.639 -2.124 . . . . 0.0 111.281 171.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 52.7 mt -88.19 -65.57 1.0 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 120.405 1.457 . . . . 0.0 112.752 -167.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 83.9 mt -57.0 -30.52 64.24 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 120.054 -1.654 . . . . 0.0 114.022 -167.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -66.38 -10.26 41.65 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 117.78 2.511 . . . . 0.0 117.78 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 45.8 m -104.81 7.07 34.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 124.38 2.038 . . . . 0.0 114.651 -177.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 . . . . . 0 C--O 1.25 1.119 1 O-C-N 115.555 -4.466 . . . . 0.0 113.697 163.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ttt . . . . . 0 N--CA 1.469 0.51 0 N-CA-C 104.306 -2.479 . . . . 0.0 104.306 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.24 155.68 20.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.502 1.921 . . . . 0.0 112.77 176.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -122.6 161.88 22.9 Favored 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 125.825 1.953 . . . . 0.0 110.219 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -123.59 164.64 18.62 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.737 1.215 . . . . 0.0 110.157 165.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -151.83 154.25 32.66 Favored Pre-proline 0 N--CA 1.447 -0.592 0 O-C-N 127.25 2.843 . . . . 0.0 115.479 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.92 -14.24 13.83 Favored 'Trans proline' 0 N--CA 1.446 -1.307 1 C-N-CA 125.591 4.194 . . . . 0.0 113.321 174.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -147.48 135.31 21.15 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.766 -2.459 . . . . 0.0 106.33 172.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 15.4 t -138.19 134.47 34.53 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 123.15 1.452 . . . . 0.0 109.819 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.38 -34.54 78.19 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 116.39 -3.944 . . . . 0.0 115.198 177.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.96 -35.38 72.14 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.622 1.569 . . . . 0.0 113.018 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 59.2 mtt -64.0 -40.71 96.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 122.264 1.03 . . . . 0.0 109.374 171.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.29 -20.46 61.5 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 176.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -66.14 -50.86 62.52 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 120.456 -1.403 . . . . 0.0 107.86 162.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -60.96 -40.42 93.3 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -170.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -44.57 83.08 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 128.737 2.815 . . . . 0.0 113.906 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -62.65 -28.83 70.19 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 170.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -68.68 -24.81 64.55 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 119.01 2.967 . . . . 0.0 119.01 169.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -80.92 -42.05 21.99 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 125.729 1.893 . . . . 0.0 110.544 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . 0.661 ' CZ2' ' HD2' ' D' ' 48' ' ' ARG . 28.9 t-105 -62.96 -46.7 86.47 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 125.674 1.59 . . . . 0.0 112.997 169.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 5.7 mp -60.89 -36.8 80.17 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 116.358 -1.782 . . . . 0.0 109.551 175.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -70.24 -31.59 69.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 118.852 2.908 . . . . 0.0 118.852 171.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -53.34 -42.93 67.25 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.564 1.945 . . . . 0.0 111.175 161.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.312 42.6 t -65.63 -50.23 72.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 124.89 1.369 . . . . 0.0 112.287 174.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -70.44 -29.54 66.14 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 117.569 2.433 . . . . 0.0 117.569 -175.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 24.0 tp -70.19 -61.2 1.87 Allowed 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 126.453 3.025 . . . . 0.0 104.501 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 36.0 tp -52.12 -30.35 25.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 118.155 -2.84 . . . . 0.0 113.695 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -62.52 -39.5 93.75 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.804 1.241 . . . . 0.0 113.631 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -81.71 -20.52 39.24 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 125.868 1.667 . . . . 0.0 111.265 178.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.14 71.26 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.377 1.071 . . . . 0.0 112.102 -176.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -61.03 -35.68 77.54 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 120.059 1.3 . . . . 0.0 112.406 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -59.42 -29.22 67.6 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 126.922 2.639 . . . . 0.0 110.552 -157.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 34.7 p-10 -128.68 35.36 4.37 Favored 'General case' 0 N--CA 1.447 -0.587 1 C-N-CA 132.886 4.474 . . . . 0.0 115.339 172.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.415 79.3 m-20 61.98 18.3 9.76 Favored 'General case' 0 N--CA 1.45 -0.472 1 N-CA-C 122.293 4.183 . . . . 0.0 122.293 175.543 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.309 45.6 mt -78.71 -4.31 48.51 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 118.072 -2.893 . . . . 0.0 116.343 174.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -71.39 -41.98 68.97 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 117.081 -1.438 . . . . 0.0 111.892 -170.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . 0.449 ' HB2' ' HD3' ' C' ' 37' ' ' PRO . 12.9 mt -64.2 -51.23 63.5 Favored Pre-proline 0 N--CA 1.446 -0.669 0 CA-C-O 116.017 -1.944 . . . . 0.0 110.923 174.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . 0.449 ' HD3' ' HB2' ' C' ' 36' ' ' LEU . 7.7 Cg_exo -45.22 -36.5 12.4 Favored 'Trans proline' 0 N--CA 1.452 -0.963 1 C-N-CA 130.296 7.331 . . . . 0.0 116.495 167.069 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.79 -44.84 22.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 116.552 -1.689 . . . . 0.0 110.019 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 36.2 mt -69.63 -28.88 66.29 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 126.21 2.194 . . . . 0.0 110.67 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -79.29 -14.8 58.78 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.918 2.487 . . . . 0.0 110.493 -177.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . 0.53 HD13 ' HA ' ' D' ' 88' ' ' SER . 58.4 tp -101.71 -42.74 6.08 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.034 3.334 . . . . 0.0 111.808 172.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 12.0 mmt -62.99 -22.65 66.99 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 175.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mp -125.3 155.51 40.09 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.936 2.094 . . . . 0.0 115.092 -175.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -90.54 167.4 16.61 Favored Pre-proline 0 N--CA 1.45 -0.45 0 C-N-CA 129.136 2.975 . . . . 0.0 115.555 163.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -56.65 -38.36 95.75 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 N-CA-C 115.689 1.38 . . . . 0.0 115.689 177.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -68.76 -37.11 79.12 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 128.553 2.741 . . . . 0.0 108.442 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -71.66 -26.11 62.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 116.193 -1.86 . . . . 0.0 112.104 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . 0.256 34.0 mtm-85 -64.99 -47.48 77.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.688 2.395 . . . . 0.0 115.96 168.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.27 -49.3 77.62 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.587 1.955 . . . . 0.0 108.406 176.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -45.94 -52.91 10.82 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 126.225 2.203 . . . . 0.0 112.491 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 92.0 mt -66.89 -45.58 77.6 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 126.346 1.858 . . . . 0.0 113.03 -177.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.17 -29.03 67.62 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 121.433 1.924 . . . . 0.0 109.269 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 94.0 m -82.47 -41.42 19.81 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 121.175 -1.191 . . . . 0.0 110.249 -174.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.35 55.2 mtt180 -44.95 -38.27 4.58 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 116.045 1.869 . . . . 0.0 116.045 165.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 54.7 t -67.72 -38.3 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-O 114.093 -2.86 . . . . 0.0 109.547 174.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -70.79 -36.22 72.92 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 124.658 3.39 . . . . 0.0 113.799 170.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 70.5 mt -69.48 -27.7 35.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 122.336 2.335 . . . . 0.0 113.476 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 79.6 t -71.79 -29.49 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 117.056 2.243 . . . . 0.0 117.056 167.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -70.75 -43.36 68.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.766 2.826 . . . . 0.0 113.023 171.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -71.65 -42.42 67.57 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 119.548 1.067 . . . . 0.0 112.127 -176.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.8 -33.29 73.61 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 117.351 -1.309 . . . . 0.0 113.507 174.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . 0.392 72.0 mt -56.59 -51.7 67.64 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 121.775 2.08 . . . . 0.0 110.115 164.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -59.13 -45.2 91.56 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.36 56.65 10.41 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 106.75 -2.54 . . . . 0.0 106.75 174.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -125.45 57.96 1.31 Allowed 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 129.631 3.172 . . . . 0.0 103.719 168.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 34.0 mtt -136.69 142.61 43.15 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 127.618 2.367 . . . . 0.0 110.983 176.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 94.5 p -77.2 159.71 29.48 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 128.749 2.82 . . . . 0.0 115.711 163.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -58.73 -24.13 61.04 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.136 3.375 . . . . 0.0 111.325 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 31.3 ttp-105 -77.07 -35.0 56.96 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 167.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -75.23 -36.83 61.3 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 121.673 -0.642 . . . . 0.0 111.036 174.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.54 -14.46 42.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.081 -2.262 . . . . 0.0 113.947 171.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.7 tttt -94.4 -44.42 7.92 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 118.036 -2.915 . . . . 0.0 114.817 165.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -97.44 -23.28 16.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 126.893 2.077 . . . . 0.0 115.54 -163.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -94.35 -36.43 11.94 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 119.346 -2.096 . . . . 0.0 114.224 170.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 9.4 mp -88.25 -29.61 20.3 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.228 -1.844 . . . . 0.0 108.579 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 75.87 -154.25 44.85 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 122.038 2.199 . . . . 0.0 110.968 -176.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.71 -15.96 60.22 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 126.564 3.078 . . . . 0.0 111.959 174.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.79 -12.39 82.95 Favored Glycine 0 N--CA 1.446 -0.68 0 O-C-N 117.121 -3.487 . . . . 0.0 113.742 -166.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 13.9 tt -54.95 -40.07 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-O 115.471 -2.204 . . . . 0.0 110.989 170.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.24 -42.72 63.84 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 123.601 2.909 . . . . 0.0 112.652 174.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 3.4 m -50.47 -33.71 22.21 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 127.329 2.251 . . . . 0.0 115.726 176.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 32.1 mm -105.17 -10.68 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 126.539 1.936 . . . . 0.0 112.154 -171.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . 0.367 20.8 p -125.4 -15.97 6.01 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 119.344 3.091 . . . . 0.0 119.344 -167.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 38.9 mtp85 -110.83 164.94 12.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 O-C-N 119.799 -1.813 . . . . 0.0 112.468 162.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.88 160.48 17.85 Favored Glycine 0 C--N 1.339 0.72 0 C-N-CA 129.792 3.568 . . . . 0.0 111.44 -171.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 2.1 m -65.73 -7.31 14.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 116.858 2.17 . . . . 0.0 116.858 -173.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -105.47 7.24 32.99 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 -179.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 45.6 p -75.63 168.75 19.44 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 111.707 -3.996 . . . . 0.0 112.39 -170.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . 0.3 54.9 tp -65.93 -28.21 68.76 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 122.366 2.348 . . . . 0.0 113.454 -145.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 81.4 mttt -104.22 -14.54 15.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.998 1.272 . . . . 0.0 114.047 178.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.73 -38.12 88.29 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 117.21 -3.431 . . . . 0.0 115.066 155.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' C' ' 93' ' ' PRO . . . -47.33 153.46 0.95 Allowed Pre-proline 0 N--CA 1.449 -0.516 0 C-N-CA 128.868 2.867 . . . . 0.0 113.052 174.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' C' ' 92' ' ' ALA . 1.0 OUTLIER -65.7 149.98 86.63 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-O 124.838 1.933 . . . . 0.0 114.521 -172.547 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . 0.46 ' HA ' ' HB2' ' C' ' 97' ' ' ARG . 7.4 t -79.21 -24.07 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 114.559 -2.639 . . . . 0.0 106.913 -167.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 21.8 pm0 -75.24 -16.41 60.46 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 122.043 2.201 . . . . 0.0 113.488 171.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -86.41 -37.97 17.83 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 167.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . 0.46 ' HB2' ' HA ' ' C' ' 94' ' ' VAL . 66.6 mtp180 -68.12 -31.28 70.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 120.443 -1.411 . . . . 0.0 112.896 -170.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -84.72 -50.59 7.49 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.181 2.192 . . . . 0.0 110.118 -178.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 49.5 t90 -53.97 -40.4 66.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 172.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.42 -40.18 93.48 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 118.764 -2.46 . . . . 0.0 112.701 178.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -70.73 -33.85 71.27 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 120.519 1.509 . . . . 0.0 111.79 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -61.71 -27.25 68.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 116.516 2.043 . . . . 0.0 116.516 168.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 60.3 t -91.77 -53.28 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.756 -178.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 52.0 mt -91.99 -39.57 11.59 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 117.976 -1.489 . . . . 0.0 113.057 -166.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 11.0 mt -108.45 50.26 0.78 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 -173.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 21.1 pttp . . . . . 0 N--CA 1.446 -0.661 0 O-C-N 119.333 -2.104 . . . . 0.0 113.808 -173.018 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 96.2 p . . . . . 0 N--CA 1.449 -0.498 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -67.98 -32.86 27.56 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 N-CA-C 121.102 3.462 . . . . 0.0 121.102 -173.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -160.74 132.69 5.92 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 109.383 -3.553 . . . . 0.0 103.923 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.5 t -54.17 132.6 43.48 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 118.269 -2.769 . . . . 0.0 115.812 178.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.09 -34.62 73.73 Favored 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 117.58 -3.2 . . . . 0.0 114.737 176.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.98 -23.57 55.31 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 124.044 1.878 . . . . 0.0 111.173 -177.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -77.92 -35.7 50.25 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 117.128 -3.482 . . . . 0.0 111.095 173.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -41.6 98.29 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 121.986 0.898 . . . . 0.0 112.52 169.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -60.91 -52.18 66.14 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 113.71 -1.586 . . . . 0.0 108.644 169.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -55.1 -35.78 64.98 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 176.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.56 0.3 34.46 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 117.391 2.367 . . . . 0.0 117.391 172.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -101.69 -19.35 15.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 116.879 -1.928 . . . . 0.0 110.513 158.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 78.7 mm-40 -82.18 -31.4 30.43 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -66.55 -27.11 67.48 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 119.168 -2.208 . . . . 0.0 112.273 165.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -73.8 -44.5 55.67 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.045 0.841 . . . . 0.0 112.406 173.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 73.3 mt -59.85 -16.75 31.27 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 118.342 2.719 . . . . 0.0 118.342 165.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -75.17 -40.91 59.1 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 125.404 2.526 . . . . 0.0 109.17 169.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -65.51 -47.0 77.48 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.014 -3.554 . . . . 0.0 110.907 171.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 58.6 t -55.52 -53.36 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-O 116.479 -1.724 . . . . 0.0 110.236 178.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -55.43 -36.58 66.66 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 118.597 2.814 . . . . 0.0 118.597 175.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 31.3 tp -76.72 -44.78 31.93 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 113.594 -1.639 . . . . 0.0 114.132 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.01 -41.04 99.47 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 113.369 -3.205 . . . . 0.0 111.103 170.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 ttpp -53.83 -57.22 11.69 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.319 2.327 . . . . 0.0 113.42 165.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -42.81 -48.88 5.78 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 116.468 -1.729 . . . . 0.0 113.186 164.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.359 . . -58.26 -38.37 76.8 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 120.454 1.479 . . . . 0.0 114.74 175.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -59.54 -31.4 69.37 Favored 'General case' 0 N--CA 1.454 -0.268 1 O-C-N 115.045 -4.784 . . . . 0.0 111.439 174.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -86.53 -23.35 25.9 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.919 2.088 . . . . 0.0 111.672 -167.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 50.4 p30 -122.95 5.08 9.35 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.985 1.314 . . . . 0.0 108.991 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.385 11.9 m-20 74.88 25.74 1.4 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 114.529 -2.653 . . . . 0.0 117.593 176.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . 0.269 66.0 mt -96.78 5.74 50.03 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 126.456 2.348 . . . . 0.0 112.432 -172.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -80.49 -48.84 12.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.852 3.261 . . . . 0.0 111.72 -155.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 1.2 mt -50.77 -46.88 86.69 Favored Pre-proline 0 N--CA 1.451 -0.418 0 O-C-N 119.707 -1.87 . . . . 0.0 112.894 174.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.256 17.1 Cg_exo -70.23 -18.19 34.94 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 N-CA-C 117.731 2.166 . . . . 0.0 117.731 176.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 32.0 tp -77.32 -37.09 53.28 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.313 3.045 . . . . 0.0 108.886 167.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.13 -38.88 60.88 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 115.372 -2.252 . . . . 0.0 108.789 -179.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -75.43 -22.2 57.54 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 128.523 3.64 . . . . 0.0 112.312 174.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 18.6 tp -70.72 -42.98 69.87 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 115.898 -2.001 . . . . 0.0 111.338 171.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 19.8 mmt -84.74 -36.34 21.85 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 129.148 2.979 . . . . 0.0 114.846 -171.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mt -122.35 126.98 49.19 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 125.049 2.357 . . . . 0.0 109.208 -171.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 68.2 p -78.32 166.62 41.76 Favored Pre-proline 0 N--CA 1.448 -0.534 0 CA-C-N 111.2 -2.727 . . . . 0.0 113.352 -176.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_exo -59.07 -43.84 39.32 Favored 'Trans proline' 0 N--CA 1.447 -1.21 0 CA-C-N 121.575 1.598 . . . . 0.0 114.912 -162.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.274 48.7 m-20 -75.37 -17.28 60.26 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 117.558 -3.214 . . . . 0.0 109.238 -177.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -74.25 -37.52 63.74 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 124.912 2.292 . . . . 0.0 108.602 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . 0.661 ' HD2' ' CZ2' ' C' ' 19' ' ' TRP . 17.1 mtm180 -76.72 -31.07 56.91 Favored 'General case' 0 N--CA 1.45 -0.459 1 C-N-CA 132.386 4.275 . . . . 0.0 108.599 174.155 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -66.85 -38.34 86.18 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 122.566 2.439 . . . . 0.0 109.549 168.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.277 . . -79.71 -36.89 36.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 114.718 -2.563 . . . . 0.0 116.635 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 18.2 mt -61.16 -49.07 78.72 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 125.182 1.551 . . . . 0.0 114.418 164.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.37 -44.43 58.43 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 82.7 m -73.76 -23.33 59.72 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 127.212 2.205 . . . . 0.0 113.118 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -62.26 -20.69 64.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 117.428 -3.295 . . . . 0.0 115.288 166.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 43.7 t -66.59 -57.51 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 119.946 1.248 . . . . 0.0 108.216 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -69.31 -17.39 63.72 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.247 1.819 . . . . 0.0 112.837 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 31.8 mt -74.4 -44.2 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 O-C-N 118.055 -2.903 . . . . 0.0 110.803 173.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.45 -39.39 80.66 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 C-N-CA 128.274 2.63 . . . . 0.0 111.718 174.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -58.13 -49.44 76.97 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 117.931 -2.981 . . . . 0.0 109.731 176.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -70.42 -22.27 62.74 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 116.223 1.935 . . . . 0.0 116.223 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 46.1 mt -72.82 -28.51 62.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 121.44 1.927 . . . . 0.0 112.691 164.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . 0.415 HD22 ' HB2' ' D' ' 101' ' ' GLU . 78.9 mt -76.53 -36.89 57.43 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 120.835 1.652 . . . . 0.0 110.239 169.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -76.94 -33.88 57.67 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.437 0.695 . . . . 0.0 111.498 -173.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 45.31 52.46 8.58 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 121.909 3.523 . . . . 0.0 121.909 176.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -127.48 -12.69 5.55 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 119.232 -2.334 . . . . 0.0 109.701 173.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 16.4 mmt -87.85 59.36 5.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.093 1.357 . . . . 0.0 109.977 164.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 1.5 p -66.23 144.72 56.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 119.94 3.311 . . . . 0.0 119.94 -171.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 49.03 -101.41 0.08 Allowed 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 128.768 2.827 . . . . 0.0 109.355 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -58.42 -37.38 75.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 115.038 -2.411 . . . . 0.0 114.785 -174.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -70.79 -38.73 73.38 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.279 1.99 . . . . 0.0 111.708 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.75 -35.6 81.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 117.992 -2.943 . . . . 0.0 112.13 169.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -76.68 -25.13 53.34 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 121.119 1.781 . . . . 0.0 115.691 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -119.85 -30.78 4.66 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 113.103 -3.332 . . . . 0.0 111.95 -171.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . 0.258 17.5 tp10 -94.99 -45.54 7.21 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 123.453 2.842 . . . . 0.0 110.899 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . 0.462 HD13 ' HA ' ' D' ' 75' ' ' LEU . 4.3 mm? -73.87 -50.51 19.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 102.676 -3.083 . . . . 0.0 102.676 170.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 94.33 -141.28 15.47 Favored Glycine 0 N--CA 1.448 -0.506 1 CA-C-O 129.212 4.784 . . . . 0.0 118.298 153.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.61 -33.38 73.81 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.694 -2.651 . . . . 0.0 113.616 -167.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.18 -25.56 25.77 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 126.175 1.845 . . . . 0.0 116.166 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 5.2 tt -65.39 -15.29 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 119.732 1.766 . . . . 0.0 115.597 -173.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.23 -44.16 65.91 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.902 -1.047 . . . . 0.0 113.571 173.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 26.4 m -61.64 -39.63 91.99 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 170.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 45.6 mm -77.2 -34.98 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 O-C-N 120.864 -1.148 . . . . 0.0 111.131 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 70.0 p -104.01 -9.8 18.56 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 113.308 -3.234 . . . . 0.0 112.761 -174.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -96.16 -175.7 3.45 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 104.354 -2.461 . . . . 0.0 104.354 173.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 66.37 161.62 1.08 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 126.518 2.008 . . . . 0.0 112.445 -173.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 57.1 p -77.49 -22.5 51.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 116.142 1.905 . . . . 0.0 116.142 -148.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 72.0 m-80 -121.67 62.71 0.92 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 131.335 3.854 . . . . 0.0 111.093 175.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . 0.53 ' HA ' HD13 ' C' ' 41' ' ' LEU . 84.0 p -85.41 175.92 8.58 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 125.821 2.724 . . . . 0.0 115.324 171.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.39 -11.56 60.28 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 118.933 -2.354 . . . . 0.0 110.977 161.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -71.22 -18.18 62.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 162.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -118.21 -23.38 7.34 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 116.947 2.202 . . . . 0.0 116.947 -165.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 42.62 85.85 0.15 Allowed Pre-proline 0 N--CA 1.449 -0.488 0 CA-C-O 124.298 1.999 . . . . 0.0 111.707 169.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo 20.11 45.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.123 0 O-C-N 116.84 -2.242 . . . . 0.0 114.45 51.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -58.95 -23.79 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 C-N-CA 127.363 2.265 . . . . 0.0 106.747 -175.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.53 -27.76 11.2 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 117.31 -1.329 . . . . 0.0 109.207 -160.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 34.5 tp -60.92 -54.24 47.51 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 128.486 2.715 . . . . 0.0 107.003 152.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 43.7 ttp180 -55.34 -52.81 62.29 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 124.739 3.427 . . . . 0.0 112.857 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -56.39 -24.78 46.84 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 124.2 3.182 . . . . 0.0 115.868 172.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . 0.429 ' CZ2' HG21 ' D' ' 103' ' ' VAL . 84.6 t90 -85.11 -40.93 16.2 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 123.238 1.494 . . . . 0.0 112.475 176.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.06 -35.25 79.61 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 118.331 -2.73 . . . . 0.0 108.967 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . 0.415 ' HB2' HD22 ' D' ' 62' ' ' LEU . 18.1 tt0 -68.08 -4.84 14.85 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 112.635 -2.075 . . . . 0.0 114.051 176.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -119.21 -33.63 4.08 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 119.331 -0.948 . . . . 0.0 108.599 177.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . 0.429 HG21 ' CZ2' ' D' ' 99' ' ' TRP . 25.4 t -77.34 -36.21 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 116.169 1.915 . . . . 0.0 116.169 171.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 24.6 mt -80.24 -39.38 29.13 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 127.923 2.489 . . . . 0.0 112.659 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 15.1 mt -110.84 37.41 2.8 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 126.62 3.105 . . . . 0.0 111.622 -174.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -58.08 165.71 1.81 Allowed 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.526 -2.609 . . . . 0.0 112.113 176.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 59.6 m -44.79 -36.48 3.25 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 129.258 3.023 . . . . 0.0 114.692 173.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 . . . . . 0 C--O 1.253 1.242 0 C-N-CA 129.175 2.99 . . . . 0.0 115.48 -178.612 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.39 -41.72 88.92 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 125.735 2.683 . . . . 0.0 114.014 171.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -71.5 -32.62 68.43 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 127.22 2.208 . . . . 0.0 112.105 171.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -60.33 -46.89 88.29 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.498 -2.001 . . . . 0.0 113.145 165.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.7 mmt-85 -70.32 -31.6 68.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 115.762 -2.066 . . . . 0.0 112.581 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.8 t60 -58.06 -50.88 71.91 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.038 -1.934 . . . . 0.0 111.796 165.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -53.53 -41.08 66.01 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.164 1.785 . . . . 0.0 113.421 174.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.254 34.7 tt0 -60.19 -49.86 75.95 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.187 1.795 . . . . 0.0 110.013 170.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -57.77 -61.07 2.78 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.394 -2.691 . . . . 0.0 117.014 172.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.8 mt -55.88 -29.17 59.56 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -175.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -47.89 -43.48 28.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 128.547 2.739 . . . . 0.0 111.023 168.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -67.15 -43.23 82.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 119.72 -1.862 . . . . 0.0 110.198 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.7 t -66.23 -36.81 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-O 113.722 -3.037 . . . . 0.0 111.171 175.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -61.99 -58.33 8.29 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.168 1.804 . . . . 0.0 109.67 168.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 36.8 tp -47.12 -54.62 10.08 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.171 -1.581 . . . . 0.0 113.17 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 36.3 tp -62.35 -39.95 94.8 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 124.137 3.153 . . . . 0.0 113.271 176.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -54.87 -35.77 64.4 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 127.003 3.287 . . . . 0.0 111.406 170.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -90.48 -6.28 55.01 Favored 'General case' 0 N--CA 1.452 -0.341 1 O-C-N 116.208 -4.057 . . . . 0.0 112.244 -177.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.0 -31.67 17.99 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 119.376 0.989 . . . . 0.0 111.961 163.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -50.95 -37.1 42.34 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.238 -2.163 . . . . 0.0 111.63 165.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -81.64 -10.46 59.41 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 121.91 2.141 . . . . 0.0 116.309 -174.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -109.76 -1.44 17.95 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.678 1.191 . . . . 0.0 113.771 172.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.442 12.4 m-20 63.94 34.52 11.51 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.822 2.049 . . . . 0.0 114.574 -175.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.6 mt -107.14 13.72 27.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.748 2.819 . . . . 0.0 113.978 174.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.3 p-80 -63.24 -60.04 3.93 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 116.091 1.886 . . . . 0.0 116.091 172.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.27 14.3 mt -59.92 -43.18 94.01 Favored Pre-proline 0 N--CA 1.449 -0.494 0 O-C-N 125.056 1.472 . . . . 0.0 112.734 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -45.46 -57.63 2.04 Favored 'Trans proline' 0 N--CA 1.448 -1.164 0 C-N-CA 123.216 2.611 . . . . 0.0 117.48 160.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.52 -40.38 92.9 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 117.605 -3.184 . . . . 0.0 117.375 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.3 mt -53.79 -35.18 61.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 115.793 -2.051 . . . . 0.0 110.434 169.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 -81.2 -10.45 59.62 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 120.789 1.631 . . . . 0.0 112.475 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.5 tt -92.68 -32.75 14.62 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 116.976 -3.578 . . . . 0.0 114.839 169.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 94.8 mmm -92.01 -17.59 24.86 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 120.065 3.358 . . . . 0.0 120.065 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.5 mt -120.6 129.83 53.92 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 169.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.9 p -70.34 154.11 94.71 Favored Pre-proline 0 N--CA 1.449 -0.481 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -49.01 -51.37 10.69 Favored 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 124.739 3.626 . . . . 0.0 119.089 -172.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.42 -9.59 58.74 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 116.863 -3.648 . . . . 0.0 115.269 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -81.92 -43.03 18.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 117.616 -3.177 . . . . 0.0 110.889 168.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 78.6 mtm-85 -54.28 -41.83 69.33 Favored 'General case' 0 N--CA 1.445 -0.693 1 O-C-N 114.666 -5.021 . . . . 0.0 112.226 171.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -65.83 -50.02 66.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 110.672 -2.967 . . . . 0.0 110.829 174.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.95 -33.6 62.49 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.953 2.101 . . . . 0.0 113.187 174.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.5 mt -88.75 -21.74 23.67 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 114.674 -2.584 . . . . 0.0 108.785 -175.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.93 -46.85 92.72 Favored Glycine 0 C--N 1.337 0.626 0 CA-C-N 121.391 1.905 . . . . 0.0 111.098 162.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.6 m -61.76 -28.67 69.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.132 -2.393 . . . . 0.0 110.462 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -60.68 -33.4 72.78 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 115.551 -2.166 . . . . 0.0 113.485 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.2 t -65.63 -40.33 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 121.592 1.996 . . . . 0.0 112.809 169.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -66.2 -23.17 66.39 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 122.641 2.473 . . . . 0.0 116.961 170.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.279 72.7 mt -64.67 -52.84 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 125.188 2.423 . . . . 0.0 109.101 168.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.4 t -68.55 -29.33 43.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-N 113.208 -1.815 . . . . 0.0 111.879 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -63.59 -44.98 92.45 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 118.604 -2.56 . . . . 0.0 112.816 174.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -83.9 -10.97 57.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -178.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 21.5 mt -78.74 -41.23 31.3 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 120.542 -1.349 . . . . 0.0 109.878 166.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.2 -43.44 17.66 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 115.475 -2.203 . . . . 0.0 107.476 -166.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -62.59 -36.97 84.41 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.317 2.261 . . . . 0.0 112.258 166.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.84 14.29 81.67 Favored Glycine 0 C--N 1.336 0.568 0 CA-C-N 122.392 2.36 . . . . 0.0 116.082 162.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -81.58 -28.58 33.75 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 129.255 3.022 . . . . 0.0 112.955 173.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.8 mtt -100.69 141.39 33.64 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 123.9 1.809 . . . . 0.0 108.399 -174.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 93.2 p -93.95 165.17 12.79 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.778 165.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -56.35 -35.48 67.71 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 125.72 2.676 . . . . 0.0 116.094 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.1 tpt85 -73.59 -21.23 60.39 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.808 -2.433 . . . . 0.0 110.532 -177.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -79.22 -42.53 25.79 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 113.911 -2.947 . . . . 0.0 110.55 166.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 57.4 mt -70.77 -18.36 62.76 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 115.612 -2.435 . . . . 0.0 114.752 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -57.25 -34.75 68.93 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.736 2.014 . . . . 0.0 111.804 169.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -90.83 -59.57 2.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.186 1.794 . . . . 0.0 107.914 167.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -62.32 -26.71 68.57 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 128.552 2.741 . . . . 0.0 117.829 -166.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.5 mt -122.82 11.35 9.68 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.393 1.877 . . . . 0.0 114.383 165.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 57.52 20.53 38.46 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 120.309 1.413 . . . . 0.0 114.26 -171.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -79.99 139.03 37.17 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.128 1.771 . . . . 0.0 114.051 -161.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.42 103.57 1.53 Allowed Glycine 0 CA--C 1.523 0.56 0 C-N-CA 127.908 2.671 . . . . 0.0 109.571 172.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 67.6 mt -37.61 -48.83 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 128.877 2.871 . . . . 0.0 112.347 -179.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.32 -34.45 74.66 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 129.731 3.212 . . . . 0.0 110.972 -172.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.3 p -65.31 -45.81 82.85 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 119.24 -2.162 . . . . 0.0 111.788 167.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.0 mm -63.64 -32.06 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 O-C-N 117.604 -3.185 . . . . 0.0 110.952 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -49.97 -52.52 33.03 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 118.645 -2.534 . . . . 0.0 115.137 165.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -59.55 -42.29 92.05 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 125.32 1.638 . . . . 0.0 110.729 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.86 -40.67 99.15 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 113.06 -1.882 . . . . 0.0 113.65 -177.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.9 m -61.74 -34.9 76.65 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 113.529 -3.129 . . . . 0.0 110.877 171.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -75.8 -30.17 58.97 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 120.771 1.623 . . . . 0.0 114.561 177.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 17.8 m -68.39 -34.97 76.99 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 115.902 -1.999 . . . . 0.0 109.967 171.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.9 tp -77.58 -45.61 24.72 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 117.255 -1.355 . . . . 0.0 111.41 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -53.76 -45.64 70.69 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 130.264 3.425 . . . . 0.0 108.262 169.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.25 -34.94 75.97 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.073 1.749 . . . . 0.0 115.302 176.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.05 171.87 4.19 Favored Pre-proline 0 N--CA 1.447 -0.614 0 O-C-N 119.496 -2.003 . . . . 0.0 113.321 -168.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . 0.317 28.5 Cg_exo -67.79 131.74 24.95 Favored 'Trans proline' 0 N--CA 1.447 -1.258 1 C-N-CA 126.847 5.032 . . . . 0.0 116.615 178.514 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 m -45.08 -39.93 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 N-CA-C 117.838 2.533 . . . . 0.0 117.838 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.1 pm0 -75.93 -31.84 59.31 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 118.26 -2.775 . . . . 0.0 110.796 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.495 HD12 HD13 ' B' ' 34' ' ' LEU . 15.7 tp -64.87 -41.95 95.24 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 112.696 -3.526 . . . . 0.0 111.394 164.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 89.1 mtm-85 -64.53 -43.47 93.91 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 126.167 2.167 . . . . 0.0 111.572 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -56.32 -20.86 20.87 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.376 2.27 . . . . 0.0 113.752 170.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -94.78 -46.26 6.98 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 127.562 3.553 . . . . 0.0 110.378 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 29.2 mt -56.32 -26.69 53.2 Favored 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 115.373 -4.579 . . . . 0.0 111.263 171.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -70.65 -24.85 62.78 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 118.11 -2.869 . . . . 0.0 117.433 170.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -101.41 -4.17 27.4 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.29 1.836 . . . . 0.0 111.968 176.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . 0.301 59.6 t -122.67 -36.66 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -170.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.2 mt -82.36 -54.83 4.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 117.866 -3.021 . . . . 0.0 115.135 165.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.7 mt -70.08 -3.89 18.63 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.747 2.019 . . . . 0.0 112.832 -167.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.264 28.9 tttt . . . . . 0 N--CA 1.448 -0.568 0 C-N-CA 129.597 3.159 . . . . 0.0 113.694 -166.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.496 0 CA-C-O 122.387 1.089 . . . . 0.0 111.236 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 36.9 mtt -69.73 -34.77 74.31 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 114.152 -2.832 . . . . 0.0 110.402 176.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.68 -40.68 93.05 Favored 'General case' 0 N--CA 1.449 -0.509 1 O-C-N 130.196 4.685 . . . . 0.0 111.766 177.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 32.1 tp10 -65.46 -29.56 70.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 126.474 3.035 . . . . 0.0 116.86 171.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -68.36 -37.99 81.0 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 125.326 2.489 . . . . 0.0 116.761 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 51.9 mmt-85 -81.34 -20.0 41.61 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 115.036 -2.411 . . . . 0.0 111.078 176.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -61.53 -57.24 12.91 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 122.502 2.41 . . . . 0.0 108.064 162.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.35 -31.68 72.98 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 123.107 2.685 . . . . 0.0 116.767 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.69 -39.25 83.93 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 117.648 2.462 . . . . 0.0 117.648 165.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 11.8 t-105 -74.69 -46.91 34.64 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.708 2.003 . . . . 0.0 107.385 175.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 83.7 mt -58.93 -17.94 29.04 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 118.105 -2.872 . . . . 0.0 114.996 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . 0.381 49.4 ttt180 -67.55 -45.04 76.79 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.172 1.789 . . . . 0.0 113.527 168.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -60.03 -39.66 86.67 Favored 'General case' 0 N--CA 1.451 -0.4 1 O-C-N 115.997 -4.189 . . . . 0.0 119.492 165.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.01 -34.14 67.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-O 122.656 1.217 . . . . 0.0 110.738 176.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -61.88 -47.91 82.86 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 116.719 -3.738 . . . . 0.0 110.771 173.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 51.6 tp -62.79 -41.58 99.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.974 1.845 . . . . 0.0 109.061 -173.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.327 14.1 tp -76.46 -28.49 56.54 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 124.003 1.859 . . . . 0.0 115.917 -178.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -62.98 -37.52 87.46 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 119.04 -2.287 . . . . 0.0 111.987 164.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -79.41 -23.29 43.33 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 119.622 -1.924 . . . . 0.0 110.727 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.49 -32.34 32.5 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -69.61 -35.79 75.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 124.107 3.14 . . . . 0.0 113.921 167.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.33 -8.97 4.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 120.469 3.507 . . . . 0.0 120.469 159.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . 0.266 65.2 m-80 -128.74 9.79 5.95 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 116.389 -3.945 . . . . 0.0 110.002 -175.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.489 5.2 m-20 55.65 9.7 0.44 Allowed 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 121.137 3.754 . . . . 0.0 121.137 -168.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.495 HD13 HD12 ' A' ' 96' ' ' LEU . 25.3 mt -82.04 10.0 7.41 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 113.654 -1.612 . . . . 0.0 115.078 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . 0.266 18.5 p-80 -61.3 -49.92 75.07 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 119.801 -1.812 . . . . 0.0 112.783 -170.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.337 54.8 mt -63.07 -55.29 38.57 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-O 115.724 -2.084 . . . . 0.0 113.679 176.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -42.23 -36.24 4.01 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 N-CA-C 118.918 2.622 . . . . 0.0 118.918 168.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 58.6 tp -87.23 -28.35 22.42 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.141 0.428 . . . . 0.0 111.291 -176.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 19.8 mt -79.9 -34.07 39.37 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 120.833 -1.167 . . . . 0.0 113.362 172.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . 0.44 ' HA ' ' NH1' ' B' ' 48' ' ' ARG . 86.8 m-20 -60.8 -42.97 98.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 113.309 -3.234 . . . . 0.0 108.032 167.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -61.89 -55.59 28.07 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 126.245 2.216 . . . . 0.0 112.14 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.0 mmt -82.85 -31.5 27.98 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 126.398 2.311 . . . . 0.0 114.759 -165.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 33.4 mt -108.3 127.13 53.59 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 104.715 -2.328 . . . . 0.0 104.715 -179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 24.3 p -69.59 157.4 89.64 Favored Pre-proline 0 N--CA 1.448 -0.538 0 C-N-CA 125.393 1.477 . . . . 0.0 113.741 172.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.67 -29.79 63.08 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 123.68 2.92 . . . . 0.0 115.721 -176.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.05 -21.04 43.91 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 125.244 1.59 . . . . 0.0 114.429 178.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -84.15 -28.11 27.65 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 169.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . 0.44 ' NH1' ' HA ' ' B' ' 40' ' ' ASN . 25.1 mtm180 -70.86 -46.77 62.09 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 117.703 -3.123 . . . . 0.0 107.076 171.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -58.72 -37.61 76.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.102 1.501 . . . . 0.0 114.007 170.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.88 -45.32 95.03 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 119.666 -1.896 . . . . 0.0 114.31 169.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 12.0 mt -68.51 -43.42 76.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 117.33 -1.748 . . . . 0.0 112.426 -174.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.11 -30.27 60.54 Favored Glycine 0 CA--C 1.525 0.715 0 O-C-N 125.427 1.704 . . . . 0.0 115.485 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.6 m -73.85 -44.41 55.66 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 174.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 38.2 mtt180 -60.56 -27.9 68.04 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.064 -3.523 . . . . 0.0 110.74 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 90.9 t -41.76 -62.75 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 123.245 2.748 . . . . 0.0 114.5 162.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 -71.13 -29.09 64.81 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -166.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 19.1 mt -71.45 -44.51 71.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 C-N-CA 126.795 2.038 . . . . 0.0 112.572 177.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 93.7 t -66.76 -41.8 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 124.332 2.015 . . . . 0.0 111.232 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -52.67 -49.19 65.75 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 115.343 1.608 . . . . 0.0 115.343 168.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . 0.254 22.8 tp10 -68.35 -30.45 69.42 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 113.169 -3.3 . . . . 0.0 109.798 174.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 8.5 mt -66.58 -25.11 66.47 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 123.353 2.797 . . . . 0.0 111.568 172.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 48.4 mt -86.61 -28.68 23.11 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 124.52 1.138 . . . . 0.0 109.614 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 28.5 ttm105 -83.02 -44.86 14.74 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 118.855 2.909 . . . . 0.0 118.855 -171.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.79 64.19 3.72 Favored Glycine 0 CA--C 1.522 0.47 0 O-C-N 119.256 -2.152 . . . . 0.0 114.638 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -128.39 -36.13 1.92 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 127.298 2.239 . . . . 0.0 109.077 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 60.0 mtp -81.16 134.31 35.61 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 118.526 -2.609 . . . . 0.0 116.117 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 88.5 p -84.29 174.41 10.17 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 125.322 1.639 . . . . 0.0 113.255 168.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -64.47 -36.47 84.3 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.293 -2.129 . . . . 0.0 113.657 -169.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -72.25 -35.88 68.91 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 120.029 -1.669 . . . . 0.0 112.923 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.72 -40.75 79.79 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 113.457 -1.701 . . . . 0.0 109.051 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 87.5 mt -58.93 -61.45 2.63 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.181 2.192 . . . . 0.0 112.21 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -53.58 -50.55 65.35 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 128.342 2.657 . . . . 0.0 112.974 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -104.14 -7.44 20.18 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 128.129 3.393 . . . . 0.0 109.764 -165.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -118.47 -7.04 10.7 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 125.201 3.637 . . . . 0.0 111.466 173.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 36.4 mt -122.09 -17.24 7.28 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 113.985 -2.912 . . . . 0.0 115.316 168.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.56 16.85 78.68 Favored Glycine 0 C--N 1.336 0.533 0 CA-C-N 125.08 3.582 . . . . 0.0 119.376 -168.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -105.23 71.03 0.92 Allowed 'General case' 0 N--CA 1.447 -0.58 1 C-N-CA 132.278 4.231 . . . . 0.0 106.571 -160.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.92 179.58 44.54 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 119.805 -1.188 . . . . 0.0 115.749 172.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 51.2 mm -44.85 -51.27 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-O 115.788 -2.054 . . . . 0.0 114.089 -171.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.8 -32.02 73.39 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.272 2.323 . . . . 0.0 117.272 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 2.9 m -66.59 -43.07 85.88 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 31.4 mm -70.08 -42.25 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 130.228 3.411 . . . . 0.0 113.432 168.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 26.3 m -59.17 -51.04 71.71 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 118.284 -2.76 . . . . 0.0 109.52 172.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -63.11 -42.58 99.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 114.916 -2.469 . . . . 0.0 113.077 175.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.84 -45.16 90.05 Favored Glycine 0 CA--C 1.522 0.499 0 O-C-N 125.703 1.877 . . . . 0.0 115.779 -176.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 88.2 p -62.88 -39.85 95.72 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 164.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -68.07 -37.46 81.28 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 117.074 -3.516 . . . . 0.0 112.469 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 48.1 m -74.41 -0.75 18.34 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 171.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mt -95.77 -43.52 7.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 128.271 2.628 . . . . 0.0 116.548 167.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 54.8 tttm -68.84 -31.76 70.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 123.003 0.521 . . . . 0.0 110.698 169.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.74 -14.72 60.33 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 129.554 3.141 . . . . 0.0 117.227 166.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.38 148.36 98.71 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-N 121.599 2.0 . . . . 0.0 108.9 165.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -72.71 151.53 52.04 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 122.598 2.198 . . . . 0.0 115.308 169.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.323 31.4 m -62.71 -34.84 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 O-C-N 118.892 -2.38 . . . . 0.0 117.362 -166.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -50.62 -34.51 26.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 128.204 2.602 . . . . 0.0 111.63 172.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 7.0 tp -97.23 -38.61 9.62 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 115.952 -1.975 . . . . 0.0 108.333 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 26.0 mtp85 -47.87 -51.91 21.25 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 121.748 2.067 . . . . 0.0 111.552 171.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -62.86 -28.64 70.17 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 117.365 2.357 . . . . 0.0 117.365 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -71.26 -60.4 2.25 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.35 1.86 . . . . 0.0 110.702 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 96.4 mt -54.49 -43.79 72.09 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -66.48 -13.94 61.55 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -104.19 -8.51 19.34 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 126.478 1.911 . . . . 0.0 114.134 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 39.4 t -111.55 -43.55 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 123.38 1.562 . . . . 0.0 107.875 -177.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.96 -47.17 39.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 116.948 -3.595 . . . . 0.0 109.567 -178.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 84.0 mt -72.25 -24.25 61.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 117.75 -1.58 . . . . 0.0 112.701 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -90.25 -8.97 49.66 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 119.373 -2.08 . . . . 0.0 111.329 -178.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.3 m -71.89 -22.77 61.46 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 165.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.394 61.9 m-20 . . . . . 0 C--O 1.249 1.036 0 N-CA-C 117.117 2.266 . . . . 0.0 117.117 161.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ttt . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.61 170.36 15.93 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.454 -1.299 . . . . 0.0 113.832 172.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -130.81 149.72 52.32 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 113.485 -1.689 . . . . 0.0 108.542 177.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -121.48 153.49 37.86 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 124.155 3.161 . . . . 0.0 109.492 177.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 94.9 p -143.85 169.7 9.84 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 172.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -89.8 -27.24 0.34 Allowed 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 116.873 -1.618 . . . . 0.0 114.333 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -140.88 144.29 35.17 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 117.167 -1.397 . . . . 0.0 114.16 176.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.7 t -148.06 118.53 7.42 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 125.335 1.647 . . . . 0.0 113.243 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.71 -12.31 2.85 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 157.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.87 -40.76 95.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 123.485 2.857 . . . . 0.0 115.399 163.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 39.2 mtt -79.38 -36.98 38.4 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 124.067 1.889 . . . . 0.0 110.513 -172.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.06 -36.04 60.18 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 128.549 2.74 . . . . 0.0 112.158 175.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -79.58 -37.69 35.74 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 119.4 -2.063 . . . . 0.0 109.724 175.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -70.56 -43.79 68.77 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 120.36 1.437 . . . . 0.0 112.334 -178.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -30.69 71.59 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 119.269 -2.144 . . . . 0.0 114.09 174.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -72.78 -48.38 38.73 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 126.6 2.437 . . . . 0.0 110.964 171.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -61.47 -24.01 66.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 112.748 -3.501 . . . . 0.0 113.871 171.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -59.65 -39.01 82.98 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 123.794 2.997 . . . . 0.0 115.999 164.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -78.22 -41.3 34.8 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.067 -1.424 . . . . 0.0 110.58 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 4.8 mp -67.12 -17.69 64.98 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 119.927 -1.733 . . . . 0.0 110.715 174.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -82.98 -38.56 22.52 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 118.159 -2.838 . . . . 0.0 116.668 175.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' D' ' 51' ' ' LEU . 73.8 t80 -55.46 -38.79 69.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 113.383 -1.735 . . . . 0.0 110.405 165.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 5.6 t -70.6 -41.94 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 O-C-N 118.91 -2.369 . . . . 0.0 108.466 -177.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -72.71 -25.62 61.3 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 119.077 2.991 . . . . 0.0 119.077 176.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 49.1 tp -71.63 -40.49 69.71 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 52.7 tp -69.35 -40.28 77.61 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -44.0 -51.5 7.71 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 123.342 1.544 . . . . 0.0 114.187 178.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -79.67 -13.4 59.51 Favored 'General case' 0 N--CA 1.45 -0.425 0 O-C-N 119.311 -2.118 . . . . 0.0 113.269 -175.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.31 -28.49 61.19 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 120.977 1.717 . . . . 0.0 114.968 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -65.19 -22.97 66.97 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 117.867 -3.021 . . . . 0.0 109.598 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.79 -20.74 61.1 Favored 'General case' 0 N--CA 1.448 -0.564 1 O-C-N 113.869 -5.519 . . . . 0.0 110.947 -166.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -126.66 30.4 5.53 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 118.545 -2.597 . . . . 0.0 113.677 168.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 42.16 44.84 3.33 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 129.151 2.98 . . . . 0.0 115.262 -173.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.264 95.9 mt -93.55 -10.0 36.3 Favored 'General case' 0 N--CA 1.448 -0.549 1 C-N-CA 132.125 4.17 . . . . 0.0 109.71 172.801 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 29.4 p-80 -47.9 -41.81 25.39 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 130.947 3.699 . . . . 0.0 109.653 168.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mt -76.34 -52.35 2.37 Favored Pre-proline 0 N--CA 1.45 -0.452 1 O-C-N 115.612 -4.43 . . . . 0.0 117.074 174.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -49.43 -33.58 30.2 Favored 'Trans proline' 0 N--CA 1.448 -1.174 0 C-N-CA 123.751 2.967 . . . . 0.0 118.54 164.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 18.8 tp -65.74 -39.18 90.85 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.005 -2.309 . . . . 0.0 115.337 168.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 66.9 mt -84.8 -16.22 42.2 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.986 2.175 . . . . 0.0 115.422 172.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -85.38 -5.12 59.33 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 129.336 3.054 . . . . 0.0 113.816 163.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 54.7 tp -91.77 -64.59 1.1 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 116.025 -1.941 . . . . 0.0 110.971 156.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -83.46 -5.83 59.28 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 119.642 3.201 . . . . 0.0 119.642 -162.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mp -114.85 155.06 27.49 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 112.731 -2.032 . . . . 0.0 111.915 162.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . 0.427 ' HB ' ' CD ' ' C' ' 45' ' ' PRO . 58.6 p -94.23 173.56 4.51 Favored Pre-proline 0 N--CA 1.449 -0.495 0 C-N-CA 129.965 3.306 . . . . 0.0 110.624 166.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . 0.427 ' CD ' ' HB ' ' C' ' 44' ' ' THR . 16.8 Cg_exo -70.91 -30.91 16.23 Favored 'Trans proline' 0 N--CA 1.451 -0.989 1 C-N-CA 125.815 4.344 . . . . 0.0 111.385 -168.109 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -43.59 97.01 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.073 2.149 . . . . 0.0 108.44 178.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -71.53 -24.12 61.89 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.132 1.373 . . . . 0.0 114.465 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 82.8 mtm-85 -80.28 -33.02 38.04 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 117.156 -3.465 . . . . 0.0 108.968 170.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -64.76 -42.77 94.89 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 123.226 1.488 . . . . 0.0 113.827 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.79 -56.58 18.79 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 128.705 2.802 . . . . 0.0 109.671 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 79.9 mt -56.6 -39.81 74.23 Favored 'General case' 0 N--CA 1.446 -0.641 1 O-C-N 116.146 -4.096 . . . . 0.0 116.823 170.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.63 -18.89 46.74 Favored Glycine 0 N--CA 1.448 -0.506 0 O-C-N 119.643 -1.91 . . . . 0.0 114.598 170.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 19.7 m -92.5 -43.54 9.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 112.945 -1.628 . . . . 0.0 110.714 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -63.68 -37.65 88.15 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.61 -2.138 . . . . 0.0 107.747 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 6.8 t -52.9 -47.49 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-N 124.332 3.242 . . . . 0.0 114.346 170.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -65.36 -38.39 89.92 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 115.68 -2.105 . . . . 0.0 114.254 173.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 20.8 mt -65.14 -45.43 94.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 123.294 2.77 . . . . 0.0 107.316 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 24.3 t -57.95 -37.87 63.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 115.503 -2.189 . . . . 0.0 112.171 167.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -70.92 -41.27 71.43 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 124.159 3.163 . . . . 0.0 113.324 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -66.48 -36.33 82.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 114.402 -2.713 . . . . 0.0 111.427 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 63.7 mt -70.94 -37.62 72.85 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 122.688 2.495 . . . . 0.0 114.276 172.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 35.8 mt -77.53 -22.23 51.44 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 114.645 -2.822 . . . . 0.0 109.9 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -67.34 -51.64 49.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.069 -2.269 . . . . 0.0 112.502 165.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.27 21.02 74.19 Favored Glycine 0 CA--C 1.521 0.429 0 O-C-N 117.824 -3.048 . . . . 0.0 118.483 177.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . 0.501 30.6 tt0 -83.48 40.35 0.72 Allowed 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 128.425 2.69 . . . . 0.0 113.995 171.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 23.2 mmt -110.42 119.19 38.39 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -173.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 85.1 p -80.75 160.06 25.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.291 -3.381 . . . . 0.0 113.46 161.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.98 -30.2 61.41 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 119.275 -2.141 . . . . 0.0 112.718 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . 0.253 35.9 ttp-105 -58.7 -45.21 90.03 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 119.966 3.321 . . . . 0.0 119.966 161.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -76.16 -29.58 57.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 126.569 2.418 . . . . 0.0 112.03 -177.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.92 -16.66 52.6 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 117.326 -3.359 . . . . 0.0 115.799 171.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -98.74 -69.58 0.76 Allowed 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 172.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -74.87 -10.92 59.96 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.618 -3.176 . . . . 0.0 113.679 -164.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -106.32 -35.57 7.11 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 120.301 1.41 . . . . 0.0 110.896 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.5 mp -88.81 -28.23 20.57 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 116.776 -1.583 . . . . 0.0 113.165 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . 0.436 ' O ' HG22 ' C' ' 79' ' ' ILE . . . 54.66 -122.85 26.56 Favored Glycine 0 C--N 1.336 0.577 1 C-N-CA 130.95 4.119 . . . . 0.0 114.79 -173.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.2 -23.99 37.76 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 126.121 1.768 . . . . 0.0 113.301 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.68 -14.7 77.86 Favored Glycine 0 CA--C 1.526 0.74 0 O-C-N 128.617 3.698 . . . . 0.0 117.198 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . 0.436 HG22 ' O ' ' C' ' 76' ' ' GLY . 17.4 tt -51.4 -55.94 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 155.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . 0.425 ' HB1' ' HD3' ' C' ' 84' ' ' ARG . . . -69.31 -25.85 64.43 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 119.327 -2.108 . . . . 0.0 111.724 -177.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 1.4 m -68.92 -27.91 66.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.916 1.686 . . . . 0.0 113.171 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 19.5 mm -98.33 -36.55 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 O-C-N 125.538 1.774 . . . . 0.0 114.075 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 78.1 p -91.95 -24.33 19.3 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -170.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . 0.425 ' HD3' ' HB1' ' C' ' 80' ' ' ALA . 71.9 mtp85 -93.6 161.09 14.49 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 130.654 3.582 . . . . 0.0 112.053 177.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.06 169.28 41.38 Favored Glycine 0 CA--C 1.524 0.642 0 O-C-N 118.706 -2.496 . . . . 0.0 116.879 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 25.5 m -64.26 -33.93 76.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 119.048 2.981 . . . . 0.0 119.048 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -93.78 28.66 2.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 126.649 2.468 . . . . 0.0 113.749 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 8.0 p -75.15 159.17 31.95 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.766 -2.459 . . . . 0.0 108.27 -172.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 30.3 tp -44.13 -54.7 5.35 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.833 2.453 . . . . 0.0 113.1 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -82.73 2.45 33.72 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 120.893 1.679 . . . . 0.0 112.663 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -124.03 -16.4 6.55 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.376 1.87 . . . . 0.0 113.054 -172.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.53 152.9 88.36 Favored Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 130.536 3.534 . . . . 0.0 114.822 163.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -66.01 158.98 51.44 Favored 'Trans proline' 0 N--CA 1.446 -1.295 0 O-C-N 115.515 -2.939 . . . . 0.0 117.926 -167.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 89.3 t -65.9 -43.63 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 117.948 -1.025 . . . . 0.0 108.648 -170.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.3 pm0 -60.88 -23.05 64.89 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 116.194 -1.86 . . . . 0.0 112.229 -178.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 18.3 tp -76.86 -49.71 15.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.254 1.822 . . . . 0.0 108.745 169.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 67.6 mtp180 -71.84 -42.44 66.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 118.695 -2.503 . . . . 0.0 111.208 -167.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -50.05 -50.0 49.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 128.794 2.838 . . . . 0.0 108.783 167.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 90.6 t90 -63.31 -41.25 98.91 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 127.998 3.311 . . . . 0.0 117.467 -178.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 81.3 mt -51.79 -36.67 48.54 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 117.077 -1.44 . . . . 0.0 114.349 168.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -80.94 -24.57 38.03 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.774 1.296 . . . . 0.0 113.708 172.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -71.12 -14.23 62.22 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 119.944 1.247 . . . . 0.0 111.162 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 72.9 t -112.03 -61.3 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-O 115.221 -2.324 . . . . 0.0 112.454 176.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 31.6 mt -66.05 -32.43 73.9 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 121.58 1.991 . . . . 0.0 115.398 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 84.9 mt -136.83 62.82 1.59 Allowed 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.662 1.585 . . . . 0.0 111.185 -168.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.281 15.2 pttp . . . . . 0 N--CA 1.452 -0.329 0 CA-C-N 112.262 -2.244 . . . . 0.0 112.595 -174.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 78.2 p . . . . . 0 N--CA 1.452 -0.357 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -50.18 -38.71 51.47 Favored 'Trans proline' 0 N--CA 1.446 -1.322 1 C-N-CA 125.585 4.19 . . . . 0.0 109.728 170.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -153.24 147.22 25.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 128.325 2.65 . . . . 0.0 108.889 178.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 12.7 t -92.66 140.37 29.6 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 120.382 1.446 . . . . 0.0 113.935 -175.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.6 -17.47 64.13 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 120.558 -1.339 . . . . 0.0 112.939 173.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.28 -35.74 66.21 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 120.653 -1.28 . . . . 0.0 111.194 167.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 14.8 mmm -72.01 -47.86 48.85 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 127.311 2.244 . . . . 0.0 114.193 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.97 -59.97 2.05 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.279 2.632 . . . . 0.0 112.263 169.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -67.43 -37.56 83.19 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 116.648 -1.644 . . . . 0.0 113.909 173.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -57.69 -22.54 46.68 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 121.705 2.048 . . . . 0.0 114.286 164.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER -93.88 -4.67 49.56 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 125.13 3.605 . . . . 0.0 106.74 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -90.19 -21.13 22.33 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 122.683 2.492 . . . . 0.0 114.81 153.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . 0.305 75.3 mm-40 -92.41 -36.14 13.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 123.876 1.798 . . . . 0.0 110.13 -166.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -46.6 -36.27 6.75 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 127.201 2.201 . . . . 0.0 111.807 161.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . 0.456 ' CZ3' ' CD1' ' D' ' 22' ' ' PHE 0.254 4.7 t-105 -85.14 -36.32 21.16 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 118.778 -2.451 . . . . 0.0 114.658 -177.564 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 50.7 mt -70.95 -22.75 62.17 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 120.037 -1.664 . . . . 0.0 113.05 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -66.51 -32.19 73.38 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 164.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . 0.456 ' CD1' ' CZ3' ' D' ' 19' ' ' TRP 0.297 13.8 t80 -66.76 -55.26 15.79 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 121.049 1.75 . . . . 0.0 107.728 173.86 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 61.1 t -57.83 -36.33 55.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 117.057 -1.449 . . . . 0.0 110.123 -172.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . 0.281 22.1 t70 -84.92 -28.38 25.96 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 125.745 1.618 . . . . 0.0 112.637 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 23.8 tp -66.27 -53.59 35.0 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 170.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . 0.558 ' O ' ' HB3' ' D' ' 29' ' ' ALA . 57.7 tp -55.33 -38.55 68.87 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 114.386 -2.721 . . . . 0.0 112.123 -178.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp -66.96 -37.35 84.12 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 127.124 2.765 . . . . 0.0 112.895 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -72.17 -29.98 64.54 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 113.535 -1.666 . . . . 0.0 113.143 171.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' D' ' 26' ' ' LEU . . . -60.3 -35.91 76.66 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 126.217 1.807 . . . . 0.0 115.591 164.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -73.39 -11.03 60.34 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 123.553 1.645 . . . . 0.0 113.734 172.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -102.36 -2.47 28.85 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 112.308 -3.71 . . . . 0.0 116.266 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 52.1 p30 -137.4 10.63 2.97 Favored 'General case' 0 N--CA 1.448 -0.55 1 O-C-N 129.228 4.08 . . . . 0.0 117.857 169.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 66.28 33.93 6.84 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 117.627 2.455 . . . . 0.0 117.627 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 20.2 mt -103.24 7.69 38.45 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.553 1.541 . . . . 0.0 111.485 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.42 -49.18 77.07 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 130.762 3.625 . . . . 0.0 112.541 174.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 18.0 mt -71.37 -45.68 13.59 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-N 122.729 2.513 . . . . 0.0 110.486 -178.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.259 82.4 Cg_exo -61.26 -32.47 90.3 Favored 'Trans proline' 0 N--CA 1.45 -1.085 1 C-N-CA 125.465 4.11 . . . . 0.0 115.982 173.745 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 34.6 tp -72.46 -45.59 58.84 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 118.836 -2.415 . . . . 0.0 110.726 174.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 11.3 mt -70.02 -27.85 65.01 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 117.575 -3.203 . . . . 0.0 112.53 176.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -76.85 -30.39 56.29 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 118.046 -2.909 . . . . 0.0 115.195 172.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 56.9 tp -57.97 -46.43 85.15 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 157.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.0 mmt -82.59 -37.7 24.68 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.064 -1.023 . . . . 0.0 112.695 -165.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 64.0 mt -114.63 137.42 51.91 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 114.691 -2.576 . . . . 0.0 111.957 -165.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 42.7 p -78.27 168.16 29.72 Favored Pre-proline 0 N--CA 1.449 -0.493 0 O-C-N 125.421 1.701 . . . . 0.0 112.342 -176.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -52.34 -32.9 53.57 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-N 123.164 2.166 . . . . 0.0 117.631 -174.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -91.49 -32.12 15.7 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 127.028 2.131 . . . . 0.0 112.805 -172.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -58.36 -39.75 80.38 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.05 1.34 . . . . 0.0 113.318 168.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 31.2 mtm-85 -64.26 -52.6 57.89 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.589 2.356 . . . . 0.0 108.491 169.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -54.28 -35.99 63.18 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 127.535 3.022 . . . . 0.0 114.082 174.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.22 -36.91 66.55 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 119.615 -1.928 . . . . 0.0 114.374 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . 0.444 ' HB3' ' CE2' ' C' ' 22' ' ' PHE . 43.5 mt -72.15 -45.73 59.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 119.211 -2.181 . . . . 0.0 113.412 -179.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.3 -42.41 99.77 Favored Glycine 0 C--N 1.338 0.676 0 C-N-CA 125.16 1.362 . . . . 0.0 110.572 166.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 36.2 m -60.67 -33.86 73.47 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 124.175 3.988 . . . . 0.0 114.504 169.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.4 61.2 mtt180 -52.99 -27.12 17.67 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 118.038 -2.914 . . . . 0.0 116.993 166.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 76.4 t -69.2 -50.5 52.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-O 114.75 -2.548 . . . . 0.0 107.377 175.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . 0.4 ' HG2' ' H ' ' D' ' 56' ' ' ARG . 3.2 ptm180 -68.02 -35.9 79.05 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 125.601 3.819 . . . . 0.0 110.67 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . 0.41 HD13 HG21 ' D' ' 57' ' ' ILE . 59.4 mt -52.48 -53.8 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 120.56 1.527 . . . . 0.0 109.877 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 69.6 t -67.66 -44.96 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 O-C-N 117.136 -3.478 . . . . 0.0 106.234 -175.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -49.67 -41.72 43.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.043 -2.286 . . . . 0.0 116.427 168.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . 0.254 45.1 mm-40 -76.28 -24.3 54.44 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 125.802 1.939 . . . . 0.0 110.73 178.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 48.0 mt -76.74 -44.78 31.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 119.29 -2.131 . . . . 0.0 110.447 176.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . 0.261 30.6 mt -62.11 -25.79 67.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.957 1.703 . . . . 0.0 114.213 168.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 37.4 ttm180 -84.99 -41.41 15.86 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 119.924 -1.735 . . . . 0.0 111.547 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 41.03 64.71 1.21 Allowed Glycine 0 CA--C 1.522 0.478 0 C-N-CA 126.524 2.011 . . . . 0.0 116.797 -174.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -130.95 -36.81 1.33 Allowed 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 131.121 3.768 . . . . 0.0 112.457 177.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 13.4 mmt -85.37 49.08 1.68 Allowed 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 130.04 3.336 . . . . 0.0 108.322 166.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 53.3 p -69.64 165.3 21.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 124.549 2.119 . . . . 0.0 115.583 -168.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 56.62 -103.42 0.18 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 117.594 2.442 . . . . 0.0 117.594 158.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -53.44 -45.06 69.33 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 114.306 -2.759 . . . . 0.0 114.48 168.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -82.03 -40.1 22.55 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 123.682 2.946 . . . . 0.0 110.314 -166.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.63 -30.74 14.16 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 118.146 2.647 . . . . 0.0 118.146 165.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -86.2 -46.85 9.99 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 116.792 2.145 . . . . 0.0 116.792 169.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -74.74 -45.81 41.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 115.278 -2.296 . . . . 0.0 110.9 -175.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -119.0 -32.55 4.43 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 120.085 1.311 . . . . 0.0 112.788 -160.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.258 1.3 mm? -72.73 -28.85 62.89 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 116.131 -1.89 . . . . 0.0 109.24 157.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 105.68 -174.35 20.88 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-O 125.63 2.795 . . . . 0.0 106.959 151.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.254 . . -58.72 -9.2 1.61 Allowed 'General case' 0 N--CA 1.45 -0.47 1 C-N-CA 133.719 4.808 . . . . 0.0 119.596 171.2 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.87 -21.79 65.81 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 115.243 0.857 . . . . 0.0 115.243 164.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 3.7 tt -38.06 -31.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 127.031 2.132 . . . . 0.0 115.672 172.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.54 -7.25 13.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 118.283 -2.761 . . . . 0.0 114.924 -171.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 47.3 m -66.89 -44.02 81.94 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.536 150.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 15.7 mm -68.09 -35.85 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 129.164 2.986 . . . . 0.0 114.328 168.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 68.4 p -119.75 8.1 11.12 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 123.868 3.031 . . . . 0.0 116.692 -175.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.2 mtp85 -115.76 170.54 8.38 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 121.744 2.066 . . . . 0.0 113.848 149.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.11 156.12 32.38 Favored Glycine 0 C--N 1.334 0.464 0 CA-C-O 123.794 1.775 . . . . 0.0 111.659 -166.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 53.1 p -78.16 -5.91 53.17 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 -156.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -138.89 41.24 2.14 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 128.839 2.856 . . . . 0.0 109.944 169.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 12.7 p -56.67 174.51 0.15 Allowed 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 129.271 3.028 . . . . 0.0 107.586 164.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp -66.38 -24.76 66.54 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 118.021 -2.925 . . . . 0.0 111.145 174.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 36.8 tttt -76.65 0.75 19.13 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 167.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -130.86 5.32 4.58 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 115.069 -2.396 . . . . 0.0 115.09 -176.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . 0.57 ' HA ' ' C ' ' D' ' 93' ' ' PRO 0.376 . . 48.33 76.5 0.54 Allowed Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 119.252 3.056 . . . . 0.0 119.252 140.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . 0.57 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 76.8 Cg_exo 33.01 28.4 0.0 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.985 0 CA-C-N 123.543 2.301 . . . . 0.0 113.665 36.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . 0.42 ' H ' ' C ' ' D' ' 92' ' ' ALA . 3.6 t -50.76 -21.93 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 C-N-CA 125.784 1.634 . . . . 0.0 108.781 166.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . 0.46 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.333 0.0 OUTLIER -103.47 -35.92 8.17 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.948 1.699 . . . . 0.0 111.919 -169.082 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 27.4 tp -50.86 -54.24 25.6 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 117.445 -1.702 . . . . 0.0 110.031 151.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 -60.48 -46.02 91.62 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 128.582 2.753 . . . . 0.0 113.816 -169.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -75.1 -12.99 60.43 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 116.957 -3.589 . . . . 0.0 116.927 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 64.5 t90 -77.47 -48.41 17.19 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 117.144 -1.408 . . . . 0.0 110.81 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 38.9 mt -58.24 -34.68 70.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 126.742 2.526 . . . . 0.0 108.33 169.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -60.97 -31.74 71.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.298 2.239 . . . . 0.0 114.018 175.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -97.97 -23.12 15.94 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 119.681 -1.887 . . . . 0.0 112.884 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.254 49.0 t -78.19 -23.57 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 CA-C-N 121.702 2.047 . . . . 0.0 111.488 167.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 78.7 mt -120.75 -20.1 7.13 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 -163.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 67.7 mt -115.44 29.72 7.82 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.252 2.221 . . . . 0.0 107.188 166.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -52.6 167.32 0.15 Allowed 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.713 2.805 . . . . 0.0 115.704 173.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 53.8 m -40.35 -50.26 2.81 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 119.524 3.157 . . . . 0.0 119.524 -175.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 . . . . . 0 C--O 1.245 0.832 0 C-N-CA 126.055 1.742 . . . . 0.0 113.944 177.54 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.2 ttt . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 121.038 0.447 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -37.62 74.78 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.215 -0.902 . . . . 0.0 112.915 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -64.97 -37.19 86.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 120.027 -1.671 . . . . 0.0 110.915 166.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -55.33 -49.34 72.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 117.231 -3.418 . . . . 0.0 111.141 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -74.53 -17.84 60.69 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.769 -177.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -65.84 -49.74 67.1 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 118.914 -1.115 . . . . 0.0 110.85 168.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -70.12 -24.78 63.24 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.332 2.345 . . . . 0.0 117.332 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -67.31 -41.93 84.54 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.756 2.423 . . . . 0.0 109.808 170.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . 0.261 3.0 t-105 -74.51 -44.1 52.86 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.977 -2.327 . . . . 0.0 113.456 174.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 15.4 mt -67.07 -29.27 68.99 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 117.527 -1.669 . . . . 0.0 112.061 -176.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 25.8 ttt180 -30.14 -63.05 0.14 Allowed 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 116.437 2.014 . . . . 0.0 116.437 153.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -53.95 -37.07 63.51 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 116.326 1.972 . . . . 0.0 116.326 173.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.279 2.7 t -69.51 -40.62 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 125.406 1.482 . . . . 0.0 112.282 -176.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -68.54 -50.68 50.13 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 116.203 -1.856 . . . . 0.0 109.329 167.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.429 ' CD1' HG11 ' B' ' 103' ' ' VAL . 22.0 tp -53.26 -40.15 64.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 123.536 2.88 . . . . 0.0 111.506 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.47 HD11 ' CE2' ' A' ' 30' ' ' TYR . 14.3 tp -76.74 -30.16 56.47 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 120.103 1.319 . . . . 0.0 111.526 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -62.74 -47.67 82.56 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 166.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -53.97 -38.81 65.39 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.38 -2.724 . . . . 0.0 111.028 165.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.94 -38.81 57.21 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 122.834 2.561 . . . . 0.0 110.964 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.47 ' CE2' HD11 ' A' ' 26' ' ' LEU . 28.2 m-85 -67.49 -35.42 79.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 118.732 -2.48 . . . . 0.0 109.02 176.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -66.59 -10.78 49.03 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 173.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -115.8 7.22 14.52 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.384 1.073 . . . . 0.0 112.242 177.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.28 24.7 m-20 60.88 14.91 5.56 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 121.474 3.879 . . . . 0.0 121.474 -171.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.1 mt -101.03 13.49 35.03 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 119.624 -1.922 . . . . 0.0 113.648 -175.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.434 ' CG ' ' CD1' ' A' ' 30' ' ' TYR . 19.8 p-80 -55.2 -53.38 56.8 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.822 -2.423 . . . . 0.0 113.381 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.9 mt -70.09 -47.33 21.74 Favored Pre-proline 0 N--CA 1.445 -0.716 0 CA-C-N 123.547 2.885 . . . . 0.0 111.039 -178.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -41.87 -47.81 6.28 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.299 2.666 . . . . 0.0 114.524 168.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 27.4 tp -66.56 -55.47 15.28 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 112.887 -1.96 . . . . 0.0 113.419 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 29.0 mt -61.71 -21.92 64.9 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 119.702 1.137 . . . . 0.0 112.37 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -73.63 -31.95 63.79 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.084 1.754 . . . . 0.0 109.549 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.87 -39.48 43.19 Favored 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 133.915 4.886 . . . . 0.0 115.993 169.229 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.3 mmm -73.58 -32.13 63.97 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 129.066 2.946 . . . . 0.0 113.241 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.4 mt -127.59 120.6 28.54 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.132 1.373 . . . . 0.0 108.724 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.4 p -53.79 163.01 1.19 Allowed Pre-proline 0 N--CA 1.45 -0.465 0 CA-C-N 114.836 -1.074 . . . . 0.0 113.418 172.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -64.86 -28.11 58.92 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 CA-C-N 121.965 1.737 . . . . 0.0 115.93 -172.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -77.23 -27.2 53.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.73 2.122 . . . . 0.0 116.73 177.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -72.17 -39.56 68.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.625 1.97 . . . . 0.0 114.07 172.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.6 mtm-85 -55.96 -46.58 78.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 168.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -49.26 -54.05 18.72 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 119.568 -1.958 . . . . 0.0 113.173 169.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.31 -50.08 55.98 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 114.934 -2.46 . . . . 0.0 107.464 -172.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.9 mt -54.4 -33.42 59.28 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 124.443 3.292 . . . . 0.0 115.707 171.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.24 -47.06 92.35 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 127.928 2.68 . . . . 0.0 114.566 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.0 m -60.11 -27.3 66.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 114.857 -2.497 . . . . 0.0 112.331 163.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -81.61 -23.49 37.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 125.429 1.706 . . . . 0.0 110.795 -173.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 51.6 t -57.36 -45.22 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-O 115.795 -2.05 . . . . 0.0 107.992 167.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.29 11.6 ttt180 -63.26 -37.75 88.45 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 126.779 2.032 . . . . 0.0 110.707 173.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 28.6 mt -57.79 -42.82 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 O-C-N 117.422 -3.299 . . . . 0.0 112.358 174.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.5 t -65.19 -48.25 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 O-C-N 119.178 -2.201 . . . . 0.0 112.458 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -57.27 -47.99 80.03 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.904 1.282 . . . . 0.0 110.526 178.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -69.0 -44.15 73.37 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 115.202 -2.333 . . . . 0.0 114.623 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.1 mt -67.63 -27.13 66.63 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 120.61 1.55 . . . . 0.0 113.997 177.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 tp -77.59 -47.66 18.84 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.359 1.464 . . . . 0.0 108.915 177.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.3 ttm105 -53.96 -35.42 61.75 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 169.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.33 -9.24 14.42 Favored Glycine 0 C--N 1.334 0.45 0 C-N-CA 129.25 3.309 . . . . 0.0 117.259 169.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -60.25 -22.51 63.15 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 127.458 2.303 . . . . 0.0 116.084 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 41.4 mtt -95.4 140.83 29.72 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 126.176 1.79 . . . . 0.0 114.915 175.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.8 p -93.44 176.87 6.22 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 127.628 2.371 . . . . 0.0 109.906 174.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -69.16 -31.88 70.83 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 119.368 -2.082 . . . . 0.0 111.482 169.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.5 tpt85 -62.27 -27.52 69.07 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 167.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -90.67 -40.04 12.11 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 117.265 -1.35 . . . . 0.0 111.763 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.4 mt -63.56 -30.21 71.36 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 120.153 1.342 . . . . 0.0 109.997 176.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -56.86 -25.48 56.63 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -95.79 -54.32 3.38 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 126.2 1.8 . . . . 0.0 111.861 172.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -65.73 -47.81 74.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 118.219 -2.801 . . . . 0.0 114.439 -170.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.3 mt -108.73 -0.34 20.07 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.535 -171.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.86 21.36 73.2 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 119.841 1.2 . . . . 0.0 114.106 -171.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.08 133.1 33.64 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 116.434 2.013 . . . . 0.0 116.434 -165.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.57 129.46 9.13 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-O 114.562 -3.354 . . . . 0.0 111.601 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 83.8 mt -61.48 -17.77 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 1 O-C-N 131.356 4.798 . . . . 0.0 111.477 -164.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -77.19 -28.38 53.93 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.852 2.569 . . . . 0.0 113.361 169.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 26.4 p -84.69 -25.38 28.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 118.067 -1.453 . . . . 0.0 109.855 -173.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 51.1 mm -69.92 -43.29 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-O 113.886 -2.959 . . . . 0.0 109.619 166.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.6 m -49.75 -52.05 34.5 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 122.981 2.628 . . . . 0.0 113.347 168.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.277 42.7 ttt180 -62.45 -29.62 70.65 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 113.779 -3.01 . . . . 0.0 115.396 175.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.64 -36.86 41.84 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 122.216 2.28 . . . . 0.0 117.696 166.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 16.3 m -61.35 -44.35 97.33 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 114.988 -2.434 . . . . 0.0 114.223 173.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -58.27 -37.85 75.8 Favored 'General case' 0 N--CA 1.448 -0.527 1 O-C-N 129.186 4.054 . . . . 0.0 112.02 165.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 64.5 m -70.55 -35.32 73.04 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 124.083 3.129 . . . . 0.0 117.709 172.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.4 tp -69.35 -40.12 77.7 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 128.176 3.422 . . . . 0.0 113.499 170.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 18.7 tttp -59.99 -36.99 78.38 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 120.575 -1.328 . . . . 0.0 113.252 176.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.13 -13.13 58.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 172.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.55 126.36 91.42 Favored Pre-proline 0 N--CA 1.449 -0.504 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -67.63 155.73 68.91 Favored 'Trans proline' 0 N--CA 1.446 -1.281 1 C-N-CA 126.786 4.991 . . . . 0.0 108.759 -172.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . 0.396 3.1 m -68.06 -34.03 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 113.288 -1.778 . . . . 0.0 113.906 -165.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.28 13.0 pm0 -61.29 -35.46 77.38 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 170.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 43.0 tp -70.34 -44.7 67.64 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 124.525 2.107 . . . . 0.0 108.618 173.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.5 mtm180 -70.09 -29.41 66.38 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 116.733 -3.729 . . . . 0.0 114.661 -168.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -80.1 -30.45 39.16 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 117.028 2.232 . . . . 0.0 117.028 168.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 85.7 t90 -73.12 -37.16 66.77 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 169.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.99 -24.31 67.67 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.489 1.516 . . . . 0.0 114.078 174.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -80.33 -8.61 59.56 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.922 2.489 . . . . 0.0 114.883 165.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -99.34 -38.61 8.78 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 112.019 -3.848 . . . . 0.0 105.904 173.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.8 t -83.88 -57.72 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 O-C-N 127.992 3.308 . . . . 0.0 106.879 -165.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.4 mt -85.25 -30.33 23.9 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 120.413 1.46 . . . . 0.0 114.04 -158.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mt -105.86 -27.64 11.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 124.686 2.184 . . . . 0.0 108.276 -148.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.8 tttt . . . . . 0 N--CA 1.452 -0.372 0 C-N-CA 128.568 2.747 . . . . 0.0 115.994 -159.943 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.657 0 CA-C-O 124.564 2.126 . . . . 0.0 108.332 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 21.7 mmt -74.32 -24.81 59.26 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 117.674 -3.141 . . . . 0.0 108.936 -178.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.94 -42.86 56.85 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 120.305 -1.497 . . . . 0.0 109.837 171.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -62.02 -40.56 96.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.075 1.75 . . . . 0.0 111.022 177.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -65.8 -39.25 90.75 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.577 2.351 . . . . 0.0 108.79 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -86.38 -14.54 43.15 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 118.027 -2.921 . . . . 0.0 112.824 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -51.7 -47.7 63.83 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 121.025 1.739 . . . . 0.0 114.757 149.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -64.68 -44.83 89.07 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 118.354 -2.716 . . . . 0.0 110.605 -177.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -53.94 -45.88 71.4 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.702 1.601 . . . . 0.0 112.425 174.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 28.0 t-105 -64.26 -58.91 5.19 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 170.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 73.8 mt -51.78 -25.84 8.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 116.721 -1.609 . . . . 0.0 110.651 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -65.08 -31.93 73.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 174.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -67.43 -53.84 25.56 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 121.048 1.749 . . . . 0.0 109.941 165.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.443 HG23 ' H ' ' B' ' 23' ' ' VAL . 29.7 t -46.11 -38.57 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 117.495 2.405 . . . . 0.0 117.495 171.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -75.07 -52.49 10.91 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.106 2.162 . . . . 0.0 106.61 171.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 46.2 tp -59.27 -34.08 71.83 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 124.891 3.496 . . . . 0.0 112.083 -175.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 27.8 tp -72.76 -37.58 67.62 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 114.503 -2.665 . . . . 0.0 115.39 173.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -65.14 -39.03 92.47 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 121.098 1.772 . . . . 0.0 113.363 176.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -71.59 -34.7 70.11 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 127.011 2.125 . . . . 0.0 108.484 173.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.51 -26.22 65.34 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 121.938 2.154 . . . . 0.0 113.098 175.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -70.77 -28.08 64.41 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.138 -2.226 . . . . 0.0 110.267 173.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -71.59 -13.08 61.66 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -123.55 -1.22 8.56 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 118.214 -2.804 . . . . 0.0 112.194 -172.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.332 0.3 OUTLIER 70.66 8.69 6.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.063 2.545 . . . . 0.0 116.556 -172.522 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.44 3.89 26.36 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 119.566 -1.959 . . . . 0.0 111.905 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -54.49 -47.86 72.53 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 177.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 27.8 tp -65.16 -61.9 5.47 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-O 116.167 -1.873 . . . . 0.0 111.23 -178.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -55.95 -31.47 81.96 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 CA-C-N 124.338 2.585 . . . . 0.0 118.687 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 46.5 tp -70.39 -42.11 72.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 113.623 -3.084 . . . . 0.0 114.22 170.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 21.8 mt -69.47 -33.59 73.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 123.403 2.819 . . . . 0.0 111.576 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -70.56 -26.88 63.75 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 125.144 1.528 . . . . 0.0 112.332 171.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . 0.282 11.7 tp -75.38 -33.48 61.03 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 116.543 -3.848 . . . . 0.0 115.277 164.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 24.4 mmt -84.2 -26.76 28.51 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -170.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 38.7 mt -122.82 136.92 55.03 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 124.242 0.964 . . . . 0.0 109.452 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 59.7 p -68.03 155.78 91.16 Favored Pre-proline 0 N--CA 1.447 -0.601 0 O-C-N 120.05 -1.656 . . . . 0.0 108.926 174.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -47.11 -38.84 25.43 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 122.886 2.391 . . . . 0.0 113.894 174.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -66.91 -45.41 78.05 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 115.592 -2.147 . . . . 0.0 114.902 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -64.1 -38.73 92.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 125.91 2.006 . . . . 0.0 115.118 171.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 42.2 mtm-85 -64.96 -37.95 89.35 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.052 -2.28 . . . . 0.0 111.595 170.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -69.46 -31.26 69.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 173.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.04 -62.42 1.71 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 114.622 -2.608 . . . . 0.0 109.218 170.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 7.2 mt -53.5 -35.7 60.9 Favored 'General case' 0 N--CA 1.447 -0.59 0 O-C-N 127.965 3.291 . . . . 0.0 117.548 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.17 -28.87 70.95 Favored Glycine 0 CA--C 1.522 0.494 0 O-C-N 125.446 1.716 . . . . 0.0 113.485 168.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.7 m -72.87 -34.72 66.91 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.716 -2.638 . . . . 0.0 110.099 166.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.471 ' HA ' ' HB ' ' B' ' 57' ' ' ILE . 95.4 mtt180 -69.79 -18.67 63.49 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 112.634 -3.555 . . . . 0.0 114.804 174.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.38 -59.15 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 122.145 2.248 . . . . 0.0 109.882 157.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -55.42 -34.71 64.67 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 122.437 2.381 . . . . 0.0 116.81 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.471 ' HB ' ' HA ' ' B' ' 54' ' ' ARG 0.347 45.1 mt -57.11 -70.09 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 124.763 2.22 . . . . 0.0 108.678 173.556 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 57.6 t -54.52 -38.15 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 125.382 1.473 . . . . 0.0 112.29 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -65.46 -39.48 92.03 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 119.32 3.082 . . . . 0.0 119.32 169.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -74.38 -31.55 62.41 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 119.533 -1.979 . . . . 0.0 111.096 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 3.6 mt -55.47 -33.77 63.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.442 1.897 . . . . 0.0 113.227 168.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . 0.284 73.3 mt -85.52 -45.84 11.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 116.384 -1.77 . . . . 0.0 108.625 174.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.319 5.0 ttm105 -62.17 -64.3 0.97 Allowed 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 130.035 3.334 . . . . 0.0 110.79 -169.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.91 44.87 13.19 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 119.375 2.51 . . . . 0.0 119.375 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -106.63 -36.48 6.72 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 112.538 -1.831 . . . . 0.0 115.075 168.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 52.2 mtt -70.77 145.6 50.32 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 116.836 2.162 . . . . 0.0 116.836 -173.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 83.3 p -78.46 161.59 26.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 119.77 -1.831 . . . . 0.0 112.738 164.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -68.25 -20.15 64.78 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 119.345 -2.097 . . . . 0.0 108.665 -175.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -64.26 -45.09 89.62 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 115.093 -2.384 . . . . 0.0 113.083 164.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -62.3 -36.94 83.69 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 125.173 1.545 . . . . 0.0 113.059 177.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 91.3 mt -73.01 -51.81 16.8 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.43 1.492 . . . . 0.0 113.554 173.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 18.0 tptp -65.92 -46.14 79.33 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 119.443 -2.036 . . . . 0.0 110.892 -174.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -100.93 -17.53 16.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 124.177 0.923 . . . . 0.0 111.004 -164.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . 0.296 34.9 mt-10 -121.92 -16.25 7.64 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 115.613 -2.137 . . . . 0.0 111.432 -172.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 81.7 mt -112.04 -5.03 14.32 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 117.589 2.44 . . . . 0.0 117.589 162.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.63 21.65 69.18 Favored Glycine 0 C--N 1.334 0.467 0 O-C-N 124.433 1.083 . . . . 0.0 111.758 -177.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -111.9 108.32 17.65 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.617 -0.931 . . . . 0.0 112.131 -172.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.5 -176.19 51.26 Favored Glycine 0 CA--C 1.523 0.558 0 O-C-N 126.374 2.296 . . . . 0.0 109.606 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 26.8 mm -53.68 -46.02 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-O 125.925 2.774 . . . . 0.0 112.833 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.38 -23.94 54.1 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 117.643 -3.16 . . . . 0.0 110.12 -171.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 5.6 m -79.1 -35.47 42.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 125.696 1.873 . . . . 0.0 109.919 177.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 38.5 mm -74.77 -52.03 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 C-N-CA 130.884 3.674 . . . . 0.0 110.549 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 30.9 m -57.61 -37.98 74.17 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 130.095 3.358 . . . . 0.0 113.34 173.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -66.75 -47.09 73.32 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.997 -1.001 . . . . 0.0 111.531 169.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -54.64 -36.97 59.98 Favored Glycine 0 CA--C 1.521 0.466 0 O-C-N 119.121 -2.237 . . . . 0.0 114.83 166.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 24.2 p -72.47 -29.19 63.43 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.223 1.011 . . . . 0.0 110.24 -178.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -70.77 -44.59 66.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.475 1.51 . . . . 0.0 114.821 166.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 70.5 m -57.85 -34.63 69.93 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 115.072 1.508 . . . . 0.0 115.072 177.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' B' ' 89' ' ' LEU . 16.8 mt -60.89 -24.64 66.13 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 127.599 3.062 . . . . 0.0 111.598 168.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -93.8 -43.35 8.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.697 1.999 . . . . 0.0 111.353 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.35 -1.21 1.56 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.398 1.879 . . . . 0.0 115.328 162.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.16 149.76 50.7 Favored Pre-proline 0 N--CA 1.447 -0.585 0 O-C-N 119.708 -1.87 . . . . 0.0 110.287 174.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -60.47 144.61 99.53 Favored 'Trans proline' 0 N--CA 1.448 -1.204 0 C-N-CA 122.857 2.371 . . . . 0.0 112.658 164.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 25.2 m -67.92 -23.72 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -178.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -68.84 -4.68 17.17 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 117.852 -3.03 . . . . 0.0 114.308 166.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 15.0 tp -99.5 -35.61 9.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 120.726 1.603 . . . . 0.0 110.338 170.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 57.9 mtp85 -54.55 -41.29 69.59 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 130.9 3.68 . . . . 0.0 113.959 173.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -74.44 -42.41 59.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.158 2.183 . . . . 0.0 110.409 167.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -52.81 -36.82 59.01 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 116.362 -1.78 . . . . 0.0 114.244 178.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 21.0 mt -83.76 -35.27 24.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.081 1.753 . . . . 0.0 113.606 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -61.91 -31.54 71.86 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 171.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -103.1 -15.49 16.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 125.493 1.746 . . . . 0.0 115.378 -175.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.429 HG11 ' CD1' ' A' ' 25' ' ' LEU . 53.9 t -85.1 -54.21 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 128.668 2.787 . . . . 0.0 110.879 167.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 14.0 mt -78.11 -44.36 26.34 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 116.886 2.18 . . . . 0.0 116.886 -168.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 88.3 mt -76.67 -22.72 53.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 127.308 2.88 . . . . 0.0 111.07 -169.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -86.58 -4.7 59.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 128.704 2.802 . . . . 0.0 112.255 170.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 17.6 m -104.49 3.57 32.17 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.304 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 19.1 t70 . . . . . 0 C--O 1.251 1.139 0 C-N-CA 128.704 2.802 . . . . 0.0 114.203 178.444 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ttt . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.86 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.275 . . -72.33 154.43 40.95 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 127.45 2.969 . . . . 0.0 113.35 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -126.94 145.74 50.57 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 126.193 1.797 . . . . 0.0 110.414 -177.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -121.14 126.17 49.06 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.935 1.294 . . . . 0.0 112.228 171.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . 0.506 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 58.5 p -136.82 142.3 38.25 Favored Pre-proline 0 N--CA 1.445 -0.725 0 C-N-CA 128.117 2.567 . . . . 0.0 109.225 -179.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . 0.506 ' HD3' ' HA ' ' C' ' 5' ' ' SER . 53.3 Cg_exo -64.88 -14.99 48.12 Favored 'Trans proline' 0 N--CA 1.451 -1.013 0 N-CA-C 120.157 3.099 . . . . 0.0 120.157 -164.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -140.97 147.76 39.26 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.125 1.37 . . . . 0.0 114.29 176.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 9.1 t -140.84 133.65 28.98 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.222 1.963 . . . . 0.0 108.527 164.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.52 -25.05 53.75 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 111.981 -2.372 . . . . 0.0 113.576 173.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.19 -29.36 34.61 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 119.381 -2.074 . . . . 0.0 110.096 178.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 39.8 mtt -66.07 -38.32 88.0 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.174 2.19 . . . . 0.0 112.284 169.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.17 84.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 117.441 2.386 . . . . 0.0 117.441 164.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -73.01 -35.48 66.81 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 125.533 1.771 . . . . 0.0 106.467 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -63.51 -44.92 92.91 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.514 2.042 . . . . 0.0 116.514 166.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -32.33 73.83 Favored 'General case' 0 N--CA 1.448 -0.547 1 O-C-N 116.141 -4.099 . . . . 0.0 107.973 177.066 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -68.0 -54.09 21.08 Favored 'General case' 0 N--CA 1.453 -0.292 1 O-C-N 115.628 -4.42 . . . . 0.0 111.416 173.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.275 67.0 mm-40 -54.44 -35.78 63.35 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 114.867 1.432 . . . . 0.0 114.867 172.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -64.58 -35.04 79.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 172.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 -71.16 -37.51 72.23 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 124.257 1.98 . . . . 0.0 108.383 177.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . 0.285 9.7 mp -67.09 -16.87 64.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.628 177.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -93.31 -31.41 14.69 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 114.099 -2.857 . . . . 0.0 113.377 178.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -64.06 -33.9 76.81 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 126.518 2.386 . . . . 0.0 109.008 168.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.284 11.1 t -60.99 -44.31 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 O-C-N 118.562 -2.586 . . . . 0.0 114.917 168.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -71.7 -32.3 67.68 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 126.623 2.452 . . . . 0.0 117.229 -174.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 50.0 tp -68.37 -50.61 51.92 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 118.482 -1.287 . . . . 0.0 108.599 173.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 61.7 tp -57.23 -37.2 71.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 120.544 -1.347 . . . . 0.0 110.461 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -47.67 -55.66 8.94 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.789 2.436 . . . . 0.0 111.849 173.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -74.87 -25.13 58.74 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.192 -2.813 . . . . 0.0 107.57 -177.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.5 -26.12 68.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 118.818 2.896 . . . . 0.0 118.818 -175.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -64.01 -41.33 97.49 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 122.745 1.259 . . . . 0.0 114.343 171.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -61.34 -36.5 80.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.072 -1.422 . . . . 0.0 111.551 -174.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . 0.312 29.6 p-10 -108.29 9.31 27.95 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.13 2.172 . . . . 0.0 116.756 173.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.535 5.0 m-20 61.21 28.45 18.05 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 117.065 -3.522 . . . . 0.0 120.507 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.02 4.13 35.33 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 116.654 2.094 . . . . 0.0 116.654 165.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -67.59 -43.31 80.84 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 122.08 2.218 . . . . 0.0 115.212 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 80.6 mt -65.92 -50.21 54.12 Favored Pre-proline 0 N--CA 1.45 -0.432 0 O-C-N 117.747 -3.096 . . . . 0.0 112.449 166.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -42.82 -49.4 6.78 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 CA-C-N 124.176 2.527 . . . . 0.0 118.205 162.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 19.8 tp -63.36 -40.62 97.77 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.318 66.8 mt -70.77 -8.4 52.05 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 118.329 -2.732 . . . . 0.0 115.514 174.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -107.96 -1.49 20.58 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 130.997 3.719 . . . . 0.0 111.32 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 12.3 tp -104.98 -48.05 3.84 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 120.814 -1.179 . . . . 0.0 113.194 166.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 87.5 mmm -78.29 -2.53 38.41 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -170.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mp -138.75 154.84 48.56 Favored 'General case' 0 N--CA 1.452 -0.342 1 O-C-N 115.877 -4.264 . . . . 0.0 107.663 -172.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 54.6 p -79.67 160.25 69.94 Favored Pre-proline 0 N--CA 1.449 -0.521 0 C-N-CA 129.791 3.236 . . . . 0.0 112.655 163.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -48.52 -43.35 33.43 Favored 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 122.811 2.341 . . . . 0.0 114.907 169.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -40.35 94.9 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 118.091 -2.881 . . . . 0.0 108.717 175.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -66.94 -35.32 79.72 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 123.686 2.948 . . . . 0.0 113.346 -176.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 82.3 mtm-85 -64.8 -31.36 72.56 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 127.608 3.575 . . . . 0.0 115.132 165.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.78 -30.0 45.33 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 111.882 -2.417 . . . . 0.0 105.521 -172.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.46 -37.05 77.15 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 123.485 1.612 . . . . 0.0 114.613 175.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 68.6 mt -74.91 -25.63 59.05 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 117.724 2.49 . . . . 0.0 117.724 167.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.11 -45.88 94.49 Favored Glycine 0 CA--C 1.526 0.751 0 O-C-N 118.837 -2.414 . . . . 0.0 111.87 164.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 58.3 m -60.98 -57.16 13.8 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 130.249 3.42 . . . . 0.0 109.412 174.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.38 26.9 mtt180 -60.59 -31.37 70.52 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.025 -1.047 . . . . 0.0 113.452 -170.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 46.8 t -67.97 -45.47 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.251 0.62 . . . . 0.0 110.088 174.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.76 -1.96 6.27 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.549 -2.594 . . . . 0.0 115.329 171.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 53.1 mt -99.49 -34.13 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 120.557 1.526 . . . . 0.0 110.328 173.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 77.5 t -69.85 -41.49 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 117.592 -3.192 . . . . 0.0 113.852 172.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -64.02 -42.66 97.06 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 122.494 1.14 . . . . 0.0 111.944 176.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -64.34 -24.6 67.7 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 170.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 97.0 mt -90.73 -17.34 26.88 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 63.5 mt -84.81 -41.08 16.44 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.881 2.472 . . . . 0.0 111.482 163.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 29.7 ttm105 -61.88 -41.85 98.35 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 126.228 2.918 . . . . 0.0 112.373 175.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.35 12.99 61.96 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 119.682 2.633 . . . . 0.0 119.682 172.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -73.28 -31.49 64.09 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 118.442 -2.799 . . . . 0.0 111.604 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 17.3 mmt -72.04 141.53 49.29 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 126.503 3.049 . . . . 0.0 110.585 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 53.8 p -114.1 169.01 9.33 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 111.466 -2.606 . . . . 0.0 113.833 -171.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -43.43 -33.91 1.18 Allowed 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 126.668 2.48 . . . . 0.0 116.606 -170.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 26.2 ttp-105 -72.37 -51.68 19.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 126.252 1.821 . . . . 0.0 109.468 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -69.37 -40.78 77.24 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 128.523 2.729 . . . . 0.0 112.414 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 91.1 mt -52.28 -21.46 3.5 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 117.233 2.309 . . . . 0.0 117.233 167.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -106.16 -42.79 4.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 120.322 -1.486 . . . . 0.0 110.949 166.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -88.16 -8.21 55.72 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 120.927 -1.108 . . . . 0.0 112.788 -165.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -129.71 -47.31 1.15 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 116.185 -1.864 . . . . 0.0 114.342 -177.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 mp -64.71 -28.3 69.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 120.164 1.347 . . . . 0.0 111.336 163.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 57.09 -151.6 26.35 Favored Glycine 0 N--CA 1.447 -0.595 0 N-CA-C 117.214 1.645 . . . . 0.0 117.214 -168.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.03 -20.84 55.42 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 116.491 -3.947 . . . . 0.0 114.981 -168.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.32 -5.1 26.63 Favored Glycine 0 C--N 1.337 0.599 0 O-C-N 126.958 2.661 . . . . 0.0 115.618 -178.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 16.5 tt -64.4 -31.87 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 O-C-N 117.601 -3.293 . . . . 0.0 110.468 170.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.15 -18.44 36.72 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 122.326 2.33 . . . . 0.0 114.142 -177.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 55.1 m -73.99 -26.8 60.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.269 2.228 . . . . 0.0 112.841 170.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 24.4 mm -98.13 -6.39 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 O-C-N 117.134 -3.479 . . . . 0.0 110.954 178.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 80.8 p -125.01 4.95 7.96 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 118.584 -2.573 . . . . 0.0 116.586 -166.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -127.66 149.09 50.36 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.399 0.68 . . . . 0.0 111.952 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.61 178.15 42.55 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-O 117.194 -1.892 . . . . 0.0 114.77 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 18.4 m -71.16 -15.56 62.49 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 118.045 2.609 . . . . 0.0 118.045 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -96.15 -7.3 36.22 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 120.524 3.528 . . . . 0.0 120.524 170.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 8.4 p -42.96 158.71 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 123.209 1.48 . . . . 0.0 114.277 175.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 57.5 tp -54.59 -38.24 66.5 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 130.536 3.534 . . . . 0.0 109.119 -167.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -99.3 -1.15 39.7 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 122.126 2.239 . . . . 0.0 113.077 -175.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -116.4 -13.21 11.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.322 -0.853 . . . . 0.0 112.656 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.29 155.76 6.54 Favored Pre-proline 0 N--CA 1.454 -0.257 0 C-N-CA 126.628 1.971 . . . . 0.0 113.896 171.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.28 149.86 83.27 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.12 1.88 . . . . 0.0 112.73 178.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 29.3 t -65.88 -46.61 88.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 126.105 1.762 . . . . 0.0 109.614 -172.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -62.29 -25.85 68.08 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 113.172 -3.299 . . . . 0.0 117.684 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 15.8 tp -66.55 -48.37 69.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 125.793 1.933 . . . . 0.0 109.377 163.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -63.95 -51.01 66.35 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.355 -165.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -60.15 -29.76 68.86 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.819 2.048 . . . . 0.0 116.236 168.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.7 t90 -78.25 -30.11 48.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 122.384 2.357 . . . . 0.0 108.673 -177.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 16.2 mt -63.77 -40.54 96.93 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 116.815 -1.564 . . . . 0.0 115.121 177.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -70.18 -18.32 63.19 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 127.522 2.329 . . . . 0.0 111.552 177.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -85.7 -28.16 24.84 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 115.359 -2.258 . . . . 0.0 116.158 167.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 17.4 t -96.42 -51.03 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.99 2.632 . . . . 0.0 112.803 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 85.1 mt -76.58 -23.63 53.49 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.101 -175.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 71.6 mt -128.91 29.48 5.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.102 1.761 . . . . 0.0 110.494 -168.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 17.4 pttp . . . . . 0 N--CA 1.451 -0.422 0 CA-C-O 128.08 3.8 . . . . 0.0 117.518 -174.67 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . 0.447 ' HB2' ' HD2' ' D' ' 6' ' ' PRO . 59.7 p . . . . . 0 N--CA 1.451 -0.388 0 CA-C-O 118.041 -0.981 . . . . 0.0 111.292 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' D' ' 5' ' ' SER 0.329 89.5 Cg_endo -78.74 -18.42 11.83 Favored 'Trans proline' 0 N--CA 1.45 -1.049 1 C-N-CA 126.943 5.095 . . . . 0.0 118.774 -166.822 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -154.87 129.69 9.35 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.638 3.175 . . . . 0.0 106.513 156.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.9 t -64.81 124.74 22.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 118.432 2.752 . . . . 0.0 118.432 -174.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.82 -42.54 58.41 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 128.033 2.533 . . . . 0.0 110.37 166.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.38 -27.08 65.92 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.294 -2.129 . . . . 0.0 111.979 177.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.298 9.2 mmt -66.57 -49.09 67.55 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 112.956 -3.402 . . . . 0.0 113.882 161.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.14 -36.52 51.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 125.842 2.734 . . . . 0.0 115.126 175.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 35.7 tp10 -76.04 -47.9 22.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 116.406 -1.759 . . . . 0.0 108.899 174.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -55.55 -44.23 76.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 128.682 2.793 . . . . 0.0 110.668 176.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . 0.406 HH21 ' CD ' ' D' ' 18' ' ' GLU . 0.0 OUTLIER -64.66 -37.06 86.28 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.324 -2.735 . . . . 0.0 115.372 173.651 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -57.56 -45.39 85.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 119.809 1.186 . . . . 0.0 114.199 165.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -74.99 -35.04 62.04 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.639 -1.913 . . . . 0.0 114.305 -175.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . 0.406 ' CD ' HH21 ' D' ' 15' ' ' ARG . 79.0 mt-10 -62.0 -21.28 64.73 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 116.189 -1.862 . . . . 0.0 113.924 163.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -89.33 -26.72 20.95 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 127.22 2.825 . . . . 0.0 113.104 172.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . 0.479 HD23 ' HA ' ' D' ' 20' ' ' LEU . 20.4 mt -69.61 -30.23 67.93 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 123.788 1.756 . . . . 0.0 113.607 172.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 37.7 ttt180 -71.51 -24.79 62.03 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.317 -2.115 . . . . 0.0 112.261 168.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . 0.406 ' CZ ' HD22 ' D' ' 26' ' ' LEU . 69.3 t80 -74.06 -56.45 4.92 Favored 'General case' 0 N--CA 1.453 -0.318 1 O-C-N 115.746 -4.346 . . . . 0.0 108.972 167.406 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 23.4 t -58.76 -37.82 68.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 121.527 1.967 . . . . 0.0 114.476 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -61.19 -39.4 90.03 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 124.76 1.288 . . . . 0.0 114.442 166.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 16.6 tp -67.44 -41.67 84.38 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 119.937 -1.727 . . . . 0.0 112.466 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . 0.406 HD22 ' CZ ' ' D' ' 22' ' ' PHE . 55.0 tp -63.07 -49.36 74.8 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 113.53 -3.128 . . . . 0.0 112.07 171.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -48.91 -55.7 11.0 Favored 'General case' 0 N--CA 1.451 -0.389 1 CA-C-N 126.978 4.445 . . . . 0.0 111.561 167.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -52.81 -30.84 35.65 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 121.294 1.861 . . . . 0.0 112.655 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.88 -34.06 62.16 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 123.126 1.441 . . . . 0.0 112.746 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -68.78 -4.93 17.9 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.109 -3.494 . . . . 0.0 115.233 163.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -104.94 -6.97 19.63 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 117.347 -3.345 . . . . 0.0 113.054 176.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 50.2 p30 -132.97 9.75 4.18 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 128.251 2.62 . . . . 0.0 114.016 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.38 7.1 m-20 67.35 6.76 5.07 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 116.555 2.058 . . . . 0.0 116.555 173.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 32.1 mt -77.68 16.24 0.7 Allowed 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 116.484 -3.885 . . . . 0.0 115.2 166.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -81.19 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.872 2.469 . . . . 0.0 114.059 171.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 14.3 mt -48.58 -30.12 1.95 Allowed Pre-proline 0 N--CA 1.447 -0.615 0 O-C-N 116.613 -3.804 . . . . 0.0 114.085 -176.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -68.13 -48.17 1.42 Allowed 'Trans proline' 0 N--CA 1.447 -1.241 0 O-C-N 114.412 -3.52 . . . . 0.0 116.095 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . 0.261 63.6 tp -48.97 -50.74 34.15 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 116.558 -1.687 . . . . 0.0 108.713 170.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 2.8 mt -66.54 -39.32 88.5 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 113.69 -3.052 . . . . 0.0 106.299 -172.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 -84.22 -17.26 40.44 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 115.587 -2.149 . . . . 0.0 114.119 -176.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 39.9 tp -65.72 -54.5 26.49 Favored 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 125.01 1.444 . . . . 0.0 108.379 161.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 1.7 mmt -68.1 -39.52 82.81 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.101 -1.428 . . . . 0.0 108.43 -168.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 37.3 mt -119.59 137.32 53.93 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 -165.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 8.0 p -73.85 153.75 89.07 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-N 114.057 -1.429 . . . . 0.0 112.757 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -48.99 -37.15 36.66 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 124.97 3.78 . . . . 0.0 120.496 -174.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.365 24.5 m-20 -72.39 -23.16 61.07 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 115.069 -2.396 . . . . 0.0 111.189 176.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -85.1 -32.03 23.03 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 15.7 mtm180 -75.8 -37.1 59.46 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.597 1.559 . . . . 0.0 110.6 173.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -54.83 -47.21 74.4 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 129.401 3.081 . . . . 0.0 107.76 170.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.46 -46.18 80.86 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -178.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.71 -42.76 95.05 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 116.141 -1.885 . . . . 0.0 113.4 174.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.76 -27.07 65.97 Favored Glycine 0 C--N 1.338 0.643 0 CA-C-N 120.307 1.412 . . . . 0.0 116.063 167.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 95.7 m -82.99 -35.48 25.84 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 117.052 -3.617 . . . . 0.0 110.94 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -60.71 -33.39 72.81 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 116.841 -3.662 . . . . 0.0 108.519 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 43.9 t -64.27 -36.11 76.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 123.738 2.972 . . . . 0.0 114.124 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -80.56 -32.28 36.66 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 115.973 -1.965 . . . . 0.0 114.52 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 82.7 mt -49.0 -48.75 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 116.612 -1.661 . . . . 0.0 113.568 160.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 75.3 t -68.99 -43.77 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 O-C-N 124.578 1.174 . . . . 0.0 109.835 -178.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -59.13 -40.02 84.16 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -67.04 -25.86 66.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 116.213 -1.851 . . . . 0.0 112.35 175.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 mt -72.96 -13.35 61.22 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 122.152 2.251 . . . . 0.0 112.169 173.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 85.5 mt -111.85 -18.96 12.57 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 117.393 -1.289 . . . . 0.0 113.759 176.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 ttm105 -69.85 -47.49 62.46 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 162.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 44.55 66.02 1.54 Allowed Glycine 0 CA--C 1.52 0.381 0 C-N-CA 126.285 1.898 . . . . 0.0 110.156 -173.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -130.67 -29.78 1.91 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.023 0.929 . . . . 0.0 112.282 164.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 22.2 mmt -81.02 69.35 7.6 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 125.213 2.435 . . . . 0.0 108.342 165.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 89.6 p -79.16 145.68 33.55 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.593 1.957 . . . . 0.0 111.243 -162.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 56.55 -88.17 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.125 -2.307 . . . . 0.0 115.927 156.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -72.54 -33.46 66.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 169.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -64.66 -42.72 95.2 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.94 -41.09 77.62 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.58 1.8 . . . . 0.0 112.517 174.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 58.1 mtmt -77.71 -37.31 49.77 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 125.09 1.493 . . . . 0.0 112.088 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -83.34 -56.3 3.84 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 121.692 2.042 . . . . 0.0 111.441 -177.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -93.95 -38.69 11.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 125.126 1.516 . . . . 0.0 113.128 -162.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -90.21 -24.06 21.1 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.258 -1.353 . . . . 0.0 108.152 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 74.58 -153.76 46.38 Favored Glycine 0 C--N 1.335 0.52 0 O-C-N 118.356 -2.715 . . . . 0.0 118.187 141.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -34.83 -65.02 0.23 Allowed 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 129.228 3.011 . . . . 0.0 113.71 -165.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.73 -1.7 2.9 Favored Glycine 0 C--N 1.339 0.701 0 O-C-N 126.412 2.32 . . . . 0.0 116.851 -174.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 2.2 tt -47.53 -34.69 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 122.549 3.175 . . . . 0.0 111.181 164.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -91.63 -20.78 21.26 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 119.388 -2.07 . . . . 0.0 110.266 -169.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 81.9 m -65.55 -46.2 80.46 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.349 1.86 . . . . 0.0 110.695 163.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 mm -73.9 -33.89 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 125.347 1.459 . . . . 0.0 111.361 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 16.3 p -119.72 9.61 11.45 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 118.775 2.88 . . . . 0.0 118.775 -174.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 17.8 mtp85 -123.85 173.47 8.16 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 153.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.63 152.98 29.72 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-O 116.633 -2.204 . . . . 0.0 113.498 -154.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 9.6 p -61.44 -29.6 70.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -165.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -128.6 45.05 2.85 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 123.878 1.799 . . . . 0.0 112.18 -177.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 1.7 p -69.24 177.73 2.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 119.808 -1.808 . . . . 0.0 109.382 -178.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 tp -66.22 -24.05 66.54 Favored 'General case' 0 N--CA 1.451 -0.379 1 O-C-N 116.108 -4.12 . . . . 0.0 114.731 176.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -67.72 -7.81 30.24 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 118.394 2.739 . . . . 0.0 118.394 159.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -133.93 11.95 3.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 115.382 -2.247 . . . . 0.0 113.245 -168.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . 0.428 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 30.35 99.32 0.03 OUTLIER Pre-proline 0 N--CA 1.452 -0.343 0 N-CA-C 116.558 2.058 . . . . 0.0 116.558 134.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . 0.428 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.346 0.3 OUTLIER 39.33 43.98 0.0 OUTLIER 'Cis proline' 0 N--CA 1.445 -1.341 0 O-C-N 117.147 -2.08 . . . . 0.0 109.902 26.339 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.94 -21.11 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 O-C-N 119.508 -1.995 . . . . 0.0 111.26 170.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.304 0.0 OUTLIER -91.15 -26.16 19.23 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 125.462 1.726 . . . . 0.0 112.201 -171.414 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.21 -51.7 55.14 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 131.064 3.745 . . . . 0.0 108.495 162.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -58.94 -48.8 80.2 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 126.128 1.771 . . . . 0.0 113.802 -174.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -63.56 -29.14 70.44 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 125.423 1.702 . . . . 0.0 115.399 170.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 70.6 t90 -83.37 -27.31 29.76 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 121.335 1.88 . . . . 0.0 111.652 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 25.7 mt -69.59 -34.8 74.65 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.179 -3.451 . . . . 0.0 110.498 171.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -67.64 -20.52 65.34 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 116.812 -1.566 . . . . 0.0 112.769 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -104.74 -9.88 17.82 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 126.556 2.41 . . . . 0.0 116.765 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.439 3.2 t -106.74 -26.61 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-O 125.698 2.666 . . . . 0.0 116.141 171.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 36.0 mt -104.83 -19.24 13.96 Favored 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 116.611 -3.806 . . . . 0.0 114.545 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 5.1 mp -110.73 44.7 1.23 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.771 1.628 . . . . 0.0 110.495 153.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -62.83 167.71 4.44 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 117.835 2.532 . . . . 0.0 117.835 169.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.9 m -52.4 -42.23 63.85 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 119.314 -2.116 . . . . 0.0 115.08 -170.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.247 0.945 0 C-N-CA 128.612 2.765 . . . . 0.0 118.104 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.451 -0.408 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.32 -22.78 61.13 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 120.428 3.492 . . . . 0.0 120.428 167.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -69.78 -37.51 76.37 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 120.985 -1.072 . . . . 0.0 112.292 157.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -66.78 -37.25 84.22 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 116.645 -3.784 . . . . 0.0 109.414 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -76.97 -3.81 40.83 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 130.747 3.619 . . . . 0.0 116.683 169.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -83.0 -50.31 8.67 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 116.412 -2.115 . . . . 0.0 110.334 163.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -41.76 -41.19 2.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 119.37 3.1 . . . . 0.0 119.37 161.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -65.17 -36.9 85.66 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.032 1.333 . . . . 0.0 113.694 174.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 9.2 t-105 -72.44 -45.57 59.01 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 117.61 -1.186 . . . . 0.0 112.807 170.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.32 -27.52 67.4 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 117.696 -1.145 . . . . 0.0 113.002 178.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . 0.313 12.1 ttt-85 -60.24 -23.22 63.9 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 130.756 3.622 . . . . 0.0 115.329 169.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.252 61.6 t80 -79.79 -43.95 21.54 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 115.427 -2.509 . . . . 0.0 109.684 165.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 68.8 t -69.51 -35.99 69.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -168.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -60.96 -37.01 80.89 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 165.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.9 tp -72.61 -30.41 64.32 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.257 1.023 . . . . 0.0 112.298 -177.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 48.5 tp -82.28 -31.76 29.91 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 128.047 2.539 . . . . 0.0 106.056 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -62.73 -44.35 96.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 121.996 2.18 . . . . 0.0 108.261 175.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -68.39 -36.29 78.94 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 127.475 3.512 . . . . 0.0 109.65 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.83 -40.93 95.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 116.535 -3.853 . . . . 0.0 117.477 175.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -68.84 -33.48 73.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 120.544 1.52 . . . . 0.0 113.044 173.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -71.96 -21.24 61.62 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 117.161 -3.462 . . . . 0.0 116.39 170.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -101.26 11.72 38.81 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 114.04 -2.886 . . . . 0.0 114.512 168.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 48.67 42.94 20.27 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 125.225 1.578 . . . . 0.0 113.142 -175.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -114.28 -1.66 13.53 Favored 'General case' 0 N--CA 1.45 -0.458 1 C-N-CA 133.538 4.735 . . . . 0.0 113.314 176.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -56.81 -43.08 80.62 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 122.683 2.492 . . . . 0.0 112.951 -178.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.444 HD23 ' HA ' ' A' ' 36' ' ' LEU . 12.5 mt -64.17 -63.45 3.82 Favored Pre-proline 0 N--CA 1.447 -0.584 0 O-C-N 120.549 -1.344 . . . . 0.0 109.841 -175.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -70.17 -11.58 30.56 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 CA-C-O 115.462 -1.974 . . . . 0.0 112.716 -174.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.6 tp -70.52 -63.25 1.13 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 129.254 3.021 . . . . 0.0 105.105 167.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 37.0 mt -58.86 -34.5 71.67 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 119.571 -1.956 . . . . 0.0 114.537 -175.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -51.71 -50.76 59.88 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.479 1.112 . . . . 0.0 112.299 164.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.8 tt -64.32 -47.18 80.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 126.584 1.954 . . . . 0.0 109.869 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 65.9 mmm -83.86 -17.95 39.17 Favored 'General case' 0 N--CA 1.453 -0.295 1 CA-C-O 111.306 -4.188 . . . . 0.0 116.49 -167.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 mt -133.5 138.77 46.28 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 124.201 3.182 . . . . 0.0 108.444 170.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.9 p -73.5 155.5 89.41 Favored Pre-proline 0 N--CA 1.448 -0.544 0 CA-C-N 114.359 -1.291 . . . . 0.0 111.011 177.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -59.45 -29.24 89.55 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 CA-C-O 114.905 -2.206 . . . . 0.0 117.212 -170.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.49 -23.61 53.76 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 122.748 2.522 . . . . 0.0 107.372 178.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -81.26 -27.63 35.08 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 116.74 -3.725 . . . . 0.0 113.221 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.8 mtm-85 -69.73 -57.13 5.5 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 117.904 -2.998 . . . . 0.0 108.373 178.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . 0.275 24.4 tt0 -61.84 -27.18 68.59 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.365 1.866 . . . . 0.0 111.889 177.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.75 -38.05 70.44 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.62 2.368 . . . . 0.0 110.269 174.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.9 mt -70.62 -27.71 64.29 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 120.823 1.647 . . . . 0.0 115.199 166.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.5 -38.02 95.69 Favored Glycine 0 C--N 1.335 0.501 0 CA-C-N 122.094 2.225 . . . . 0.0 111.299 167.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.0 m -68.91 -39.87 79.42 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 119.614 3.19 . . . . 0.0 119.614 171.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -54.93 -24.13 22.21 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 114.829 -2.51 . . . . 0.0 115.724 163.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.3 t -60.93 -38.66 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 122.397 2.362 . . . . 0.0 113.17 164.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -77.74 -29.67 51.23 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 114.983 -2.436 . . . . 0.0 114.378 171.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 66.8 mt -74.74 -24.57 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 122.48 2.4 . . . . 0.0 112.556 172.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 4.3 t -71.12 -51.77 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 C-N-CA 124.789 1.236 . . . . 0.0 110.986 159.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -50.51 -67.99 0.21 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.067 1.747 . . . . 0.0 111.922 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -71.79 -34.93 69.82 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.611 2.365 . . . . 0.0 110.541 -165.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.66 -39.45 91.42 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 118.022 2.601 . . . . 0.0 118.022 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.89 -37.14 72.98 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.751 2.02 . . . . 0.0 113.877 177.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 34.8 ttm105 -66.76 -44.6 80.97 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 165.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.7 18.02 55.49 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 110.014 -3.266 . . . . 0.0 113.372 155.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.257 47.9 mm-40 -88.18 -27.22 21.98 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 120.595 2.198 . . . . 0.0 107.025 -179.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 57.3 mtt -91.91 124.95 36.4 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 125.098 1.499 . . . . 0.0 112.603 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.8 p -73.07 164.63 26.41 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.024 1.73 . . . . 0.0 112.589 166.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.404 ' HB3' HG23 ' A' ' 79' ' ' ILE . 48.6 mt-30 -59.4 -40.06 85.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 123.967 0.792 . . . . 0.0 112.999 166.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 42.2 tpt85 -57.63 -27.37 62.73 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 173.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -87.1 -34.99 18.93 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 117.063 2.245 . . . . 0.0 117.063 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 92.0 mt -58.6 -26.16 63.38 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 118.806 -2.434 . . . . 0.0 115.592 167.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -42.28 -44.67 3.92 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 115.663 1.727 . . . . 0.0 115.663 157.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -83.37 -46.12 12.93 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 174.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -62.53 -46.77 86.87 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 125.458 1.503 . . . . 0.0 111.148 -169.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.9 mt -119.09 9.21 11.73 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 111.787 -2.46 . . . . 0.0 109.042 -169.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.79 12.1 74.17 Favored Glycine 0 C--N 1.337 0.596 0 N-CA-C 117.985 1.954 . . . . 0.0 117.985 174.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -97.2 141.59 30.14 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 118.875 2.917 . . . . 0.0 118.875 -157.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.03 123.17 21.04 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-O 116.656 -2.191 . . . . 0.0 110.422 168.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.404 HG23 ' HB3' ' A' ' 68' ' ' GLN . 72.0 mt -53.88 -35.08 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 118.719 1.259 . . . . 0.0 112.387 -162.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.2 -14.36 61.78 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 119.308 -2.12 . . . . 0.0 114.491 -171.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 78.0 p -74.56 -44.6 50.2 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.9 mm -68.93 -29.23 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-O 115.091 -2.385 . . . . 0.0 107.453 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 99.0 m -60.89 -32.15 71.62 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 120.908 1.686 . . . . 0.0 114.009 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -69.69 -46.26 66.43 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.919 -1.113 . . . . 0.0 113.114 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.15 -26.97 65.05 Favored Glycine 0 CA--C 1.525 0.712 0 O-C-N 119.739 -1.851 . . . . 0.0 110.29 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.2 m -64.64 -38.93 92.68 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.854 0.862 . . . . 0.0 110.161 169.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -77.34 -30.03 53.72 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 118.697 -2.502 . . . . 0.0 110.757 175.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.7 m -67.43 -40.14 85.46 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 122.362 2.346 . . . . 0.0 112.938 170.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.4 tp -64.4 -41.7 96.5 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 117.626 2.454 . . . . 0.0 117.626 168.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -57.8 -39.53 77.79 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 119.756 -1.84 . . . . 0.0 111.04 165.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.71 3.59 44.2 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 121.422 3.86 . . . . 0.0 121.422 175.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.44 153.36 85.8 Favored Pre-proline 0 N--CA 1.449 -0.482 0 O-C-N 126.336 2.272 . . . . 0.0 108.782 178.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -67.12 148.57 81.28 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 N-CA-C 109.303 -1.076 . . . . 0.0 109.303 -175.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.14 -30.79 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 117.852 -1.071 . . . . 0.0 111.692 -163.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 16.1 pm0 -76.86 -7.96 56.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.267 2.227 . . . . 0.0 111.392 -177.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 49.3 tp -87.34 -46.85 9.29 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 124.794 1.309 . . . . 0.0 112.944 168.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 54.5 mtm-85 -56.86 -35.28 68.7 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 119.251 -2.156 . . . . 0.0 110.493 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -66.94 -20.61 65.93 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 116.844 -3.66 . . . . 0.0 117.69 171.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -90.27 -42.94 10.7 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 118.061 -2.9 . . . . 0.0 106.715 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.66 -20.45 64.83 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 126.12 1.768 . . . . 0.0 114.683 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -70.21 -48.53 56.69 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.861 -3.024 . . . . 0.0 108.677 170.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -71.44 -32.23 68.12 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.239 -175.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 80.8 t -81.37 -59.75 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-O 113.464 -3.16 . . . . 0.0 110.959 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.6 mt -96.28 -29.69 13.86 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 127.367 2.917 . . . . 0.0 113.268 -172.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 11.7 mt -107.46 -22.9 12.38 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 114.735 -2.786 . . . . 0.0 110.84 -159.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 71.7 tttt . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 125.319 2.485 . . . . 0.0 115.19 -175.314 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.423 0 N-CA-C 118.244 2.683 . . . . 0.0 118.244 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.86 -30.27 28.74 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.289 1.836 . . . . 0.0 108.097 172.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.77 -17.9 65.1 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 163.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -85.02 -46.14 11.47 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.508 1.123 . . . . 0.0 112.615 171.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 36.5 tp60 -63.77 -28.78 70.11 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 118.392 -0.813 . . . . 0.0 111.863 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.448 ' HD3' ' HA ' ' B' ' 15' ' ' ARG . 25.9 mmt180 -85.41 -16.21 40.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.774 -1.829 . . . . 0.0 113.793 173.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -80.69 -33.46 35.4 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 119.182 -2.199 . . . . 0.0 108.433 172.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -78.03 -13.52 59.84 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 118.185 -2.822 . . . . 0.0 110.852 175.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -72.91 -39.0 66.68 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 126.183 1.793 . . . . 0.0 113.321 160.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -62.05 -35.94 80.12 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.37 -2.081 . . . . 0.0 111.005 173.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 93.9 mt -70.01 -26.78 64.23 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 128.425 2.69 . . . . 0.0 113.963 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -54.0 -59.97 3.94 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 115.685 -2.102 . . . . 0.0 110.336 165.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -44.33 -45.74 8.94 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.011 2.187 . . . . 0.0 112.949 166.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 39.8 t -65.29 -48.42 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 -176.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.14 -33.74 73.93 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 117.427 -3.296 . . . . 0.0 113.5 172.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 48.6 tp -61.53 -47.03 87.44 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 177.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.261 65.3 tp -66.96 -39.56 87.27 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.308 -3.37 . . . . 0.0 116.066 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -56.3 -44.8 80.24 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 120.423 -1.423 . . . . 0.0 110.079 173.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -71.87 -30.08 65.04 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . 0.299 . . -68.14 -42.33 80.29 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 113.475 -3.155 . . . . 0.0 114.938 168.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -70.27 -10.59 59.38 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 116.617 2.081 . . . . 0.0 116.617 170.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -84.35 -13.3 52.72 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.845 1.258 . . . . 0.0 112.865 168.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -121.63 6.79 9.99 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 122.513 1.149 . . . . 0.0 112.747 176.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.294 1.7 m-20 57.04 30.12 17.66 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 119.429 -2.045 . . . . 0.0 115.496 -176.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 50.4 mt -102.3 14.21 32.57 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 128.886 2.874 . . . . 0.0 110.127 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -64.93 -38.57 91.39 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 114.583 -2.627 . . . . 0.0 117.764 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.26 34.0 tp -67.59 -55.1 15.33 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 126.007 2.067 . . . . 0.0 109.569 -175.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.31 -14.45 22.91 Favored 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 123.794 2.996 . . . . 0.0 114.025 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 40.4 tp -73.93 -41.74 61.61 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 119.405 -2.059 . . . . 0.0 112.511 163.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 46.3 mt -75.9 -25.57 56.18 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.917 -1.992 . . . . 0.0 115.144 175.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -67.76 -41.26 83.61 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.855 1.262 . . . . 0.0 110.345 163.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 26.7 tp -62.3 -46.38 89.02 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 117.671 -3.143 . . . . 0.0 107.283 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 23.7 mmt -77.57 -17.22 58.08 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.602 -2.561 . . . . 0.0 116.975 -169.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 mt -134.01 138.12 45.19 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 118.634 -2.541 . . . . 0.0 108.059 -175.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 64.8 p -89.01 164.98 29.05 Favored Pre-proline 0 N--CA 1.45 -0.467 0 C-N-CA 127.58 2.352 . . . . 0.0 109.607 -171.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -60.66 -27.99 85.78 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 124.215 3.277 . . . . 0.0 117.311 -172.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -76.49 -25.8 54.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 119.67 -1.894 . . . . 0.0 112.052 173.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -92.5 -33.7 14.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 116.628 -3.795 . . . . 0.0 110.168 -169.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 mtm-85 -70.88 -40.96 71.94 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 115.354 -2.26 . . . . 0.0 111.808 176.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -67.27 -30.78 70.76 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 119.891 1.223 . . . . 0.0 111.335 170.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.85 -34.08 60.05 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 120.003 -1.686 . . . . 0.0 115.044 177.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 28.3 mt -62.7 -44.59 95.83 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 118.694 -2.504 . . . . 0.0 110.635 166.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -42.65 -52.43 5.44 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-N 122.295 2.316 . . . . 0.0 114.411 163.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 6.2 m -74.74 -37.86 62.4 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.503 -0.848 . . . . 0.0 111.262 -170.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.42 ' HA ' HD12 ' B' ' 57' ' ' ILE . 89.7 mtt180 -57.48 -35.94 70.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 113.11 -3.329 . . . . 0.0 113.597 168.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 62.5 t -65.7 -35.25 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 114.241 -2.984 . . . . 0.0 106.749 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 48.6 mtp180 -74.98 -22.37 58.59 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 116.973 -1.489 . . . . 0.0 114.788 177.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.42 HD12 ' HA ' ' B' ' 54' ' ' ARG . 31.6 mt -70.17 -47.59 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 119.789 1.177 . . . . 0.0 108.767 173.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.283 47.1 t -73.84 -25.26 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 118.099 -2.876 . . . . 0.0 109.362 -175.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -64.34 -49.45 71.65 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 115.496 1.665 . . . . 0.0 115.496 166.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -64.68 -33.9 77.03 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 127.435 2.959 . . . . 0.0 110.858 175.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 52.1 mt -63.01 -21.22 66.0 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 122.567 2.44 . . . . 0.0 116.74 169.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 39.0 mt -89.05 -38.74 14.15 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 116.9 -1.524 . . . . 0.0 112.173 167.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.281 26.2 ttm105 -55.02 -53.13 59.67 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 123.964 1.84 . . . . 0.0 112.879 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.61 45.91 33.91 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-O 114.666 -3.297 . . . . 0.0 116.034 -172.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -118.26 -44.95 2.66 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 121.107 2.453 . . . . 0.0 115.018 -173.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 50.7 mtt -70.34 148.36 48.55 Favored 'General case' 0 N--CA 1.447 -0.586 2 O-C-N 113.286 -5.884 . . . . 0.0 114.43 179.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 73.0 p -74.96 161.36 29.57 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 128.063 2.545 . . . . 0.0 115.452 158.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -55.02 -24.42 24.46 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.557 0.694 . . . . 0.0 112.119 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 67.0 ttt-85 -77.1 -39.59 48.97 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 127.553 2.341 . . . . 0.0 110.61 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -70.68 -45.44 65.05 Favored 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 127.229 2.831 . . . . 0.0 108.229 174.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 44.7 mt -49.72 -41.02 42.49 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 117.451 2.389 . . . . 0.0 117.451 173.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 17.7 tptp -62.32 -43.91 97.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.479 2.311 . . . . 0.0 116.491 171.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -114.95 -24.09 8.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 126.02 1.728 . . . . 0.0 113.104 -158.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -105.7 -13.89 15.42 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 125.121 1.368 . . . . 0.0 113.862 175.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 57.4 mt -137.62 -3.6 1.87 Allowed 'General case' 0 N--CA 1.446 -0.628 1 O-C-N 116.044 -4.16 . . . . 0.0 108.398 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 84.46 2.75 88.89 Favored Glycine 0 C--N 1.336 0.561 0 O-C-N 120.033 -1.667 . . . . 0.0 113.902 164.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.54 133.76 52.24 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.602 -3.293 . . . . 0.0 118.306 -172.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.59 177.6 39.09 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 127.978 2.704 . . . . 0.0 114.471 174.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 40.6 mm -70.19 -35.86 65.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 O-C-N 118.071 -3.017 . . . . 0.0 111.513 -161.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.35 -36.62 81.77 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 113.894 -2.955 . . . . 0.0 113.127 170.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 74.9 m -54.89 -54.3 44.27 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 127.898 3.249 . . . . 0.0 114.1 172.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 20.4 mm -79.62 -37.05 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 112.527 -2.124 . . . . 0.0 112.391 -170.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 18.6 m -55.4 -47.39 75.96 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 116.154 -1.879 . . . . 0.0 109.724 168.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -55.68 -53.67 53.64 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 123.13 2.695 . . . . 0.0 116.198 173.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -49.24 -31.68 12.65 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 116.042 1.177 . . . . 0.0 116.042 166.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 60.4 p -81.83 -36.31 28.44 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.377 -2.249 . . . . 0.0 114.026 173.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -62.49 -30.48 71.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 115.847 -2.025 . . . . 0.0 114.778 167.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 50.7 m -66.84 -32.04 73.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 122.2 2.273 . . . . 0.0 112.079 171.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 5.7 mt -73.82 -35.27 64.84 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 115.68 -2.105 . . . . 0.0 112.409 168.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -66.82 -36.19 81.79 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 121.011 1.732 . . . . 0.0 114.635 164.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.24 -28.26 67.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 118.086 -2.884 . . . . 0.0 108.4 175.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.76 145.82 97.32 Favored Pre-proline 0 N--CA 1.446 -0.647 0 CA-C-N 123.811 3.005 . . . . 0.0 111.306 -170.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -72.9 153.89 53.16 Favored 'Trans proline' 0 N--CA 1.449 -1.122 0 C-N-CA 124.397 3.398 . . . . 0.0 111.526 173.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 16.7 m -64.47 -19.07 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 O-C-N 118.434 -2.666 . . . . 0.0 116.192 -177.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -77.18 -16.07 59.25 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.356 1.462 . . . . 0.0 113.738 173.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 18.0 tp -90.85 -47.57 7.53 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 118.209 -2.807 . . . . 0.0 114.248 161.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.1 mtp85 -57.75 -48.06 80.71 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 116.2 -1.857 . . . . 0.0 114.404 -176.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -78.82 -12.07 60.01 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 127.088 2.743 . . . . 0.0 115.063 177.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -76.69 -45.0 31.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.563 1.145 . . . . 0.0 109.744 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 11.4 mt -62.08 -42.95 99.74 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 118.726 -2.484 . . . . 0.0 113.528 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -58.95 -31.53 68.8 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 115.689 -2.404 . . . . 0.0 115.257 -178.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -92.74 -27.38 17.26 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 128.521 2.728 . . . . 0.0 118.156 -171.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.39 -42.05 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 O-C-N 119.086 -2.259 . . . . 0.0 110.351 168.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 75.9 mt -77.49 -77.04 0.16 Allowed 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 123.574 0.546 . . . . 0.0 112.125 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 13.3 mt -77.35 -24.83 50.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.204 1.401 . . . . 0.0 110.77 -153.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -61.03 -22.46 64.58 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 123.641 2.928 . . . . 0.0 110.896 171.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 49.5 m -110.85 8.93 22.45 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 129.588 3.155 . . . . 0.0 115.305 -177.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 26.5 t70 . . . . . 0 C--O 1.25 1.095 0 N-CA-C 116.102 1.89 . . . . 0.0 116.102 178.413 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 19.8 ttt . . . . . 0 N--CA 1.471 0.604 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.53 159.13 25.21 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 122.451 1.12 . . . . 0.0 110.419 -173.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -152.82 155.3 36.85 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.453 2.301 . . . . 0.0 107.745 -167.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -154.32 111.42 3.38 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -164.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 81.5 p -101.02 159.03 30.64 Favored Pre-proline 0 N--CA 1.444 -0.736 0 O-C-N 118.992 -2.318 . . . . 0.0 109.042 -175.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -63.5 -28.93 70.75 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 CA-C-O 115.851 -1.812 . . . . 0.0 112.977 -167.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -153.67 142.63 21.19 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 127.827 3.205 . . . . 0.0 111.957 176.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 44.5 t -133.81 118.77 18.41 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 125.665 2.65 . . . . 0.0 107.092 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.79 -20.2 60.54 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.482 -2.011 . . . . 0.0 109.333 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.19 -26.91 32.94 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 121.752 2.069 . . . . 0.0 112.84 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 17.9 mtt -70.1 -31.94 69.74 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 121.104 3.742 . . . . 0.0 121.104 151.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.84 -40.25 83.68 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 126.147 1.779 . . . . 0.0 112.352 163.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -71.72 -37.7 70.59 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 116.369 -2.132 . . . . 0.0 112.898 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -63.15 -29.76 71.05 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.911 1.284 . . . . 0.0 112.033 173.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . 0.28 0.0 OUTLIER -66.15 -39.3 89.71 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 118.36 -2.713 . . . . 0.0 112.826 163.037 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -68.16 -38.49 82.16 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 115.417 -2.23 . . . . 0.0 113.375 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.255 31.5 mm-40 -67.53 -37.47 82.79 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 172.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -61.19 -40.51 94.21 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 115.734 -2.079 . . . . 0.0 113.697 169.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . 0.498 ' CZ2' HD13 ' D' ' 39' ' ' LEU . 24.8 t-105 -63.89 -46.09 86.41 Favored 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 129.713 4.383 . . . . 0.0 113.519 177.015 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.44 -30.98 70.92 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 113.022 -1.899 . . . . 0.0 109.795 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -67.93 -27.67 66.83 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 118.557 -2.589 . . . . 0.0 115.484 172.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -61.21 -41.91 97.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 119.887 -1.758 . . . . 0.0 114.889 156.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 83.6 t -70.59 -41.76 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 C-N-CA 128.474 2.71 . . . . 0.0 112.0 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.61 -44.83 89.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 117.84 -1.076 . . . . 0.0 113.884 169.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 34.1 tp -56.79 -48.85 76.99 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 120.376 1.444 . . . . 0.0 111.651 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 25.9 tp -63.98 -34.8 78.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.394 1.878 . . . . 0.0 111.668 176.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -60.76 -39.0 87.12 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 118.224 -2.798 . . . . 0.0 114.348 -178.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -76.85 -19.13 57.86 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 125.529 1.768 . . . . 0.0 115.272 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 -22.1 35.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.148 -2.22 . . . . 0.0 113.877 -172.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -56.83 -46.64 81.57 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 116.363 -3.96 . . . . 0.0 104.534 170.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -58.67 -35.62 72.86 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 117.041 -3.537 . . . . 0.0 112.065 -170.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -106.26 9.04 32.16 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 117.425 2.38 . . . . 0.0 117.425 174.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.41 7.7 m-20 49.47 39.41 16.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 119.094 -2.254 . . . . 0.0 113.095 177.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 33.9 mt -86.43 -0.35 55.81 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.669 2.388 . . . . 0.0 110.937 160.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -53.65 -51.04 64.39 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 121.19 1.814 . . . . 0.0 109.374 -169.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 mt -62.05 -52.88 64.33 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-O 115.856 -2.021 . . . . 0.0 114.676 174.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . 0.282 70.5 Cg_exo -43.36 -47.11 9.28 Favored 'Trans proline' 0 N--CA 1.45 -1.054 1 C-N-CA 127.458 5.438 . . . . 0.0 116.259 166.567 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 tp -64.99 -37.4 87.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 116.987 2.217 . . . . 0.0 116.987 171.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.292 33.0 mt -77.43 -25.14 50.43 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 127.545 3.028 . . . . 0.0 110.921 177.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -59.31 -44.54 92.55 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 117.733 -1.127 . . . . 0.0 108.779 166.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . 0.422 HD22 HD21 ' D' ' 96' ' ' LEU . 64.1 tp -75.71 -46.35 31.59 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.989 2.515 . . . . 0.0 111.506 -169.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 84.7 mmm -88.77 -14.77 36.32 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.912 -1.117 . . . . 0.0 113.187 -163.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mp -125.48 164.9 19.46 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 122.536 1.16 . . . . 0.0 109.092 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 69.7 p -97.22 169.37 8.74 Favored Pre-proline 0 N--CA 1.448 -0.564 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 175.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -54.51 -45.8 38.27 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.685 2.257 . . . . 0.0 113.668 174.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -42.92 97.19 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.542 1.937 . . . . 0.0 111.63 177.091 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -59.52 -32.18 70.07 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.417 1.487 . . . . 0.0 114.047 179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 95.9 mtm-85 -88.02 -34.93 17.84 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 127.665 2.386 . . . . 0.0 112.733 177.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -60.33 -41.18 93.01 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 117.092 2.256 . . . . 0.0 117.092 162.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.12 -53.92 15.01 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 119.425 -2.047 . . . . 0.0 115.303 169.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 26.3 mt -75.71 -32.66 60.16 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 126.371 2.295 . . . . 0.0 115.863 -174.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.9 -33.08 86.07 Favored Glycine 0 N--CA 1.448 -0.521 0 O-C-N 120.363 -1.46 . . . . 0.0 110.153 166.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 27.4 m -80.7 -47.26 14.26 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.85 0.825 . . . . 0.0 111.743 -178.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.304 89.0 mtt180 -53.39 -24.43 12.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 167.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 39.8 t -68.24 -38.87 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 O-C-N 117.078 -3.514 . . . . 0.0 113.157 169.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 33.9 mtp180 -81.53 -1.7 47.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 123.772 0.829 . . . . 0.0 109.001 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . 0.425 HG23 HD23 ' C' ' 75' ' ' LEU . 79.9 mt -95.17 -52.05 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 O-C-N 119.678 -1.889 . . . . 0.0 108.495 170.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 37.4 t -46.64 -52.58 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 C-N-CA 128.282 2.633 . . . . 0.0 116.949 166.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -56.04 -47.46 77.81 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 122.25 1.024 . . . . 0.0 112.223 173.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -72.53 -18.62 61.63 Favored 'General case' 0 N--CA 1.452 -0.364 1 O-C-N 115.175 -4.703 . . . . 0.0 113.083 -171.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 60.3 mt -87.5 -31.76 19.79 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 118.384 -2.698 . . . . 0.0 108.313 173.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 24.3 mt -68.55 -10.81 58.14 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 118.507 -2.621 . . . . 0.0 114.358 160.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttm105 -104.32 -43.02 5.32 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 125.302 1.626 . . . . 0.0 113.084 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.11 2.16 60.89 Favored Glycine 0 C--N 1.336 0.583 0 O-C-N 119.238 -2.164 . . . . 0.0 112.497 158.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -89.26 -17.41 29.07 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 120.977 -1.308 . . . . 0.0 114.351 -166.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 10.7 mmt -56.08 125.89 23.57 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.409 1.483 . . . . 0.0 114.589 177.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . 0.285 55.4 p -78.14 166.64 22.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.932 2.02 . . . . 0.0 110.233 169.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -51.03 -29.88 13.89 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 116.555 2.057 . . . . 0.0 116.555 169.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 -65.74 -44.17 86.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 125.557 2.598 . . . . 0.0 107.788 172.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -75.56 -39.21 58.5 Favored 'General case' 0 N--CA 1.452 -0.336 1 O-C-N 116.027 -4.171 . . . . 0.0 111.572 -174.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 96.8 mt -56.76 -6.59 0.34 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 118.637 2.828 . . . . 0.0 118.637 166.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -112.1 -65.07 1.21 Allowed 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 125.551 1.782 . . . . 0.0 109.912 171.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -85.53 -9.73 56.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 112.96 -3.4 . . . . 0.0 115.892 -169.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -105.74 -45.81 4.3 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 128.71 2.804 . . . . 0.0 114.752 173.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . 0.425 HD23 HG23 ' C' ' 57' ' ' ILE . 5.2 mp -86.51 -12.06 49.92 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 116.865 -1.54 . . . . 0.0 111.659 177.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 58.51 -133.56 52.68 Favored Glycine 0 C--N 1.338 0.641 0 CA-C-N 120.6 1.545 . . . . 0.0 110.848 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.72 -23.78 9.99 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 126.687 2.051 . . . . 0.0 110.756 -162.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.07 -13.19 6.41 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 127.404 2.43 . . . . 0.0 117.382 167.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 19.2 tt -58.3 -39.63 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 1 O-C-N 116.181 -4.129 . . . . 0.0 115.501 175.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.91 -56.13 11.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 116.919 -1.515 . . . . 0.0 111.975 168.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . 0.337 28.3 m -55.57 -37.98 68.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 125.977 2.048 . . . . 0.0 113.889 -179.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 6.5 mm -70.58 -23.54 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-O 115.105 -2.378 . . . . 0.0 115.509 170.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 52.9 p -122.51 -17.86 6.85 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 129.71 3.204 . . . . 0.0 114.925 -164.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 74.3 mtp85 -104.05 149.44 25.18 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.883 3.673 . . . . 0.0 112.283 171.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 98.28 153.45 28.66 Favored Glycine 0 C--N 1.337 0.6 0 CA-C-N 121.216 1.826 . . . . 0.0 109.498 -176.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 4.3 m -75.66 9.92 2.02 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 128.522 2.729 . . . . 0.0 117.045 176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -118.89 -2.64 10.83 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.684 1.593 . . . . 0.0 115.072 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 80.1 p -45.75 166.84 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.01 1.324 . . . . 0.0 114.43 172.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 42.7 tp -56.37 -35.76 68.05 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.618 2.451 . . . . 0.0 117.618 -164.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -90.15 -25.2 20.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 126.785 2.034 . . . . 0.0 113.033 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.94 -12.66 59.36 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 125.581 1.801 . . . . 0.0 111.801 174.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.24 161.23 5.56 Favored Pre-proline 0 N--CA 1.45 -0.457 0 C-N-CA 128.625 2.77 . . . . 0.0 113.701 174.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -68.76 143.78 57.14 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 125.08 3.853 . . . . 0.0 112.411 177.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 81.0 t -54.47 -39.73 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 124.921 1.288 . . . . 0.0 114.439 -173.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 15.6 pm0 -63.85 -33.94 76.8 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 112.511 -3.614 . . . . 0.0 113.523 173.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 32.7 tp -71.16 -43.95 66.48 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 127.558 3.036 . . . . 0.0 116.261 172.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -63.69 -39.5 94.48 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 115.488 -2.196 . . . . 0.0 110.231 -174.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -81.69 -32.75 31.59 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 116.532 -1.699 . . . . 0.0 110.635 172.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.3 t90 -67.17 -42.93 83.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 122.598 2.454 . . . . 0.0 112.645 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 22.6 mt -66.5 -16.69 64.33 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 123.604 2.911 . . . . 0.0 114.116 172.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -78.8 -18.89 53.36 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.133 1.773 . . . . 0.0 111.507 172.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -100.18 -41.98 6.88 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 120.173 -1.579 . . . . 0.0 108.963 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 48.9 t -72.12 -62.05 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.492 1 C-N-CA 131.822 4.049 . . . . 0.0 114.54 176.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . 0.26 38.9 mt -77.65 -18.03 57.13 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 124.414 3.279 . . . . 0.0 109.796 -171.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 90.4 mt -117.66 50.84 1.09 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 121.039 1.745 . . . . 0.0 114.817 -169.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.257 17.3 pttp . . . . . 0 N--CA 1.451 -0.424 0 O-C-N 127.605 3.066 . . . . 0.0 112.591 -157.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . 0.451 ' HB2' ' HD2' ' D' ' 6' ' ' PRO . 78.0 p . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 122.572 1.177 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . 0.451 ' HD2' ' HB2' ' D' ' 5' ' ' SER . 68.8 Cg_endo -57.86 -30.8 90.72 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 122.935 2.423 . . . . 0.0 113.12 -175.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -148.57 142.91 26.23 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 129.189 2.995 . . . . 0.0 106.914 164.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 26.6 t -76.46 128.26 34.44 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 125.743 2.687 . . . . 0.0 112.263 -173.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.74 -20.86 37.75 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 118.075 -2.891 . . . . 0.0 114.288 165.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -83.76 -33.09 25.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 120.737 -1.227 . . . . 0.0 112.797 172.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 16.6 mmt -66.68 -42.81 85.94 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 118.404 -2.685 . . . . 0.0 112.531 173.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.9 -39.48 62.77 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 169.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -65.15 -55.31 19.41 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.471 -2.018 . . . . 0.0 107.466 176.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -50.92 -44.56 60.19 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.918 2.087 . . . . 0.0 109.331 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -11.25 47.8 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 124.425 3.284 . . . . 0.0 110.816 173.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -95.91 -19.28 19.67 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.974 -2.329 . . . . 0.0 108.754 168.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -86.36 -33.24 20.6 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.318 -3.364 . . . . 0.0 114.273 176.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -67.29 -33.0 74.37 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 126.637 3.113 . . . . 0.0 111.908 173.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -62.99 -51.14 67.99 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 112.782 -2.008 . . . . 0.0 112.682 168.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.64 -16.97 62.87 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.116 -2.24 . . . . 0.0 111.717 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 49.2 ttt-85 -84.1 -6.46 59.41 Favored 'General case' 0 N--CA 1.449 -0.523 1 O-C-N 116.083 -4.135 . . . . 0.0 118.628 161.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -76.06 -41.28 51.13 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 119.28 -2.137 . . . . 0.0 113.207 149.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 99.3 t -66.42 -39.66 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 O-C-N 121.189 -0.945 . . . . 0.0 113.413 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -64.78 -39.63 93.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 124.652 2.168 . . . . 0.0 114.674 174.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 63.5 tp -67.38 -40.59 85.73 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 118.878 -2.389 . . . . 0.0 115.117 173.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 39.6 tp -74.14 -41.6 61.29 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.31 1.844 . . . . 0.0 110.293 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -51.79 -57.81 8.24 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 163.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -63.0 -31.74 72.94 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 117.465 -1.255 . . . . 0.0 110.728 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.82 -38.0 80.77 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 120.839 1.654 . . . . 0.0 114.726 167.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -72.62 -14.82 61.69 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 130.43 3.492 . . . . 0.0 109.958 170.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . 0.315 47.8 mt-30 -87.48 -14.9 39.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 118.697 -2.502 . . . . 0.0 109.554 176.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . 0.418 ' ND2' HD12 ' D' ' 34' ' ' LEU 0.39 47.2 p30 -128.76 5.46 5.52 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 129.166 2.986 . . . . 0.0 115.911 179.303 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 62.66 25.49 15.15 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 124.439 2.066 . . . . 0.0 112.826 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . 0.418 HD12 ' ND2' ' D' ' 32' ' ' ASN . 44.2 mt -88.37 -8.0 55.76 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.279 -2.763 . . . . 0.0 114.927 170.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -49.03 -57.56 6.35 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 127.967 2.507 . . . . 0.0 115.382 -173.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.321 3.1 mt -53.18 -52.87 61.83 Favored Pre-proline 0 N--CA 1.447 -0.582 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 177.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -62.63 -15.27 45.13 Favored 'Trans proline' 0 N--CA 1.446 -1.317 0 C-N-CA 122.322 2.015 . . . . 0.0 113.406 176.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 47.0 tp -77.46 -43.54 32.0 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 125.592 3.814 . . . . 0.0 111.386 164.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . 0.498 HD13 ' CZ2' ' C' ' 19' ' ' TRP . 25.2 mt -57.94 -45.09 87.17 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 125.413 3.733 . . . . 0.0 111.844 171.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -73.03 -23.32 60.58 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 119.572 -0.851 . . . . 0.0 111.831 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 19.2 tp -78.69 -27.6 45.07 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.347 -2.095 . . . . 0.0 111.059 170.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 13.2 mmt -89.24 -41.09 12.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 119.602 -1.936 . . . . 0.0 114.444 -174.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt -117.03 147.26 42.49 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 125.847 2.736 . . . . 0.0 112.798 -171.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 30.4 p -74.09 156.27 87.83 Favored Pre-proline 0 N--CA 1.45 -0.443 0 C-N-CA 128.721 2.808 . . . . 0.0 108.675 172.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -44.57 -44.01 13.94 Favored 'Trans proline' 0 N--CA 1.451 -1.024 1 C-N-CA 126.967 5.111 . . . . 0.0 122.168 173.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.265 18.9 m-20 -71.21 -22.44 62.01 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 120.376 3.473 . . . . 0.0 120.376 170.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -75.71 -36.54 59.97 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 126.143 2.152 . . . . 0.0 112.864 164.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 25.5 mtm180 -67.46 -43.7 80.44 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 126.205 2.191 . . . . 0.0 109.306 171.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -70.01 -35.84 74.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -170.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.28 -32.87 73.33 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 174.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . 0.426 ' HA ' HD23 ' D' ' 51' ' ' LEU . 23.9 mt -77.79 -49.12 14.98 Favored 'General case' 0 N--CA 1.45 -0.451 1 O-C-N 115.388 -4.57 . . . . 0.0 114.113 -176.695 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -51.44 -37.25 39.84 Favored Glycine 0 C--N 1.335 0.507 0 CA-C-O 122.637 1.132 . . . . 0.0 113.906 164.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 86.9 m -72.33 -42.27 65.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 118.017 -3.049 . . . . 0.0 108.582 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -55.3 -23.15 21.87 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 121.579 3.918 . . . . 0.0 121.579 170.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 24.4 t -64.48 -33.5 63.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 172.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -89.02 -20.77 23.97 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 172.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . 0.414 HD13 HG21 ' D' ' 57' ' ' ILE . 17.9 mt -54.19 -49.65 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 118.748 -2.47 . . . . 0.0 111.506 158.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . 0.536 HG22 HD12 ' D' ' 82' ' ' ILE . 65.0 t -68.24 -47.57 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 CA-C-O 117.028 -1.463 . . . . 0.0 109.63 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -51.12 -48.32 61.77 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 119.446 3.128 . . . . 0.0 119.446 170.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -65.42 -24.79 67.29 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.074 2.25 . . . . 0.0 117.074 172.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 59.3 mt -68.27 -13.44 62.26 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 121.859 2.118 . . . . 0.0 113.178 168.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 80.0 mt -104.6 -36.49 7.47 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 114.914 -2.47 . . . . 0.0 105.005 -177.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -81.4 -39.08 25.52 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.643 2.377 . . . . 0.0 113.083 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 53.01 41.67 59.92 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 120.168 2.827 . . . . 0.0 120.168 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -119.62 -1.91 10.55 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 117.806 -3.173 . . . . 0.0 116.231 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 8.5 mmt -129.86 39.51 3.69 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 128.702 2.801 . . . . 0.0 118.105 169.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 26.1 p -81.01 -179.95 7.58 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 110.235 -3.166 . . . . 0.0 117.532 -168.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . 0.518 ' O ' ' HE2' ' D' ' 72' ' ' LYS . 6.0 tp-100 63.05 -105.43 0.16 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 169.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -63.84 -43.01 97.45 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.331 1.452 . . . . 0.0 110.92 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -86.81 -16.09 37.26 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 116.876 2.176 . . . . 0.0 116.876 -171.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.42 -31.85 58.14 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.652 1.215 . . . . 0.0 109.664 176.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . 0.518 ' HE2' ' O ' ' D' ' 68' ' ' GLN 0.303 38.6 mtmt -72.09 -45.97 58.58 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 114.58 -1.191 . . . . 0.0 113.052 166.255 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -86.49 -25.81 24.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 124.299 2.0 . . . . 0.0 115.582 -163.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -122.39 -45.44 2.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 120.775 -1.203 . . . . 0.0 111.695 -171.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -69.46 -42.51 74.79 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.15 -2.844 . . . . 0.0 110.08 166.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.47 -167.22 18.86 Favored Glycine 0 C--N 1.339 0.742 0 CA-C-N 125.694 3.861 . . . . 0.0 122.273 155.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.71 -19.83 64.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.569 -1.548 . . . . 0.0 114.578 -164.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.45 -17.23 5.85 Favored Glycine 0 N--CA 1.446 -0.644 0 O-C-N 119.278 -2.139 . . . . 0.0 118.261 166.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 10.0 tt -52.5 -33.06 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 125.752 1.621 . . . . 0.0 108.032 -177.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -86.28 -12.48 49.39 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.736 2.414 . . . . 0.0 111.522 -173.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.3 m -79.75 -25.06 41.17 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 124.999 2.333 . . . . 0.0 114.004 165.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . 0.536 HD12 HG22 ' D' ' 58' ' ' VAL . 26.1 mm -100.11 -31.45 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 130.219 3.408 . . . . 0.0 115.215 -163.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 81.6 p -117.21 -2.73 11.58 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 126.348 2.28 . . . . 0.0 114.776 174.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.354 28.5 mtp85 -121.29 175.1 6.31 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 122.447 1.118 . . . . 0.0 112.872 167.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.99 160.96 27.67 Favored Glycine 0 N--CA 1.445 -0.706 0 O-C-N 118.054 -2.904 . . . . 0.0 114.165 -155.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 77.5 p -71.62 -42.01 68.17 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 118.759 -2.613 . . . . 0.0 112.968 -147.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -118.75 63.92 0.77 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.476 2.71 . . . . 0.0 106.652 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . 0.266 3.1 p -73.46 -175.46 1.97 Allowed 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 117.424 2.379 . . . . 0.0 117.424 173.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.27 5.5 tp -54.76 -32.95 60.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 113.187 -3.292 . . . . 0.0 111.446 162.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -72.44 -2.14 18.36 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.005 2.691 . . . . 0.0 114.03 174.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -124.28 -23.72 4.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 116.359 -1.781 . . . . 0.0 113.76 -171.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . 0.292 . . 63.3 94.37 0.05 OUTLIER Pre-proline 0 N--CA 1.447 -0.576 0 CA-C-N 121.671 2.032 . . . . 0.0 112.226 148.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.324 32.1 Cg_exo 33.81 32.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 129.216 0.923 . . . . 0.0 114.351 36.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 88.0 t -56.51 -17.74 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 C-N-CA 127.988 2.515 . . . . 0.0 110.022 176.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.285 0.1 OUTLIER -92.31 -49.36 6.2 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 117.984 -2.948 . . . . 0.0 112.899 -173.739 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . 0.422 HD21 HD22 ' C' ' 41' ' ' LEU . 54.2 tp -38.38 -53.16 1.53 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 128.138 3.399 . . . . 0.0 109.531 150.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 31.7 ttp180 -65.87 -50.99 62.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 122.977 1.37 . . . . 0.0 111.856 -167.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.99 -28.05 15.55 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.137 -1.392 . . . . 0.0 113.726 170.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 45.6 t90 -85.61 -43.51 13.41 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -177.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.52 -38.86 69.79 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 125.614 1.821 . . . . 0.0 108.974 166.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -72.67 -14.82 61.67 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.873 1.321 . . . . 0.0 112.826 -177.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -94.2 -46.05 7.25 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.983 -2.323 . . . . 0.0 111.724 169.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 97.7 t -68.0 -27.92 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 O-C-N 119.345 -2.097 . . . . 0.0 113.869 177.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 82.6 mt -108.78 -18.87 13.6 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 122.055 2.207 . . . . 0.0 114.369 -171.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 4.6 mp -105.96 23.81 13.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.094 -2.879 . . . . 0.0 108.506 168.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 16.8 pttp -61.19 169.13 2.23 Favored 'General case' 0 N--CA 1.448 -0.534 1 C-N-CA 132.419 4.288 . . . . 0.0 113.342 -172.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 45.5 m -49.73 -45.56 49.4 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 110.654 -2.975 . . . . 0.0 114.557 -170.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 113.362 -3.208 . . . . 0.0 116.089 177.354 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . 0.253 16.5 tpt . . . . . 0 N--CA 1.45 -0.434 0 N-CA-C 106.509 -1.663 . . . . 0.0 106.509 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -27.93 65.11 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 111.933 -3.889 . . . . 0.0 112.391 166.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -73.64 -38.75 64.91 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 126.517 2.386 . . . . 0.0 111.116 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -59.98 -42.14 93.52 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 127.163 2.79 . . . . 0.0 111.147 171.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -68.65 -34.39 75.64 Favored 'General case' 0 N--CA 1.448 -0.555 1 O-C-N 115.75 -4.344 . . . . 0.0 114.096 170.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.6 t60 -64.86 -32.58 74.35 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 121.993 2.179 . . . . 0.0 114.6 171.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -67.36 -35.72 79.93 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 174.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -75.28 -30.08 60.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.262 -2.149 . . . . 0.0 109.104 -175.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -76.45 -40.52 50.27 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 119.707 1.139 . . . . 0.0 111.096 172.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 20' ' ' LEU . 51.3 mt -71.96 -15.81 62.08 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.476 -1.39 . . . . 0.0 109.68 -171.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.2 ttt180 -54.03 -57.39 11.23 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 120.162 -1.586 . . . . 0.0 113.582 167.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.591 ' CE1' HD22 ' A' ' 26' ' ' LEU . 77.5 t80 -49.89 -35.15 22.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 120.41 1.459 . . . . 0.0 114.427 168.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.0 t -67.42 -51.83 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 121.225 -0.922 . . . . 0.0 112.533 -175.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -71.46 -23.72 61.88 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 125.435 2.541 . . . . 0.0 110.787 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.0 tp -75.13 -43.58 51.83 Favored 'General case' 0 N--CA 1.451 -0.41 1 O-C-N 114.244 -5.285 . . . . 0.0 108.307 173.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.591 HD22 ' CE1' ' A' ' 22' ' ' PHE . 20.9 tp -64.66 -31.03 72.07 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 116.639 -1.648 . . . . 0.0 110.103 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -57.01 -58.07 9.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 127.599 3.062 . . . . 0.0 109.13 173.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -60.57 -37.79 82.45 Favored 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 117.496 -3.253 . . . . 0.0 108.432 175.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.87 -41.31 83.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.716 -3.115 . . . . 0.0 113.569 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.487 ' CE1' ' HB2' ' B' ' 27' ' ' LYS . 16.9 m-85 -61.44 -35.99 79.13 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 124.708 3.413 . . . . 0.0 112.186 172.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.316 84.6 mt-30 -62.78 -16.65 58.93 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 119.448 -2.033 . . . . 0.0 115.139 173.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -124.38 18.84 8.95 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 127.627 2.371 . . . . 0.0 116.52 -176.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 41.32 33.24 0.25 Allowed 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 -165.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.1 mt -91.11 -5.8 54.6 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.577 2.751 . . . . 0.0 114.005 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -68.54 -41.42 79.86 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 113.405 -3.188 . . . . 0.0 113.923 -167.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 36' ' ' LEU 0.28 39.9 mt -61.9 -50.77 79.65 Favored Pre-proline 0 N--CA 1.448 -0.542 0 O-C-N 126.3 2.25 . . . . 0.0 112.593 165.285 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . 0.261 84.8 Cg_exo -51.25 -39.73 61.91 Favored 'Trans proline' 0 N--CA 1.451 -1.004 1 C-N-CA 127.94 5.76 . . . . 0.0 113.256 174.811 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.4 tp -81.39 -36.23 29.79 Favored 'General case' 0 N--CA 1.449 -0.522 1 O-C-N 115.153 -4.717 . . . . 0.0 111.643 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.9 mt -74.5 -30.54 61.85 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 126.14 1.776 . . . . 0.0 115.517 -177.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -66.75 -30.05 70.17 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 125.972 2.045 . . . . 0.0 113.625 163.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tt -69.72 -48.15 60.59 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 127.614 2.366 . . . . 0.0 111.019 173.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 80.4 mmm -91.44 -11.42 37.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.124 -2.86 . . . . 0.0 115.243 -162.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.8 mt -130.34 136.62 49.3 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 128.04 2.536 . . . . 0.0 110.714 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.2 p -94.49 157.97 36.36 Favored Pre-proline 0 N--CA 1.448 -0.555 0 O-C-N 119.154 -2.216 . . . . 0.0 112.393 176.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -47.89 -39.79 32.12 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.566 2.177 . . . . 0.0 116.135 -169.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . 0.288 5.3 p-10 -72.77 -18.89 61.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 129.121 2.968 . . . . 0.0 112.528 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -97.01 -32.53 11.95 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.884 1.274 . . . . 0.0 108.356 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.2 mtm-85 -69.54 -44.37 71.1 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 119.919 -1.738 . . . . 0.0 112.763 173.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -68.82 -14.56 63.1 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 112.043 -3.837 . . . . 0.0 112.158 166.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.45 -46.99 62.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 123.553 2.888 . . . . 0.0 113.035 164.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.06 -42.2 73.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 118.834 -2.416 . . . . 0.0 110.551 -173.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.26 -42.58 82.89 Favored Glycine 0 C--N 1.333 0.405 0 O-C-N 117.113 -3.492 . . . . 0.0 114.484 167.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.5 m -68.82 -33.15 73.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 124.064 1.887 . . . . 0.0 112.861 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.21 -24.12 67.04 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 116.746 2.128 . . . . 0.0 116.746 178.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.332 5.0 t -61.99 -39.6 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-O 117.171 -1.395 . . . . 0.0 108.138 172.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -70.53 -31.79 69.0 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 121.257 1.844 . . . . 0.0 113.687 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 95.3 mt -64.14 -48.92 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 117.126 -1.416 . . . . 0.0 107.895 176.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.1 t -61.89 -41.56 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-O 115.776 -2.059 . . . . 0.0 112.637 170.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -58.4 -53.2 61.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 123.372 2.806 . . . . 0.0 112.023 174.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -67.15 -26.4 66.65 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.316 76.6 mt -81.93 -35.87 28.66 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.101 2.96 . . . . 0.0 112.151 173.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 tp -72.12 -45.75 59.33 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 114.418 -2.706 . . . . 0.0 113.292 171.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -53.24 -55.66 22.69 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 120.61 1.55 . . . . 0.0 110.375 163.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.81 -0.8 89.39 Favored Glycine 0 C--N 1.333 0.391 0 CA-C-O 116.561 -2.244 . . . . 0.0 114.503 171.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -75.39 -4.92 42.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 120.437 3.495 . . . . 0.0 120.437 -176.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 94.6 mtp -106.2 155.83 19.07 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 129.252 3.021 . . . . 0.0 113.901 167.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 60.4 p -83.63 156.67 22.58 Favored 'General case' 0 N--CA 1.447 -0.615 0 O-C-N 124.476 1.11 . . . . 0.0 112.647 164.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -42.82 -39.8 2.64 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 120.573 -1.33 . . . . 0.0 111.429 166.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.8 tpt85 -79.77 -23.49 42.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 115.656 -2.116 . . . . 0.0 110.96 -175.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -76.12 -31.93 58.91 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 121.954 2.161 . . . . 0.0 112.99 168.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.8 mt -68.14 -31.39 70.94 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 124.39 2.043 . . . . 0.0 114.863 175.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -50.94 -54.39 24.66 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 117.55 -3.219 . . . . 0.0 108.83 174.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -59.2 -38.04 78.91 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.923 1.082 . . . . 0.0 113.923 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -70.56 -32.6 70.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 119.448 -2.033 . . . . 0.0 110.307 -177.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 74.3 mt -119.44 -26.45 5.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -156.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 81.77 -28.29 3.21 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 120.469 2.948 . . . . 0.0 120.469 174.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.6 163.83 25.89 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 120.226 -1.749 . . . . 0.0 110.058 -173.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.28 140.85 34.59 Favored Glycine 0 C--N 1.339 0.702 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -177.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.346 89.1 mt -53.07 -27.38 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-O 116.104 -1.903 . . . . 0.0 111.757 -178.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.42 -36.15 53.7 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 120.163 1.347 . . . . 0.0 111.064 175.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 56.5 p -80.9 -23.88 38.66 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 119.614 -1.929 . . . . 0.0 110.922 -173.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 50.0 mm -78.81 -42.5 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 C-N-CA 127.529 2.332 . . . . 0.0 108.999 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.4 m -67.89 -33.95 75.71 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.837 1.255 . . . . 0.0 108.477 177.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.1 ttt180 -61.55 -46.65 89.0 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 121.796 -0.565 . . . . 0.0 110.762 172.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.28 -26.82 74.27 Favored Glycine 0 C--N 1.334 0.426 0 CA-C-O 117.065 -1.964 . . . . 0.0 113.487 175.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 58.1 m -63.54 -40.29 96.62 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.261 1.825 . . . . 0.0 110.789 174.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -68.88 -43.86 74.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 116.988 -1.482 . . . . 0.0 113.96 169.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.0 m -63.26 -25.87 68.52 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 127.21 2.204 . . . . 0.0 106.666 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.0 tp -85.44 -32.35 22.35 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 117.117 -3.489 . . . . 0.0 115.901 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -78.28 -38.0 43.61 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.875 2.07 . . . . 0.0 109.069 -173.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.56 -13.03 60.34 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 129.743 3.217 . . . . 0.0 116.132 167.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.82 126.72 92.25 Favored Pre-proline 0 N--CA 1.449 -0.48 0 C-N-CA 131.088 3.755 . . . . 0.0 107.771 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -59.93 152.48 64.12 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 O-C-N 128.209 3.742 . . . . 0.0 115.298 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -34.88 67.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 CA-C-O 116.395 -1.764 . . . . 0.0 111.086 -173.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 95' ' ' GLU . 8.6 pm0 -71.83 -18.07 62.1 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 122.174 2.261 . . . . 0.0 111.896 -178.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 13.6 tp -85.52 -36.35 20.56 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 58.2 mtm-85 -82.41 -35.06 28.0 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 117.545 -3.222 . . . . 0.0 115.934 -171.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -69.58 -6.06 28.59 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.095 1.758 . . . . 0.0 114.148 165.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 40.3 t90 -98.97 -48.34 4.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 117.996 2.591 . . . . 0.0 117.996 166.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.0 mt -61.59 -32.7 72.82 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 120.015 -1.678 . . . . 0.0 111.589 177.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.93 -22.63 65.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 122.608 2.458 . . . . 0.0 115.992 172.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -93.9 -7.7 42.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 118.799 -2.438 . . . . 0.0 113.381 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 54.1 t -118.95 -25.36 2.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 127.456 2.972 . . . . 0.0 113.905 -175.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 68.5 mt -103.57 -39.34 6.76 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 118.587 -2.571 . . . . 0.0 116.308 167.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.2 mt -88.57 -33.61 17.64 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 119.84 -1.787 . . . . 0.0 115.318 -175.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.3 tttt . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 117.448 -1.263 . . . . 0.0 113.73 -166.303 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.307 . . . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 16.5 mmt -74.85 -28.22 60.58 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -174.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.19 75.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 168.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.8 -39.52 66.62 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.787 2.835 . . . . 0.0 114.537 165.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 8.9 tp60 -57.47 -44.03 84.52 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 119.938 -1.726 . . . . 0.0 112.313 171.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 51.7 mmt-85 -74.42 -29.0 61.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 120.926 1.694 . . . . 0.0 112.336 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -75.27 -39.64 59.57 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 117.991 -2.943 . . . . 0.0 113.943 170.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -64.72 -38.81 92.27 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 129.216 3.006 . . . . 0.0 109.384 169.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -70.19 -36.67 74.78 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 119.108 -2.245 . . . . 0.0 111.591 178.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -63.65 -50.15 70.42 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 116.567 -1.683 . . . . 0.0 109.105 170.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 82.6 mt -64.66 -14.2 57.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 122.131 2.241 . . . . 0.0 113.525 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -56.41 -54.17 48.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 128.56 2.744 . . . . 0.0 108.33 171.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -65.39 -52.24 54.91 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.528 0.731 . . . . 0.0 111.692 -178.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . 0.256 4.2 t -44.19 -48.98 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 126.221 1.808 . . . . 0.0 111.642 178.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -73.44 -41.8 62.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 128.448 3.592 . . . . 0.0 109.282 -171.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 33.8 tp -64.53 -43.7 93.17 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.37 176.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 41.1 tp -65.02 -32.88 74.82 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 120.694 -1.254 . . . . 0.0 114.008 171.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.487 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 57.7 tttt -64.14 -41.48 97.18 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.486 -2.009 . . . . 0.0 112.43 171.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -58.35 -39.15 78.75 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 123.015 2.643 . . . . 0.0 112.811 166.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.8 -33.4 62.22 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.539 -1.35 . . . . 0.0 113.281 -176.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -54.75 -47.7 73.54 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.94 2.096 . . . . 0.0 112.732 169.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -70.77 -6.31 36.65 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.286 1.834 . . . . 0.0 114.426 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -119.86 23.64 10.97 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.556 1.942 . . . . 0.0 113.004 170.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 34.79 48.18 0.3 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 128.372 2.669 . . . . 0.0 110.277 -173.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 33.9 mt -121.63 16.61 11.16 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.445 -1.252 . . . . 0.0 113.098 174.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -71.8 -37.95 70.31 Favored 'General case' 0 N--CA 1.452 -0.357 1 O-C-N 115.444 -4.535 . . . . 0.0 111.144 -176.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 43.0 tp -62.13 -55.75 37.71 Favored Pre-proline 0 N--CA 1.449 -0.518 0 CA-C-O 114.587 -2.625 . . . . 0.0 111.454 177.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -65.23 -20.52 62.51 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 CA-C-N 122.707 2.002 . . . . 0.0 111.696 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 27.7 tp -79.1 -32.85 44.76 Favored 'General case' 0 N--CA 1.451 -0.417 1 CA-C-O 111.56 -4.067 . . . . 0.0 113.047 172.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 59.1 mt -71.08 -32.87 69.64 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 125.603 1.814 . . . . 0.0 107.756 173.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -80.31 -10.2 59.75 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 117.38 2.363 . . . . 0.0 117.38 176.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.3 tp -91.58 -33.42 15.14 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 118.097 -2.877 . . . . 0.0 111.31 160.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 16.2 mmt -85.0 -18.18 35.24 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 128.548 3.655 . . . . 0.0 116.226 -175.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 6.2 mp -126.97 147.77 50.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.21 1.804 . . . . 0.0 112.312 176.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 18.5 p -75.82 165.52 52.63 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-O 112.305 -3.712 . . . . 0.0 116.44 176.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -58.65 -14.57 22.07 Favored 'Trans proline' 0 N--CA 1.45 -1.042 0 O-C-N 126.371 2.774 . . . . 0.0 116.385 174.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -90.19 -46.37 8.48 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 126.195 1.798 . . . . 0.0 113.218 175.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -67.43 -26.59 66.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 117.115 -1.421 . . . . 0.0 114.448 -178.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -60.12 -42.55 94.99 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 125.656 1.848 . . . . 0.0 110.81 172.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -65.35 -27.75 68.8 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 112.141 -2.3 . . . . 0.0 116.148 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.5 -45.97 12.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 118.256 -2.778 . . . . 0.0 110.748 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.99 -34.22 77.28 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.511 -1.993 . . . . 0.0 110.176 -179.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.79 -23.78 72.59 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 118.361 2.104 . . . . 0.0 118.361 170.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 74.7 m -87.9 -25.6 23.16 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.799 2.04 . . . . 0.0 112.803 174.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 42.4 mtt180 -64.5 -24.99 67.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 117.711 2.485 . . . . 0.0 117.711 161.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.02 -41.97 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 120.179 1.354 . . . . 0.0 107.671 175.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 -59.61 -43.84 93.64 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 112.897 -3.43 . . . . 0.0 110.502 176.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 56.5 mt -61.57 -47.76 91.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 123.116 2.689 . . . . 0.0 107.129 -177.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.298 69.2 t -62.18 -33.31 58.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 120.156 1.344 . . . . 0.0 111.766 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -69.45 -43.23 73.7 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 118.654 -2.529 . . . . 0.0 113.176 173.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -72.4 -36.82 68.74 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 119.417 -2.052 . . . . 0.0 114.118 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 12.7 mt -52.18 -28.06 16.79 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.352 0.596 . . . . 0.0 112.568 165.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 23.4 mt -92.18 -21.94 20.1 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 117.831 -3.043 . . . . 0.0 118.381 174.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . 0.429 HH21 ' CG ' ' B' ' 108' ' ' ASP . 5.1 ttm105 -88.89 -43.58 11.08 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.833 2.053 . . . . 0.0 105.516 -166.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.99 49.95 31.74 Favored Glycine 0 CA--C 1.524 0.632 0 CA-C-O 117.422 -1.765 . . . . 0.0 116.294 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -116.75 -36.13 3.98 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 119.811 1.805 . . . . 0.0 108.746 -177.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 27.0 mtt -73.33 139.56 46.13 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 126.357 2.98 . . . . 0.0 111.43 -175.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -81.79 170.65 15.46 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 118.973 -2.329 . . . . 0.0 109.438 163.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -59.97 -17.43 38.1 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 117.135 -3.478 . . . . 0.0 110.446 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 48.1 ttt-85 -82.04 -48.39 11.47 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.676 2.39 . . . . 0.0 106.94 -173.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -71.24 -49.28 44.94 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 114.157 -2.83 . . . . 0.0 112.162 178.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 83.0 mt -47.66 -43.27 26.1 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 121.296 1.862 . . . . 0.0 109.279 173.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -61.14 -20.11 62.31 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 119.271 -2.143 . . . . 0.0 113.229 178.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -118.21 -54.22 2.31 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 124.907 3.503 . . . . 0.0 116.785 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.03 -24.56 64.61 Favored 'General case' 0 N--CA 1.446 -0.653 1 C-N-CA 132.142 4.177 . . . . 0.0 113.371 -177.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 60.0 mt -131.28 -3.96 3.86 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 113.274 -1.784 . . . . 0.0 113.258 172.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.9 21.28 67.45 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 126.558 2.028 . . . . 0.0 116.603 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.55 110.85 22.43 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 118.608 -2.701 . . . . 0.0 108.959 -163.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.19 176.53 48.7 Favored Glycine 0 CA--C 1.523 0.565 0 O-C-N 118.811 -2.431 . . . . 0.0 117.289 168.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 14.4 mm -53.51 -48.32 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.725 0 CA-C-O 117.751 -1.118 . . . . 0.0 111.869 -166.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.82 -33.98 69.18 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 122.059 2.209 . . . . 0.0 112.977 -177.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 54.1 m -75.93 -48.52 20.9 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.38 3.072 . . . . 0.0 111.213 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 18.9 mm -53.96 -35.94 29.65 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 O-C-N 118.366 -2.709 . . . . 0.0 108.385 167.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 5.3 m -75.64 -27.61 58.46 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 117.17 -1.395 . . . . 0.0 112.917 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -63.69 -48.89 75.31 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 122.7 2.5 . . . . 0.0 110.321 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -76.94 -32.07 50.89 Favored Glycine 0 CA--C 1.525 0.682 0 CA-C-O 118.132 -1.371 . . . . 0.0 112.701 -167.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 89.1 p -68.46 -40.58 81.01 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -61.45 -41.46 97.24 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 118.826 -2.421 . . . . 0.0 110.185 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.6 m -77.94 -24.69 48.12 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 112.391 -3.671 . . . . 0.0 110.127 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.57 -36.66 44.22 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 127.113 2.758 . . . . 0.0 116.917 170.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -60.71 -45.44 94.22 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 125.26 2.457 . . . . 0.0 111.46 169.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . 0.31 . . -71.2 -17.21 62.53 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 118.222 -2.799 . . . . 0.0 117.62 173.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' B' ' 93' ' ' PRO . . . -72.56 160.17 83.49 Favored Pre-proline 0 N--CA 1.45 -0.451 0 O-C-N 119.906 -1.746 . . . . 0.0 112.548 172.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' B' ' 92' ' ' ALA . 86.0 Cg_exo -67.32 155.75 69.17 Favored 'Trans proline' 0 N--CA 1.447 -1.222 1 C-N-CA 127.942 5.761 . . . . 0.0 118.436 175.165 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.277 12.9 m -65.81 -36.3 77.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 119.262 0.937 . . . . 0.0 113.452 -177.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.332 7.8 pm0 -59.57 -27.75 66.52 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 -177.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 24.7 tp -83.16 -46.6 12.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.569 1.548 . . . . 0.0 109.41 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 64.8 mtp85 -57.47 -27.3 62.37 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 175.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -99.32 -8.75 24.47 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 174.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -75.01 -62.59 1.5 Allowed 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 127.968 2.507 . . . . 0.0 105.78 168.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 83.2 mt -57.77 -31.74 66.81 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 131.391 3.876 . . . . 0.0 109.029 -169.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -69.62 -43.13 73.34 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 124.267 3.212 . . . . 0.0 111.326 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -71.85 -48.15 48.08 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 124.871 2.272 . . . . 0.0 108.565 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 65.2 t -60.31 -50.03 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 113.481 -1.691 . . . . 0.0 111.455 -170.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 13.5 mt -76.16 -54.56 6.63 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 127.862 3.696 . . . . 0.0 115.399 176.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 60.6 mt -76.6 -36.6 57.42 Favored 'General case' 0 N--CA 1.45 -0.44 1 O-C-N 114.431 -5.168 . . . . 0.0 116.907 -165.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -80.19 -5.88 56.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 112.518 -3.611 . . . . 0.0 108.408 177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 70.6 m -105.73 -10.25 16.85 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 128.398 2.679 . . . . 0.0 109.701 -178.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . 0.429 ' CG ' HH21 ' B' ' 63' ' ' ARG . 9.8 t70 . . . . . 0 C--O 1.25 1.11 0 C-N-CA 129.834 3.253 . . . . 0.0 115.346 -173.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 15.7 mtt . . . . . 0 N--CA 1.472 0.639 0 CA-C-O 123.816 1.769 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.42 147.4 30.99 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 112.587 -2.097 . . . . 0.0 114.747 -178.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -140.67 156.91 46.11 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.854 2.461 . . . . 0.0 113.204 165.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -122.21 164.8 17.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.995 1.718 . . . . 0.0 108.885 175.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 42.9 p -127.99 153.97 78.38 Favored Pre-proline 0 N--CA 1.451 -0.398 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.94 -38.21 93.07 Favored 'Trans proline' 0 N--CA 1.447 -1.261 0 O-C-N 125.69 2.416 . . . . 0.0 116.976 172.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -149.82 148.59 29.36 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 124.72 2.2 . . . . 0.0 110.605 175.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.1 t -145.46 133.79 21.78 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.286 -2.759 . . . . 0.0 114.556 170.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.64 -26.43 59.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 112.95 -3.405 . . . . 0.0 107.806 175.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.33 -34.63 78.77 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 125.853 3.933 . . . . 0.0 110.044 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 18.4 mtt -82.32 -34.48 28.55 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 125.338 1.649 . . . . 0.0 114.84 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.62 -38.82 82.36 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 125.576 1.551 . . . . 0.0 114.337 164.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -67.29 -33.13 74.65 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.619 1.568 . . . . 0.0 112.659 167.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -59.08 -40.98 86.93 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 119.206 -2.184 . . . . 0.0 111.46 167.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -21.52 65.1 Favored 'General case' 0 N--CA 1.449 -0.506 1 O-C-N 114.635 -5.041 . . . . 0.0 117.792 169.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -76.82 -46.56 24.4 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 120.888 -1.132 . . . . 0.0 113.205 177.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -53.92 -23.15 11.91 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 119.191 3.034 . . . . 0.0 119.191 159.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -81.75 -45.13 16.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 127.329 2.251 . . . . 0.0 106.375 171.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 23.8 t-105 -66.9 -37.11 83.75 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 118.072 -2.893 . . . . 0.0 112.406 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' C' ' 20' ' ' LEU . 1.9 mp -73.03 -27.6 61.86 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 127.11 2.756 . . . . 0.0 111.281 -176.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 27.1 ttt180 -75.38 -35.23 61.12 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 119.33 -2.106 . . . . 0.0 113.151 172.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -61.06 -42.38 98.38 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 169.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.368 76.0 t -54.81 -61.99 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 CA-C-O 117.097 -1.43 . . . . 0.0 108.921 167.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -53.24 -43.35 67.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 117.834 2.531 . . . . 0.0 117.834 178.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 60.9 tp -45.17 -55.07 6.11 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 127.721 2.408 . . . . 0.0 112.268 176.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 25.6 tp -67.25 -27.01 66.86 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 119.641 -1.912 . . . . 0.0 114.825 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -56.43 -50.56 71.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 119.398 -2.064 . . . . 0.0 110.302 166.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -68.65 -8.73 44.94 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 119.821 -1.799 . . . . 0.0 112.086 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.17 -20.77 17.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 -178.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -76.0 -22.89 55.34 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-O 125.796 2.712 . . . . 0.0 115.123 164.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . 0.305 45.7 tt0 -62.07 -16.37 51.66 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 129.598 3.159 . . . . 0.0 116.582 169.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -147.24 6.01 0.85 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.263 3.6 m-20 59.16 29.98 19.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 118.228 2.677 . . . . 0.0 118.228 -173.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 96.9 mt -82.31 7.52 13.72 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 118.679 -2.513 . . . . 0.0 114.536 162.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 7.0 p-80 -59.33 -44.99 92.56 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 119.121 3.008 . . . . 0.0 119.121 173.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.323 6.5 mt -60.25 -55.44 45.29 Favored Pre-proline 0 N--CA 1.452 -0.352 0 O-C-N 125.085 1.491 . . . . 0.0 110.312 175.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -54.35 -50.62 12.86 Favored 'Trans proline' 0 N--CA 1.445 -1.329 0 C-N-CA 123.488 2.792 . . . . 0.0 113.12 174.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 56.6 tp -55.4 -30.53 60.58 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 173.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.387 15.3 mt -94.92 -18.48 21.08 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 122.496 2.407 . . . . 0.0 114.187 177.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -67.24 -26.18 66.46 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.596 -1.192 . . . . 0.0 111.635 161.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 19.9 tp -77.5 -52.54 8.9 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.638 2.375 . . . . 0.0 114.708 170.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 49.2 mmm -78.72 -15.8 58.01 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 117.117 -1.421 . . . . 0.0 113.752 -164.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 7.8 mp -121.29 144.45 48.62 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 130.669 3.588 . . . . 0.0 113.523 -175.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 55.7 p -75.42 157.13 84.94 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-N 122.26 2.3 . . . . 0.0 113.356 164.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -57.88 -34.1 97.88 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 CA-C-N 121.52 1.578 . . . . 0.0 110.872 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.74 -41.18 94.84 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.868 172.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -67.83 -31.49 71.38 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.652 1.181 . . . . 0.0 112.309 176.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . 0.433 ' HD2' ' CE2' ' D' ' 19' ' ' TRP . 85.8 mtm-85 -69.75 -44.08 70.94 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.067 2.147 . . . . 0.0 110.888 175.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . 0.254 40.5 tt0 -68.89 -22.65 64.17 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 127.967 2.507 . . . . 0.0 114.34 168.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.51 -28.76 64.13 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 121.62 2.009 . . . . 0.0 110.704 173.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 57.2 mt -74.75 -46.11 39.47 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 118.424 2.75 . . . . 0.0 118.424 177.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.49 -43.8 36.26 Favored Glycine 0 CA--C 1.526 0.766 0 O-C-N 126.482 2.364 . . . . 0.0 110.532 169.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 99.6 m -59.59 -55.92 28.45 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.576 1.95 . . . . 0.0 109.958 178.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -57.69 -42.03 82.86 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 115.5 -2.19 . . . . 0.0 113.504 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 50.2 t -58.59 -36.02 57.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 CA-C-N 124.464 3.302 . . . . 0.0 114.671 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -80.82 -30.91 35.73 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 113.536 -1.666 . . . . 0.0 110.788 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . 0.417 HG12 ' HG ' ' C' ' 75' ' ' LEU 0.325 7.9 mt -60.16 -51.67 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 1 O-C-N 115.6 -4.438 . . . . 0.0 110.755 165.039 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . 0.267 62.5 t -49.08 -55.81 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 C-N-CA 125.488 1.515 . . . . 0.0 113.484 174.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -49.05 -45.71 43.31 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.338 1.855 . . . . 0.0 114.672 174.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . 0.265 29.9 mm-40 -78.83 -11.01 59.98 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 123.179 1.466 . . . . 0.0 114.882 -174.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 46.2 mt -101.53 -4.5 26.63 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 115.21 -2.329 . . . . 0.0 108.847 168.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.53 -39.95 11.08 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 114.362 -2.732 . . . . 0.0 113.222 166.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 7.9 ttm105 -67.38 -31.62 71.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 126.139 2.15 . . . . 0.0 113.664 167.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.84 17.23 73.12 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-N 113.71 -1.587 . . . . 0.0 116.746 171.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -97.94 -2.02 41.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 121.644 2.722 . . . . 0.0 112.03 -160.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 19.1 mmt -79.38 136.7 37.05 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 124.851 1.344 . . . . 0.0 108.547 -177.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 65.7 p -90.33 174.8 7.38 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 129.274 3.029 . . . . 0.0 113.001 166.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -57.93 -40.49 80.56 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -173.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 39.0 ttp-105 -57.17 -46.25 82.97 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 126.155 1.782 . . . . 0.0 109.417 173.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -80.42 -22.29 41.34 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 119.724 -1.86 . . . . 0.0 111.279 -170.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 16.3 mt -73.25 -21.14 60.69 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.038 -2.914 . . . . 0.0 110.799 172.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -89.06 -54.64 4.02 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.894 -2.379 . . . . 0.0 112.382 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -72.55 -49.04 35.32 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 125.191 1.557 . . . . 0.0 111.835 -172.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -73.31 -38.87 65.69 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 115.909 -1.996 . . . . 0.0 115.993 177.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . 0.417 ' HG ' HG12 ' C' ' 57' ' ' ILE . 8.0 mp -97.0 -30.86 12.83 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 120.77 3.618 . . . . 0.0 120.77 -171.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.18 -160.37 31.38 Favored Glycine 0 C--N 1.337 0.608 0 CA-C-O 124.021 1.901 . . . . 0.0 114.844 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.84 -21.58 59.18 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 116.998 2.221 . . . . 0.0 116.998 -175.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.53 -12.71 9.83 Favored Glycine 0 CA--C 1.522 0.531 0 C-N-CA 128.858 3.123 . . . . 0.0 117.204 173.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 16.8 tt -54.11 -38.09 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 161.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.86 -46.35 89.58 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 113.915 -2.945 . . . . 0.0 110.858 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 40.6 m -50.68 -32.54 19.57 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 129.603 3.161 . . . . 0.0 115.669 166.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.298 52.0 mm -89.18 -10.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 119.441 -2.037 . . . . 0.0 114.073 177.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 39.8 p -136.67 5.1 2.87 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 118.285 -1.366 . . . . 0.0 114.215 -161.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 52.5 mtp85 -126.43 158.98 34.58 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 123.433 1.587 . . . . 0.0 110.723 169.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.64 163.37 31.36 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-O 117.155 -1.914 . . . . 0.0 115.118 -178.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . 0.317 20.0 m -67.55 -12.88 61.39 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 127.334 2.432 . . . . 0.0 117.048 -167.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . 0.268 63.2 m-80 -99.83 -1.81 36.59 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 112.013 -2.358 . . . . 0.0 114.153 -179.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 52.7 p -70.06 167.0 18.58 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 121.101 1.773 . . . . 0.0 110.395 -174.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 27.2 tp -56.45 -29.53 61.78 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -161.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 45.3 mttt -99.54 -4.8 30.39 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 118.786 -2.446 . . . . 0.0 116.164 170.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.33 -23.9 22.14 Favored 'General case' 0 N--CA 1.452 -0.355 1 O-C-N 115.536 -4.478 . . . . 0.0 115.38 166.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.45 156.61 30.06 Favored Pre-proline 0 N--CA 1.449 -0.514 0 C-N-CA 124.849 1.26 . . . . 0.0 112.938 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -63.72 147.26 92.65 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 O-C-N 116.667 -2.333 . . . . 0.0 110.584 -177.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 68.3 t -62.58 -31.08 50.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 127.751 2.421 . . . . 0.0 111.671 -172.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . 0.275 22.6 pm0 -65.24 -28.27 69.24 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.566 1.547 . . . . 0.0 114.213 175.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . 0.44 HD22 ' HB2' ' D' ' 37' ' ' PRO . 13.7 tp -82.97 -42.5 17.52 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.395 -0.812 . . . . 0.0 108.891 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 -61.1 -54.39 45.2 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 127.927 2.491 . . . . 0.0 110.566 -175.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -52.71 -53.5 46.82 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 127.787 3.18 . . . . 0.0 112.665 172.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 66.9 t90 -64.08 -39.17 93.48 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -177.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' C' ' 100' ' ' LEU . 13.3 mt -60.1 -39.28 85.59 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 116.948 -1.901 . . . . 0.0 114.642 172.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -64.23 -30.64 71.69 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.271 1.028 . . . . 0.0 112.711 175.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -67.86 -37.52 81.95 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 128.724 2.81 . . . . 0.0 116.751 173.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 61.6 t -86.42 -51.17 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 129.757 3.223 . . . . 0.0 113.315 -176.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 70.4 mt -77.76 -19.12 55.67 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 113.852 -2.975 . . . . 0.0 108.13 -174.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 35.1 mt -124.5 49.3 1.83 Allowed 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 122.564 2.438 . . . . 0.0 111.224 176.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 4.5 pttp . . . . . 0 N--CA 1.45 -0.454 0 CA-C-O 114.908 -2.472 . . . . 0.0 116.142 -172.914 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 55.0 p . . . . . 0 N--CA 1.447 -0.596 0 CA-C-O 118.124 -0.941 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -63.62 -20.7 69.7 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 115.089 -2.807 . . . . 0.0 111.405 169.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -161.29 137.43 8.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 172.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 18.1 t -78.72 132.91 37.15 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 126.896 2.623 . . . . 0.0 111.602 -167.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.02 -34.54 74.99 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 116.615 -1.659 . . . . 0.0 114.209 169.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.69 -38.99 57.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 125.277 2.465 . . . . 0.0 114.722 166.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 12.8 mmt -81.91 -22.95 36.52 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 115.635 -2.126 . . . . 0.0 114.879 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.56 -17.93 57.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 118.59 2.811 . . . . 0.0 118.59 165.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . 0.336 40.0 tp10 -76.97 -45.04 28.94 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 116.96 -1.495 . . . . 0.0 110.622 156.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -65.64 -31.66 72.81 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 117.687 2.477 . . . . 0.0 117.687 -173.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.95 -21.05 63.3 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 176.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -86.1 -24.09 26.41 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 165.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -81.66 -30.33 32.77 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.206 -1.559 . . . . 0.0 108.677 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -70.76 -22.41 62.4 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 117.901 -3.0 . . . . 0.0 111.881 169.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . 0.433 ' CE2' ' HD2' ' C' ' 48' ' ' ARG . 6.7 t-105 -87.39 -48.44 7.97 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 114.806 -2.521 . . . . 0.0 110.932 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 46.3 mt -57.13 -34.27 68.21 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 126.925 2.09 . . . . 0.0 109.504 167.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -63.11 -35.54 80.61 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 116.729 -3.732 . . . . 0.0 114.377 169.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -69.68 -36.71 76.22 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 121.255 1.843 . . . . 0.0 110.037 167.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 97.9 t -68.46 -35.86 72.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-N 122.455 2.389 . . . . 0.0 110.739 -177.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.91 -42.35 94.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 128.188 2.595 . . . . 0.0 114.158 168.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . 0.457 ' HA ' HD12 ' D' ' 25' ' ' LEU . 57.5 tp -65.89 -47.8 73.62 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 116.27 -1.824 . . . . 0.0 109.236 177.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 39.5 tp -64.44 -38.31 90.59 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 125.537 1.773 . . . . 0.0 114.844 177.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -49.67 -58.06 6.02 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 123.846 0.858 . . . . 0.0 111.878 166.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -74.41 -12.87 60.63 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.133 -1.413 . . . . 0.0 113.127 -176.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.396 . . -77.08 -27.41 54.24 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.691 2.478 . . . . 0.0 117.691 157.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -68.0 -29.99 69.14 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.362 -3.336 . . . . 0.0 113.101 171.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -73.21 -36.95 66.58 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 129.187 2.995 . . . . 0.0 116.254 -172.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 40.7 p30 -105.92 9.91 32.55 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 125.259 1.599 . . . . 0.0 113.571 171.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 64.95 30.7 11.81 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 131.391 3.876 . . . . 0.0 115.287 -176.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 34.9 mt -96.39 12.91 29.57 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 118.713 -2.492 . . . . 0.0 116.228 174.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -53.77 51.67 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 128.07 2.548 . . . . 0.0 110.15 178.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.27 1.1 mt -63.1 -50.88 73.88 Favored Pre-proline 0 N--CA 1.448 -0.534 0 O-C-N 121.246 -0.909 . . . . 0.0 111.679 -171.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . 0.44 ' HB2' HD22 ' C' ' 96' ' ' LEU . 35.9 Cg_exo -53.09 -27.35 36.31 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 N-CA-C 118.606 2.502 . . . . 0.0 118.606 166.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 27.2 tp -83.45 -43.2 16.09 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 120.084 1.311 . . . . 0.0 111.971 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 93.1 mt -62.35 -37.36 85.37 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 119.991 1.269 . . . . 0.0 110.425 170.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -81.9 -30.72 31.78 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 116.734 -1.603 . . . . 0.0 113.769 -174.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 13.8 tp -58.52 -58.64 7.64 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 129.389 3.076 . . . . 0.0 111.166 157.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.9 mmt -56.04 -35.97 67.5 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.167 2.187 . . . . 0.0 112.677 -178.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 70.0 mt -121.7 124.98 45.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 117.576 -3.202 . . . . 0.0 106.365 -161.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . 0.436 ' HB ' ' HD2' ' D' ' 45' ' ' PRO . 81.4 p -60.42 153.49 59.56 Favored Pre-proline 0 N--CA 1.453 -0.313 0 C-N-CA 127.665 2.386 . . . . 0.0 109.927 162.388 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . 0.436 ' HD2' ' HB ' ' D' ' 44' ' ' THR . 61.7 Cg_endo -74.61 -27.12 11.09 Favored 'Trans proline' 0 N--CA 1.449 -1.133 0 CA-C-O 116.606 -1.498 . . . . 0.0 115.513 -158.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -15.08 63.04 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 113.988 -2.91 . . . . 0.0 114.711 165.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -76.99 -29.72 55.63 Favored 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 125.544 1.777 . . . . 0.0 115.294 167.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 28.9 mtm-85 -77.06 -37.97 53.58 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.833 1.653 . . . . 0.0 112.022 175.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -56.82 -41.44 77.8 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 123.728 1.728 . . . . 0.0 114.414 166.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.319 . . -64.32 -42.22 96.42 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.76 -1.838 . . . . 0.0 113.877 175.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 20.0 mt -72.05 -38.72 69.43 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.12 -28.58 73.79 Favored Glycine 0 C--N 1.336 0.545 0 CA-C-N 120.034 1.288 . . . . 0.0 110.724 167.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 91.2 m -70.5 -23.08 62.6 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 119.164 -2.374 . . . . 0.0 110.928 170.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -81.6 -23.86 36.8 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 116.622 -3.799 . . . . 0.0 110.329 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 69.5 t -58.33 -39.14 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 120.594 1.543 . . . . 0.0 113.859 164.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -84.4 -19.44 33.53 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.839 -1.788 . . . . 0.0 115.747 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 80.4 mt -66.8 -51.57 54.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 C-N-CA 127.315 2.246 . . . . 0.0 110.353 160.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . 0.278 67.9 t -55.7 -52.35 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 O-C-N 126.352 2.282 . . . . 0.0 109.099 169.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -56.2 -42.55 77.36 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 120.065 1.302 . . . . 0.0 112.289 -168.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -76.16 -35.33 59.23 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 119.007 2.965 . . . . 0.0 119.007 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 54.4 mt -53.66 -37.32 63.03 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 115.562 -2.161 . . . . 0.0 113.22 167.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 94.1 mt -80.74 -36.2 32.36 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 127.984 2.514 . . . . 0.0 107.358 177.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -68.53 -50.49 51.58 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 122.488 2.404 . . . . 0.0 110.261 -177.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.63 48.15 8.2 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-O 114.933 -3.148 . . . . 0.0 106.651 161.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -130.74 -54.5 1.07 Allowed 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 126.385 1.874 . . . . 0.0 107.081 179.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 15.7 mmt -80.28 49.91 1.19 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.766 2.426 . . . . 0.0 108.679 -176.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 23.6 p -82.4 -166.02 1.17 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 119.977 3.325 . . . . 0.0 119.977 -175.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 50.59 -95.47 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 126.124 1.77 . . . . 0.0 113.761 169.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -70.58 -39.14 74.03 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 117.498 -3.251 . . . . 0.0 113.025 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -79.01 -38.71 35.96 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 112.885 -1.961 . . . . 0.0 110.656 -161.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . 0.3 3.8 mt -56.65 -34.76 67.62 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.415 170.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -78.45 -29.85 47.14 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 177.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -116.65 -16.81 10.68 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 128.177 2.591 . . . . 0.0 116.207 -162.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . 0.27 15.8 tp10 -122.14 -44.93 2.26 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 130.971 3.708 . . . . 0.0 107.821 -173.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -82.17 -47.15 12.85 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 113.282 -3.247 . . . . 0.0 114.879 165.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 99.53 -164.14 19.93 Favored Glycine 0 CA--C 1.523 0.592 0 CA-C-N 121.144 1.793 . . . . 0.0 113.415 155.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.69 -22.49 66.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 125.808 1.534 . . . . 0.0 113.947 -159.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.94 -15.81 22.26 Favored Glycine 0 C--N 1.337 0.6 1 CA-C-O 112.483 -4.509 . . . . 0.0 112.099 171.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 10.0 tt -49.8 -22.11 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 1 CA-C-N 124.211 4.006 . . . . 0.0 114.926 172.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -102.19 -15.21 16.73 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 131.356 3.862 . . . . 0.0 112.649 -171.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 57.1 m -64.78 -32.4 74.07 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 116.264 -1.827 . . . . 0.0 113.341 153.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 28.0 mm -98.18 -23.55 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 126.817 2.047 . . . . 0.0 113.388 -173.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 44.8 p -118.17 0.56 11.79 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 118.836 -2.415 . . . . 0.0 115.118 177.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -120.22 -177.53 3.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.308 1.843 . . . . 0.0 108.083 154.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.14 166.3 35.51 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-O 117.183 -1.898 . . . . 0.0 112.127 -144.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 53.3 p -77.83 -32.31 52.13 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 118.872 2.916 . . . . 0.0 118.872 -166.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -131.57 101.71 5.61 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.014 -1.448 . . . . 0.0 112.485 161.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 69.1 p -101.33 -177.28 3.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 124.273 1.987 . . . . 0.0 112.433 -172.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 tp -63.34 -22.5 66.91 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.165 -1.38 . . . . 0.0 113.371 168.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 46.5 tttt -75.17 -15.48 60.57 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.453 -2.03 . . . . 0.0 111.306 170.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -110.1 -15.36 14.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 115.874 -2.013 . . . . 0.0 115.263 -170.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 38.68 92.43 0.05 OUTLIER Pre-proline 0 N--CA 1.45 -0.45 0 O-C-N 126.539 2.399 . . . . 0.0 115.886 172.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . 0.449 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.365 15.2 Cg_exo 24.43 38.49 0.0 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.342 0 CA-C-O 116.319 -1.617 . . . . 0.0 115.948 50.694 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 15.4 t -51.8 -33.34 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 126.137 1.775 . . . . 0.0 107.45 -176.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . 0.449 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.332 0.0 OUTLIER -76.38 -43.27 41.36 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -174.36 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 14.7 tp -59.51 -46.85 87.66 Favored 'General case' 0 N--CA 1.447 -0.606 1 O-C-N 129.263 4.102 . . . . 0.0 105.805 174.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 45.2 ttp180 -65.94 -55.1 18.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.62 0.768 . . . . 0.0 110.43 -171.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -45.22 -37.64 4.76 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 126.638 2.461 . . . . 0.0 113.564 173.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . 0.272 90.4 t90 -74.03 -52.67 11.99 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 172.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 97.0 mt -51.39 -29.65 16.39 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 118.519 -2.613 . . . . 0.0 112.579 169.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -82.73 -16.22 48.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 120.049 -1.657 . . . . 0.0 110.933 -175.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -116.38 6.07 13.61 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 117.0 -3.562 . . . . 0.0 115.875 175.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 44.1 t -109.88 -38.14 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 128.122 2.569 . . . . 0.0 108.87 170.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 31.3 mt -99.34 -20.62 16.42 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 121.965 2.166 . . . . 0.0 112.198 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 4.3 mp -116.6 44.49 2.01 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 126.928 3.251 . . . . 0.0 112.677 171.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 17.1 pttp -71.64 -179.89 2.78 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 112.136 -2.302 . . . . 0.0 113.704 -174.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 69.2 m -50.97 -31.8 18.99 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.619 -1.173 . . . . 0.0 112.636 -173.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 . . . . . 0 C--O 1.251 1.157 1 O-C-N 116.297 -4.002 . . . . 0.0 114.487 -175.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 16.9 tpt . . . . . 0 N--CA 1.453 -0.277 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.07 -37.0 85.44 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 118.426 -1.31 . . . . 0.0 113.583 174.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -62.91 -39.29 94.09 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 118.981 -2.324 . . . . 0.0 112.884 171.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -72.04 -30.43 65.17 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.134 -1.394 . . . . 0.0 112.473 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 37.4 mmt-85 -75.16 -28.08 59.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 162.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -64.95 -42.33 94.71 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 117.036 -1.459 . . . . 0.0 110.543 171.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -79.68 -18.15 52.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 125.049 1.468 . . . . 0.0 112.276 -175.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -74.28 -36.55 63.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.734 2.814 . . . . 0.0 107.334 173.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.44 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG . 11.1 t-105 -71.17 -62.08 1.53 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 124.914 2.292 . . . . 0.0 110.697 172.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.3 mt -57.05 -13.81 3.17 Favored 'General case' 0 N--CA 1.447 -0.604 1 O-C-N 115.535 -4.478 . . . . 0.0 117.422 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -52.37 -44.95 65.55 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 118.732 -2.48 . . . . 0.0 113.798 160.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -72.4 -35.66 68.45 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 118.034 -2.916 . . . . 0.0 114.221 179.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.557 HG21 HD13 ' B' ' 36' ' ' LEU . 92.8 t -62.65 -34.72 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 124.141 1.924 . . . . 0.0 110.226 176.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -76.5 -31.49 57.75 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.47 -2.643 . . . . 0.0 114.352 171.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 27.3 tp -68.13 -66.23 0.59 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.695 1.198 . . . . 0.0 111.588 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.0 tp -46.37 -29.45 1.69 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 117.514 2.413 . . . . 0.0 117.514 167.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -62.8 -49.39 75.12 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 116.329 -3.982 . . . . 0.0 110.924 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -70.94 -17.86 62.66 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 116.501 -1.714 . . . . 0.0 112.563 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . 0.301 . . -84.28 -28.68 26.99 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 114.482 1.289 . . . . 0.0 114.482 176.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -56.33 -49.67 73.69 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.094 1.758 . . . . 0.0 110.435 163.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -62.08 -7.16 3.61 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 118.404 2.742 . . . . 0.0 118.404 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -126.66 8.66 6.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 129.625 3.17 . . . . 0.0 112.29 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 42.41 21.64 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 118.282 2.697 . . . . 0.0 118.282 -168.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 mt -84.06 2.86 37.19 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.466 1.906 . . . . 0.0 111.898 172.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -66.35 -45.38 80.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 -178.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.1 mt -64.57 -40.47 50.1 Favored Pre-proline 0 N--CA 1.451 -0.423 0 C-N-CA 116.44 -2.104 . . . . 0.0 112.333 174.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -60.69 -39.65 61.77 Favored 'Trans proline' 0 N--CA 1.449 -1.119 1 C-N-CA 126.791 4.994 . . . . 0.0 112.584 178.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.9 tp -63.32 -47.66 81.31 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 125.427 2.537 . . . . 0.0 114.925 169.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 62.5 mt -70.41 -37.31 74.43 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 118.384 -2.698 . . . . 0.0 112.105 -169.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -68.34 -9.42 47.81 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 119.836 -1.79 . . . . 0.0 114.035 171.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.293 1.0 OUTLIER -86.34 -56.56 3.38 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 118.263 -2.773 . . . . 0.0 106.89 178.902 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.3 mmt -66.17 -22.77 66.37 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.367 48.5 mt -123.56 131.28 53.58 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.276 2.63 . . . . 0.0 112.946 -170.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.8 p -87.56 152.74 52.41 Favored Pre-proline 0 N--CA 1.447 -0.575 0 CA-C-O 117.229 -1.367 . . . . 0.0 111.899 177.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -49.69 -48.24 19.96 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 123.709 2.939 . . . . 0.0 118.619 -175.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -65.66 -35.77 81.74 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 116.693 -1.622 . . . . 0.0 110.365 175.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -60.69 -40.14 91.06 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 123.887 3.04 . . . . 0.0 112.71 169.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 46.0 mtm-85 -65.86 -54.36 27.66 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -50.45 -45.76 56.23 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.391 1.476 . . . . 0.0 108.377 170.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.37 -33.97 77.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 117.638 -3.164 . . . . 0.0 109.983 -178.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.409 HD23 ' HD2' ' A' ' 54' ' ' ARG . 12.8 mt -75.75 -27.5 58.11 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 125.262 1.602 . . . . 0.0 113.554 176.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -64.27 -47.14 87.79 Favored Glycine 0 CA--C 1.521 0.447 0 CA-C-O 115.436 -2.869 . . . . 0.0 108.229 172.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 m -57.79 -36.31 72.01 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 120.419 2.11 . . . . 0.0 114.321 174.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.409 ' HD2' HD23 ' A' ' 51' ' ' LEU . 82.2 mtt180 -59.54 -19.85 51.36 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 117.4 2.37 . . . . 0.0 117.4 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.9 t -64.86 -45.74 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 CA-C-O 117.25 -1.357 . . . . 0.0 113.932 167.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 46.6 ttt180 -71.35 -26.57 62.87 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 125.759 1.912 . . . . 0.0 116.142 171.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.304 34.5 mt -61.66 -53.34 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 128.047 3.342 . . . . 0.0 115.679 165.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.0 t -67.55 -30.76 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 O-C-N 126.558 2.411 . . . . 0.0 110.544 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -50.97 -55.16 18.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 116.397 -3.939 . . . . 0.0 115.369 172.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.447 ' HA ' ' OE1' ' A' ' 60' ' ' GLU . 22.5 mm-40 -76.05 -29.28 57.97 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.158 1.783 . . . . 0.0 106.393 -174.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -80.56 -18.61 47.86 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 113.087 -3.34 . . . . 0.0 112.077 178.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.5 tp -87.18 -35.47 18.56 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 113.131 -3.319 . . . . 0.0 109.18 167.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -66.66 -45.41 79.0 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 123.294 2.77 . . . . 0.0 109.448 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.65 20.42 44.21 Favored Glycine 0 CA--C 1.525 0.673 0 CA-C-O 125.689 2.827 . . . . 0.0 113.183 158.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -105.06 -43.46 5.04 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.919 1.688 . . . . 0.0 113.531 -170.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 24.6 mtp -79.49 145.32 33.3 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.796 -3.065 . . . . 0.0 109.448 178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.55 165.17 21.38 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 126.091 2.12 . . . . 0.0 113.494 170.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -67.68 -27.99 67.31 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 126.481 2.363 . . . . 0.0 108.662 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -78.45 -33.34 48.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.823 1.249 . . . . 0.0 113.542 173.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -67.24 -40.32 86.28 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 124.223 1.963 . . . . 0.0 109.533 172.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.4 mt -68.68 -22.38 64.38 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 118.51 -2.619 . . . . 0.0 110.822 -175.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -61.6 -46.05 91.48 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 116.816 -1.564 . . . . 0.0 114.852 167.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -60.73 -15.72 32.25 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 120.22 1.373 . . . . 0.0 113.27 172.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -91.05 -50.8 5.66 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 124.937 2.303 . . . . 0.0 113.821 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.6 mt -100.4 -20.26 15.89 Favored 'General case' 0 N--CA 1.451 -0.381 1 N-CA-C 121.895 4.035 . . . . 0.0 121.895 -172.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 61.07 -4.85 0.25 Allowed Glycine 0 CA--C 1.521 0.418 0 N-CA-C 118.608 2.203 . . . . 0.0 118.608 -164.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.71 154.08 39.95 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 125.189 2.423 . . . . 0.0 112.827 -178.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.75 136.97 50.75 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 126.45 1.976 . . . . 0.0 117.021 171.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 26.8 mt -74.91 -25.92 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 O-C-N 118.014 -3.051 . . . . 0.0 113.464 -175.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . 0.298 . . -58.3 -33.97 70.05 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 120.159 3.392 . . . . 0.0 120.159 167.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . 0.277 33.4 p -83.12 -26.38 31.05 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 114.582 -2.627 . . . . 0.0 113.971 174.048 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 13.7 mm -68.66 -38.01 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 162.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.2 m -64.91 -44.75 88.53 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 118.633 -2.542 . . . . 0.0 112.856 176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -60.68 -49.13 78.73 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 113.732 -1.576 . . . . 0.0 111.85 172.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -50.17 -38.55 32.9 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 117.071 1.588 . . . . 0.0 117.071 171.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.4 m -63.58 -41.79 98.34 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 128.877 2.871 . . . . 0.0 114.347 174.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 49.4 m-20 -77.67 -38.98 46.41 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.065 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 70.3 m -54.51 -33.24 59.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 126.426 1.89 . . . . 0.0 114.247 166.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 89' ' ' LEU . 37.3 tp -69.89 -49.27 53.87 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.862 1.665 . . . . 0.0 111.857 172.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -56.28 -37.82 70.37 Favored 'General case' 0 N--CA 1.446 -0.658 0 O-C-N 117.157 -3.464 . . . . 0.0 107.728 172.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.89 5.05 26.77 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 121.434 1.925 . . . . 0.0 114.579 -173.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.86 147.65 94.27 Favored Pre-proline 0 N--CA 1.452 -0.367 0 C-N-CA 127.959 2.504 . . . . 0.0 113.131 166.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -59.43 150.14 77.15 Favored 'Trans proline' 0 N--CA 1.446 -1.285 0 C-N-CA 125.094 3.863 . . . . 0.0 112.925 165.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.2 m -59.1 -36.91 65.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 O-C-N 126.116 2.135 . . . . 0.0 105.725 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -73.88 -37.89 64.57 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 123.498 2.863 . . . . 0.0 109.584 -168.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 21.8 tp -61.12 -43.82 98.3 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 117.365 -3.334 . . . . 0.0 111.479 168.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 50.7 mtm-85 -67.31 -40.01 85.98 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 121.477 1.944 . . . . 0.0 113.322 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.37 -43.12 83.3 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 126.842 2.057 . . . . 0.0 115.266 166.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -63.39 -53.56 50.59 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 116.299 -1.81 . . . . 0.0 115.831 164.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 51.4 mt -59.72 -25.05 64.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 127.44 2.296 . . . . 0.0 112.488 -177.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -67.73 -35.23 78.38 Favored 'General case' 0 N--CA 1.452 -0.332 1 O-C-N 116.257 -4.027 . . . . 0.0 111.895 170.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -80.11 -24.72 40.32 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 120.529 -1.357 . . . . 0.0 111.83 178.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.4 t -66.72 -61.04 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 O-C-N 117.314 -3.366 . . . . 0.0 114.291 164.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.2 mt -87.5 -31.66 19.84 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 117.375 2.361 . . . . 0.0 117.375 -166.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 24.4 mt -109.14 -4.64 16.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 -163.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.8 tttt . . . . . 0 N--CA 1.447 -0.622 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -164.077 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -34.72 67.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 117.182 2.29 . . . . 0.0 117.182 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.02 -45.23 91.24 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 123.41 1.576 . . . . 0.0 109.711 173.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . 0.302 48.3 tp10 -61.73 -38.09 86.65 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.501 2.72 . . . . 0.0 110.628 174.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -70.3 -42.36 72.1 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 122.232 2.287 . . . . 0.0 109.39 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -80.8 -2.81 48.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 115.004 -2.427 . . . . 0.0 112.266 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -82.58 -44.97 15.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 119.933 3.308 . . . . 0.0 119.933 152.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -65.14 -21.38 66.78 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 170.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -64.95 -37.04 86.33 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 117.88 2.548 . . . . 0.0 117.88 161.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 15.9 t-105 -68.44 -41.42 80.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 117.143 -1.408 . . . . 0.0 108.815 -177.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 59.7 mt -65.92 -27.79 68.45 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 127.346 2.904 . . . . 0.0 110.739 -176.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -63.31 -31.66 72.88 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 125.251 1.595 . . . . 0.0 114.677 -178.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -74.48 -49.36 22.5 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 124.814 1.321 . . . . 0.0 109.847 171.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.18 -37.41 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.774 1.63 . . . . 0.0 108.48 -173.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.45 -35.01 63.32 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 127.846 2.458 . . . . 0.0 113.601 175.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 16.8 tp -57.79 -50.09 74.42 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 116.879 -3.638 . . . . 0.0 110.597 166.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' B' ' 29' ' ' ALA . 22.4 tp -63.52 -45.45 90.54 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.844 178.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -56.73 -44.94 82.13 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.812 2.045 . . . . 0.0 113.419 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -66.55 -43.94 83.73 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 172.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' B' ' 26' ' ' LEU . . . -50.44 -49.35 55.18 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 119.214 -2.179 . . . . 0.0 114.238 173.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . 0.404 ' C ' ' H ' ' B' ' 32' ' ' ASN . 1.6 m-85 -64.65 -37.69 88.45 Favored 'General case' 0 N--CA 1.45 -0.457 1 CA-C-O 111.37 -4.157 . . . . 0.0 105.206 -176.166 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -57.26 -4.94 0.24 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 123.639 2.927 . . . . 0.0 116.47 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . 0.404 ' H ' ' C ' ' B' ' 30' ' ' TYR . 49.0 m-80 -141.48 3.18 1.69 Allowed 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 129.002 2.921 . . . . 0.0 114.61 -167.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 65.79 19.43 11.35 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 129.503 3.121 . . . . 0.0 118.298 170.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 26.2 mt -87.81 0.69 55.45 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 113.367 -1.742 . . . . 0.0 114.843 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -59.19 -40.92 87.24 Favored 'General case' 0 N--CA 1.45 -0.425 1 O-C-N 115.573 -4.454 . . . . 0.0 113.286 -170.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.557 HD13 HG21 ' A' ' 23' ' ' VAL . 29.4 tp -66.89 -47.61 53.46 Favored Pre-proline 0 N--CA 1.451 -0.41 0 CA-C-O 113.51 -3.138 . . . . 0.0 110.109 -178.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.22 -49.07 18.27 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 124.934 3.756 . . . . 0.0 116.567 167.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 21.8 tp -56.08 -40.78 74.13 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 119.201 3.037 . . . . 0.0 119.201 168.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 82.4 mt -73.61 -16.55 61.23 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 113.986 -2.912 . . . . 0.0 109.338 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . 0.344 33.6 m-20 -78.8 -40.46 32.95 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 123.025 2.648 . . . . 0.0 110.945 169.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 56.4 tp -65.88 -30.13 70.69 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 117.336 2.347 . . . . 0.0 117.336 169.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.2 mmt -105.82 -8.27 17.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 121.535 1.97 . . . . 0.0 109.039 -169.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 19.5 mt -134.94 135.23 41.34 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 120.501 1.5 . . . . 0.0 109.298 176.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 59.0 p -75.42 159.32 82.21 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-O 114.037 -2.887 . . . . 0.0 112.879 170.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -67.97 -20.56 44.64 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 CA-C-O 113.025 -2.99 . . . . 0.0 112.885 -172.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.78 -35.65 73.13 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 128.153 3.408 . . . . 0.0 112.372 166.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -86.8 -36.57 18.46 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 126.078 2.111 . . . . 0.0 112.28 -176.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . 0.44 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 16.3 mtm-85 -68.19 -30.21 69.25 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.069 -1.423 . . . . 0.0 114.157 170.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -71.38 -25.91 62.56 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 114.651 -2.595 . . . . 0.0 114.135 167.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.81 -53.02 62.41 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 124.592 2.139 . . . . 0.0 114.915 158.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.292 30.7 mt -62.12 -42.78 99.57 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 116.63 -1.653 . . . . 0.0 114.849 -175.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.32 -31.67 79.69 Favored Glycine 0 CA--C 1.522 0.519 0 C-N-CA 118.096 -2.002 . . . . 0.0 113.798 174.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . 0.258 25.8 m -64.01 -45.05 90.67 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.638 2.375 . . . . 0.0 111.303 170.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -73.08 -27.51 61.76 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 118.891 -2.38 . . . . 0.0 112.385 -171.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 23.8 t -56.85 -38.28 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 1 O-C-N 115.01 -4.807 . . . . 0.0 112.889 163.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -76.97 -33.06 57.66 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 120.656 1.571 . . . . 0.0 110.38 -176.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 45.0 mt -64.3 -56.08 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 128.383 2.673 . . . . 0.0 113.536 173.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.267 94.0 t -44.69 -48.16 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 119.136 3.013 . . . . 0.0 119.136 167.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -58.75 -54.72 43.89 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 126.99 2.681 . . . . 0.0 110.924 173.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -59.93 -33.29 71.69 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.831 -1.793 . . . . 0.0 109.437 -175.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 42.6 mt -60.89 -42.59 98.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 116.308 -1.805 . . . . 0.0 108.901 178.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 47.8 mt -72.64 -24.55 61.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.753 1.908 . . . . 0.0 114.995 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 31.9 ttm105 -87.08 -50.12 6.85 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.421 -1.276 . . . . 0.0 112.208 -176.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.02 37.91 36.85 Favored Glycine 0 CA--C 1.525 0.687 0 CA-C-N 121.249 1.841 . . . . 0.0 116.865 177.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -113.23 -28.94 7.44 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 118.237 -2.92 . . . . 0.0 114.14 -175.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 24.5 mtt -82.72 131.17 35.21 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 -168.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 29.6 p -62.61 166.25 5.53 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 128.338 2.655 . . . . 0.0 113.066 170.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -72.15 -25.04 61.55 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 123.921 3.055 . . . . 0.0 112.428 -177.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -63.33 -48.06 79.58 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 131.437 3.895 . . . . 0.0 109.202 169.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -67.06 -38.93 86.65 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.409 HD23 HD12 ' B' ' 75' ' ' LEU . 78.0 mt -54.68 -42.05 70.92 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 124.471 1.107 . . . . 0.0 112.133 168.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -71.33 -21.51 62.04 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 115.09 -2.386 . . . . 0.0 113.595 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -130.41 -39.37 1.31 Allowed 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 124.758 3.435 . . . . 0.0 110.159 -163.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -71.38 -49.39 42.62 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 124.874 2.273 . . . . 0.0 112.091 173.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . 0.409 HD12 HD23 ' B' ' 71' ' ' LEU . 16.9 mt -96.53 3.86 52.4 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 112.766 -2.016 . . . . 0.0 115.977 170.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 56.79 33.39 63.17 Favored Glycine 0 C--N 1.337 0.593 0 O-C-N 118.037 -2.914 . . . . 0.0 115.387 172.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.71 139.94 52.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 120.952 2.376 . . . . 0.0 115.389 -168.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.23 153.86 36.18 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 127.889 2.661 . . . . 0.0 114.006 169.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . 0.251 23.8 mm -62.85 -23.18 32.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 120.557 2.179 . . . . 0.0 112.148 -172.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.67 -41.89 95.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 119.728 -1.857 . . . . 0.0 112.504 167.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -69.16 -19.18 64.0 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 116.722 -3.736 . . . . 0.0 114.188 174.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 mm -81.35 -54.16 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-O 123.969 1.842 . . . . 0.0 113.591 172.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 25.7 m -55.71 -35.17 65.79 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 118.573 -2.579 . . . . 0.0 114.86 174.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -56.81 -50.65 71.74 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 118.746 -2.471 . . . . 0.0 114.409 168.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -57.25 -42.99 93.73 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 128.402 2.905 . . . . 0.0 118.927 173.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 4.0 p -72.39 -42.41 65.22 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 175.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -47.57 -37.59 12.64 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 158.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 13.8 m -75.32 -28.75 59.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 120.086 1.312 . . . . 0.0 112.487 -176.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 mt -84.68 -43.73 14.07 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 128.179 2.591 . . . . 0.0 106.448 -178.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 18.5 tttm -54.13 -40.8 67.7 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 121.858 2.117 . . . . 0.0 110.711 176.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.05 4.55 44.77 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 117.606 2.447 . . . . 0.0 117.606 -179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . 0.408 ' HB1' HD23 ' B' ' 96' ' ' LEU . . . -67.07 135.62 93.95 Favored Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 117.539 2.422 . . . . 0.0 117.539 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -51.83 128.76 27.69 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 N-CA-C 106.755 -2.056 . . . . 0.0 106.755 176.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 34.5 m -65.32 -23.21 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -163.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -62.24 -31.58 72.16 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 170.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . 0.408 HD23 ' HB1' ' B' ' 92' ' ' ALA . 13.7 tp -80.28 -36.54 34.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 126.588 1.955 . . . . 0.0 112.674 171.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 58.0 mtp85 -61.92 -43.96 97.76 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 177.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.69 -37.66 85.19 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.06 1.344 . . . . 0.0 110.415 177.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 79.1 t90 -67.15 -45.62 76.51 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 124.765 2.222 . . . . 0.0 108.906 -172.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 70.2 mt -67.98 -27.26 66.43 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 111.835 -3.936 . . . . 0.0 110.378 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -68.99 -37.09 78.53 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 125.191 3.632 . . . . 0.0 109.266 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -82.04 -30.2 31.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.435 2.294 . . . . 0.0 114.852 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 76.9 t -62.17 -55.3 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 O-C-N 121.327 -0.858 . . . . 0.0 108.859 167.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . 0.29 33.2 mt -82.17 -55.2 4.69 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 124.345 2.021 . . . . 0.0 111.73 -156.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 32.1 mt -79.59 -2.78 44.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 118.087 -2.883 . . . . 0.0 114.13 -163.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -123.33 4.03 9.13 Favored 'General case' 0 N--CA 1.454 -0.268 1 C-N-CA 132.765 4.426 . . . . 0.0 110.926 -177.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 16.5 m -114.43 -35.95 4.78 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 115.532 -2.175 . . . . 0.0 110.949 162.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 33.0 t70 . . . . . 0 C--O 1.25 1.091 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 169.395 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . 0.296 61.9 mtp . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.428 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.294 . . -87.78 132.58 34.11 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 126.327 1.851 . . . . 0.0 110.054 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -109.05 132.75 53.81 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 119.513 1.051 . . . . 0.0 110.899 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -103.59 149.85 24.52 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 166.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . 0.417 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 32.7 p -125.03 150.45 66.61 Favored Pre-proline 0 N--CA 1.45 -0.446 0 O-C-N 126.682 2.489 . . . . 0.0 109.545 177.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' C' ' 5' ' ' SER . 63.6 Cg_exo -66.32 -9.85 25.37 Favored 'Trans proline' 0 N--CA 1.446 -1.282 0 C-N-CA 124.573 3.515 . . . . 0.0 116.388 -174.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -155.08 158.08 38.52 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 118.082 -2.886 . . . . 0.0 107.589 176.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 10.6 t -150.06 121.89 8.14 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 131.311 3.844 . . . . 0.0 112.065 157.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.34 -40.9 78.98 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 116.845 -3.66 . . . . 0.0 114.579 171.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.57 -41.41 73.26 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 120.78 1.627 . . . . 0.0 115.355 172.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 25.3 mtt -56.67 -40.73 76.05 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.651 1.58 . . . . 0.0 108.694 178.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.94 -37.79 79.09 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 119.305 -2.122 . . . . 0.0 112.94 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -68.95 -16.8 63.83 Favored 'General case' 0 N--CA 1.448 -0.541 1 CA-C-O 109.224 -5.179 . . . . 0.0 116.79 165.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -84.66 -31.1 24.35 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 125.04 3.563 . . . . 0.0 110.868 163.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -33.27 75.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 124.677 1.236 . . . . 0.0 113.114 170.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . 0.265 84.7 t60 -78.59 -30.83 46.9 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 126.019 2.075 . . . . 0.0 109.62 -177.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -69.18 -23.93 63.99 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 117.413 -1.715 . . . . 0.0 114.863 171.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -77.6 -32.82 53.82 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 124.502 1.121 . . . . 0.0 111.84 -179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -64.9 -43.04 94.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 130.899 3.68 . . . . 0.0 114.225 165.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mp -66.86 -30.04 70.1 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 116.612 -3.805 . . . . 0.0 110.279 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -74.53 -34.02 62.9 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 124.085 1.898 . . . . 0.0 110.739 -175.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . 0.411 ' CE2' HD22 ' D' ' 51' ' ' LEU . 5.4 t80 -59.99 -39.33 85.36 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 115.916 -1.992 . . . . 0.0 112.622 170.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 78.7 t -68.55 -46.23 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 C-N-CA 128.284 2.633 . . . . 0.0 110.983 174.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -64.77 -41.54 95.78 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 117.723 2.49 . . . . 0.0 117.723 176.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 45.7 tp -57.11 -40.94 78.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 127.442 3.496 . . . . 0.0 110.689 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 15.8 tp -71.65 -28.39 63.73 Favored 'General case' 0 N--CA 1.447 -0.579 1 O-C-N 115.955 -4.215 . . . . 0.0 116.579 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -63.86 -44.11 94.08 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.129 -1.891 . . . . 0.0 108.728 170.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -71.69 -31.39 66.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 126.834 2.584 . . . . 0.0 111.229 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.42 83.85 Favored 'General case' 0 N--CA 1.443 -0.785 0 O-C-N 119.15 -2.219 . . . . 0.0 115.232 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -58.17 -24.74 60.06 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 126.768 3.175 . . . . 0.0 117.167 169.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -76.51 -22.99 53.73 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 111.821 -2.445 . . . . 0.0 114.092 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 32.7 p-10 -135.55 19.38 3.33 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.237 2.215 . . . . 0.0 112.253 -174.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.263 1.6 m-20 60.92 24.34 14.37 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 117.362 -3.336 . . . . 0.0 115.619 178.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 18.4 mt -89.2 4.46 48.56 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.642 171.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . 0.402 32.6 p-80 -53.66 -56.74 14.6 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 117.454 2.39 . . . . 0.0 117.454 175.397 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.73 -57.15 27.55 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-O 115.862 -2.018 . . . . 0.0 105.813 175.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -52.69 -37.56 75.46 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 CA-C-N 124.323 2.58 . . . . 0.0 114.507 175.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 64.4 tp -74.65 -23.28 58.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 122.927 2.603 . . . . 0.0 112.654 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 35.4 mt -90.09 -38.21 13.71 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 119.512 1.051 . . . . 0.0 112.237 174.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -43.93 -38.4 3.4 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.712 1.205 . . . . 0.0 110.446 162.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 57.6 tp -83.43 -40.15 19.68 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 118.42 -2.675 . . . . 0.0 114.004 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . 0.4 ' SD ' ' HB3' ' D' ' 54' ' ' ARG . 26.1 mmm -96.07 -6.28 38.98 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 119.786 -1.821 . . . . 0.0 112.143 -171.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 10.1 mp -119.24 146.8 44.92 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.044 1.738 . . . . 0.0 108.158 175.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . 0.387 41.6 p -70.2 156.83 91.2 Favored Pre-proline 0 N--CA 1.449 -0.487 0 C-N-CA 127.468 2.307 . . . . 0.0 114.518 158.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -50.25 -31.46 29.39 Favored 'Trans proline' 0 N--CA 1.45 -1.063 0 C-N-CA 124.743 3.629 . . . . 0.0 112.001 165.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.66 -30.6 65.9 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 127.248 2.219 . . . . 0.0 113.419 175.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -82.21 -36.87 26.83 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 120.447 -1.408 . . . . 0.0 108.453 -174.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . 0.405 ' HD2' ' CE2' ' D' ' 19' ' ' TRP . 73.1 mtm-85 -66.04 -42.33 89.72 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 115.394 -2.241 . . . . 0.0 112.903 171.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -58.04 -52.42 65.6 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 127.901 3.251 . . . . 0.0 111.271 176.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -41.88 -59.89 1.56 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 128.37 2.668 . . . . 0.0 110.791 169.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 28.7 mt -63.78 -34.42 77.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 119.213 3.042 . . . . 0.0 119.213 178.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.84 -56.47 24.95 Favored Glycine 0 C--N 1.336 0.55 0 O-C-N 126.798 2.561 . . . . 0.0 113.124 170.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . 0.315 17.6 m -45.04 -53.77 7.43 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 159.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . 0.419 ' HA ' HD12 ' C' ' 57' ' ' ILE . 95.2 mtt180 -59.7 -33.66 71.89 Favored 'General case' 0 N--CA 1.449 -0.498 1 O-C-N 114.756 -4.965 . . . . 0.0 117.88 172.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 17.1 t -57.38 -51.63 67.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 121.19 -0.944 . . . . 0.0 110.612 169.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 45.9 mtp180 -66.52 -26.72 67.29 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 113.396 -3.192 . . . . 0.0 113.593 -174.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . 0.419 HD12 ' HA ' ' C' ' 54' ' ' ARG 0.251 77.8 mt -70.42 -27.17 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 105.392 -2.077 . . . . 0.0 105.392 175.284 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 40.1 t -78.84 -39.7 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 122.369 2.35 . . . . 0.0 112.335 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -49.83 -47.09 51.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 119.042 -2.286 . . . . 0.0 111.366 169.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -75.79 -22.3 56.52 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 115.336 -2.269 . . . . 0.0 116.034 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 63.6 mt -86.39 -15.23 41.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 123.579 2.9 . . . . 0.0 108.255 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 16.7 mt -83.03 -41.71 18.35 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 123.256 2.753 . . . . 0.0 108.824 172.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.5 ttm105 -66.02 -25.93 67.29 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 116.687 2.106 . . . . 0.0 116.687 170.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.77 2.39 0.02 OUTLIER Glycine 0 C--N 1.336 0.548 0 C-N-CA 127.517 2.484 . . . . 0.0 118.469 -178.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -66.06 -39.42 90.08 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 121.815 2.807 . . . . 0.0 110.903 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 16.0 mmt -55.58 123.15 13.08 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 124.659 2.171 . . . . 0.0 113.157 175.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 92.5 p -83.91 -174.96 5.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 112.826 -1.988 . . . . 0.0 111.791 -174.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -67.5 -28.31 67.73 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 122.208 2.276 . . . . 0.0 112.112 -173.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 34.1 ttp-105 -59.48 -64.55 0.9 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 127.63 2.372 . . . . 0.0 113.872 171.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -53.69 -39.94 65.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 128.301 2.64 . . . . 0.0 112.976 176.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 77.2 mt -64.17 -12.22 38.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.375 -1.453 . . . . 0.0 114.706 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -107.08 -48.64 3.43 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.023 2.529 . . . . 0.0 112.783 171.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -88.96 10.9 19.78 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -174.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -137.85 -36.71 0.61 Allowed 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 111.929 -3.891 . . . . 0.0 110.08 166.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 7.8 mp -95.77 0.22 52.11 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 120.477 3.51 . . . . 0.0 120.477 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 44.3 -125.36 5.87 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-O 115.199 -3.0 . . . . 0.0 119.85 171.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.04 -18.85 16.07 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 120.728 2.264 . . . . 0.0 113.149 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.11 -29.3 73.98 Favored Glycine 0 CA--C 1.523 0.57 0 O-C-N 117.299 -3.375 . . . . 0.0 109.656 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tt -43.81 -34.81 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 117.733 2.494 . . . . 0.0 117.733 162.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.64 -59.22 5.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 121.126 3.75 . . . . 0.0 121.126 173.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 9.1 m -43.62 -47.13 7.51 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 115.341 -2.266 . . . . 0.0 109.849 172.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.259 44.5 mm -60.29 -30.42 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 122.213 2.279 . . . . 0.0 113.203 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 61.0 p -118.34 3.22 11.93 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 119.127 -2.233 . . . . 0.0 114.536 -163.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 67.8 mtp85 -116.76 136.67 52.78 Favored 'General case' 0 N--CA 1.45 -0.428 1 C-N-CA 131.856 4.062 . . . . 0.0 115.039 175.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 97.76 161.59 31.05 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-O 115.794 -2.67 . . . . 0.0 113.816 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 66.7 m -56.83 -12.28 1.86 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 113.465 -3.16 . . . . 0.0 117.812 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -103.84 15.01 29.7 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 122.387 2.358 . . . . 0.0 113.698 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 3.0 p -68.05 162.91 23.54 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 116.803 -1.57 . . . . 0.0 114.504 -171.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 17.3 tp -47.01 -42.64 18.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 121.979 2.172 . . . . 0.0 115.791 -172.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -91.16 -10.76 40.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 119.989 3.329 . . . . 0.0 119.989 171.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.72 -28.53 64.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 116.872 -1.537 . . . . 0.0 109.819 167.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.77 162.98 31.8 Favored Pre-proline 0 N--CA 1.453 -0.316 0 C-N-CA 129.526 3.13 . . . . 0.0 117.716 -163.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_exo -55.36 148.14 52.94 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 124.285 3.323 . . . . 0.0 111.957 172.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 18.1 t -71.13 -45.35 72.02 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 CA-C-N 110.139 -3.21 . . . . 0.0 106.991 -169.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 18.7 pm0 -65.77 -28.43 69.02 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 113.788 -3.006 . . . . 0.0 111.672 -179.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 36.6 tp -71.36 -46.27 60.85 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 125.184 2.421 . . . . 0.0 115.57 169.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -63.18 -33.73 76.12 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 112.37 -3.681 . . . . 0.0 110.022 -177.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -83.35 -31.29 26.86 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 127.618 3.074 . . . . 0.0 113.378 173.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 82.0 t90 -63.29 -54.19 40.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 170.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 78.8 mt -55.55 -29.24 58.63 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.513 1.125 . . . . 0.0 109.329 -175.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -71.52 -34.91 70.49 Favored 'General case' 0 N--CA 1.452 -0.34 1 C-N-CA 132.08 4.152 . . . . 0.0 109.825 -178.031 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -75.19 -26.26 58.88 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 111.075 -2.784 . . . . 0.0 113.117 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 54.2 t -97.42 -47.98 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-N 113.145 -1.843 . . . . 0.0 113.142 -176.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 73.4 mt -85.38 -22.7 28.29 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -169.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 64.5 mt -111.36 17.06 20.53 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 119.088 -2.258 . . . . 0.0 112.698 176.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 20.9 pttp . . . . . 0 N--CA 1.446 -0.673 0 CA-C-O 125.941 2.781 . . . . 0.0 116.69 176.088 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 1.7 p . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -76.09 -0.04 9.87 Favored 'Trans proline' 0 N--CA 1.444 -1.383 0 CA-C-O 117.587 -1.089 . . . . 0.0 112.615 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -162.89 120.29 1.96 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.184 2.593 . . . . 0.0 110.455 165.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 15.8 p -74.82 149.88 39.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 113.147 -3.421 . . . . 0.0 110.965 -168.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.77 -33.91 73.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 126.299 1.84 . . . . 0.0 115.347 174.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.36 -14.28 59.47 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 124.474 2.083 . . . . 0.0 112.491 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 4.8 mmt -87.15 -36.13 18.22 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 117.804 -3.06 . . . . 0.0 105.81 -175.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.98 -23.25 66.29 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 116.627 -3.796 . . . . 0.0 117.331 168.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -74.35 -40.75 61.95 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 126.927 2.642 . . . . 0.0 116.035 156.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -62.72 -36.92 84.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 119.815 1.189 . . . . 0.0 109.465 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -36.25 77.17 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 115.158 -2.353 . . . . 0.0 113.735 175.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -69.88 -24.87 63.47 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 122.564 2.438 . . . . 0.0 117.412 172.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -82.09 -39.53 23.23 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.342 1.057 . . . . 0.0 108.544 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -62.92 -29.32 70.7 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 169.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . 0.405 ' CE2' ' HD2' ' C' ' 48' ' ' ARG . 38.4 t-105 -70.69 -35.84 72.98 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 117.49 -3.256 . . . . 0.0 112.859 166.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 64.4 mt -80.19 -18.36 49.86 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 119.059 -2.276 . . . . 0.0 115.442 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 42.3 ttt180 -69.05 -29.11 67.18 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 126.535 1.934 . . . . 0.0 112.857 162.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -75.09 -48.4 24.03 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 114.409 -2.71 . . . . 0.0 112.347 166.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 46.7 t -56.67 -38.78 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 124.524 3.329 . . . . 0.0 112.272 174.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -73.05 -48.27 37.54 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 125.528 1.768 . . . . 0.0 113.081 173.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 39.0 tp -52.93 -48.61 67.18 Favored 'General case' 0 N--CA 1.448 -0.563 1 O-C-N 115.173 -4.704 . . . . 0.0 109.307 173.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.25 -46.7 87.67 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 120.364 1.438 . . . . 0.0 110.507 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -51.61 -46.83 63.74 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 116.123 1.898 . . . . 0.0 116.123 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -66.73 -27.85 67.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 119.109 -2.244 . . . . 0.0 108.578 174.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.307 . . -69.66 -23.91 63.53 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.049 2.94 . . . . 0.0 114.785 173.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -76.43 -28.26 56.54 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 120.449 -1.407 . . . . 0.0 111.031 165.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -75.44 -24.28 57.03 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 119.895 -1.753 . . . . 0.0 113.085 -175.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 55.1 p30 -116.33 9.93 14.61 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 121.134 3.753 . . . . 0.0 121.134 164.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 55.59 32.54 19.39 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 116.693 -1.622 . . . . 0.0 115.278 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 60.8 mt -80.78 -1.51 43.21 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 120.411 1.46 . . . . 0.0 112.578 164.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . 0.331 0.0 OUTLIER -38.8 -75.6 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 119.418 3.118 . . . . 0.0 119.418 -179.279 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.292 50.8 mt -46.44 -45.33 44.37 Favored Pre-proline 0 N--CA 1.446 -0.631 0 CA-C-O 113.528 -3.13 . . . . 0.0 115.298 174.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -55.0 -37.23 93.86 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 124.538 3.492 . . . . 0.0 114.063 168.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 41.3 tp -75.09 -46.94 31.28 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 176.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 61.8 mt -57.85 -31.23 66.47 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.757 2.023 . . . . 0.0 112.804 171.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -79.0 -40.61 31.05 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 117.0 -3.563 . . . . 0.0 112.31 176.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 54.9 tp -51.01 -55.92 15.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 118.954 -2.341 . . . . 0.0 111.68 164.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 22.2 mmt -83.5 -25.03 31.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 115.943 -1.98 . . . . 0.0 115.401 -172.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 31.9 mt -116.96 141.3 48.42 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 122.173 2.26 . . . . 0.0 113.2 -176.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . 0.437 ' HB ' ' HD2' ' D' ' 45' ' ' PRO . 46.4 p -70.58 156.03 92.54 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 127.923 2.489 . . . . 0.0 109.347 170.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . 0.437 ' HD2' ' HB ' ' D' ' 44' ' ' THR . 17.7 Cg_endo -65.28 -36.69 34.75 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 O-C-N 117.93 -1.668 . . . . 0.0 113.868 -168.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.255 0.1 OUTLIER -69.65 -10.82 59.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.834 -2.416 . . . . 0.0 115.477 173.894 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -78.91 -40.3 32.57 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.508 1.523 . . . . 0.0 108.982 166.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 41.0 mtm-85 -71.14 -36.44 72.09 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 119.164 -2.21 . . . . 0.0 116.829 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.19 -36.19 82.82 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 119.667 -1.896 . . . . 0.0 112.493 167.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.1 -30.38 43.8 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 117.72 -3.113 . . . . 0.0 111.421 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . 0.411 HD22 ' CE2' ' C' ' 22' ' ' PHE . 56.4 mt -68.84 -52.7 27.13 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 118.625 -2.547 . . . . 0.0 113.844 167.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -48.45 -36.36 17.17 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-O 115.614 -2.77 . . . . 0.0 115.162 164.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 25.6 m -76.13 -26.55 56.46 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 121.087 2.444 . . . . 0.0 113.516 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . 0.4 ' HB3' ' SD ' ' C' ' 42' ' ' MET . 72.9 mtt180 -66.22 -34.36 77.84 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 116.928 -1.51 . . . . 0.0 109.354 171.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . 0.255 42.8 t -44.71 -49.09 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-O 126.471 3.034 . . . . 0.0 115.562 171.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -86.42 -21.98 26.81 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 112.017 -2.356 . . . . 0.0 116.507 -176.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.13 -39.05 84.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 122.35 1.071 . . . . 0.0 112.932 166.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 85.0 t -60.69 -54.44 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 C-N-CA 127.928 2.491 . . . . 0.0 112.415 165.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -67.06 -35.63 80.28 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -178.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -79.24 -18.19 53.32 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 121.922 2.147 . . . . 0.0 112.484 176.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 17.0 mt -63.43 -58.8 5.9 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 117.686 -1.149 . . . . 0.0 109.09 162.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 11.1 mt -63.55 -42.48 98.38 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.242 -2.132 . . . . 0.0 105.242 -171.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -62.46 -41.6 98.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 177.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 59.16 44.53 96.33 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 118.064 1.985 . . . . 0.0 118.064 175.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -132.16 -22.52 2.26 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 121.732 2.766 . . . . 0.0 115.966 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 25.1 mmt -92.49 56.57 2.76 Favored 'General case' 0 N--CA 1.448 -0.566 1 O-C-N 129.433 4.208 . . . . 0.0 108.019 168.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 64.4 p -93.22 176.16 6.5 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 125.603 1.814 . . . . 0.0 112.777 -148.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 51.69 -82.76 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 114.653 -2.594 . . . . 0.0 112.027 168.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -88.43 -24.57 22.99 Favored 'General case' 0 N--CA 1.451 -0.39 1 CA-C-N 126.803 4.365 . . . . 0.0 113.346 -174.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -83.79 -44.06 14.77 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 53.0 mt -45.52 -43.01 11.48 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 120.534 3.531 . . . . 0.0 120.534 163.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 30.3 mtmm -79.73 -38.84 32.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 116.564 2.061 . . . . 0.0 116.564 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -112.22 -17.62 12.73 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -162.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -107.21 -50.02 3.16 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.106 1.762 . . . . 0.0 114.398 168.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.56 -27.49 51.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.551 1.541 . . . . 0.0 112.355 170.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . 0.412 ' O ' HG22 ' D' ' 79' ' ' ILE . . . 84.92 -157.33 32.16 Favored Glycine 0 CA--C 1.522 0.505 1 O-C-N 113.496 -5.752 . . . . 0.0 118.206 136.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.67 -23.42 11.32 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.432 1.893 . . . . 0.0 114.11 -169.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.56 14.13 25.47 Favored Glycine 0 C--N 1.334 0.47 1 O-C-N 115.227 -4.671 . . . . 0.0 114.682 177.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . 0.412 HG22 ' O ' ' D' ' 76' ' ' GLY . 14.9 tt -93.59 -15.19 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.826 0 C-N-CA 117.9 -1.52 . . . . 0.0 108.598 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.15 -18.6 42.25 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 130.303 3.441 . . . . 0.0 108.802 176.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 95.7 m -84.62 -34.03 23.19 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 121.749 -0.594 . . . . 0.0 110.256 175.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 18.6 mm -87.07 -35.65 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 C-N-CA 127.421 2.288 . . . . 0.0 111.764 -178.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 11.5 p -118.39 4.46 11.82 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 116.879 -1.534 . . . . 0.0 114.386 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 33.1 mtp85 -119.66 -169.68 1.81 Allowed 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 120.453 1.479 . . . . 0.0 112.246 151.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.17 171.04 40.17 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.936 -159.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 90.4 p -71.43 -35.2 70.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 120.155 3.391 . . . . 0.0 120.155 -164.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -130.35 72.36 1.49 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 126.209 2.909 . . . . 0.0 104.678 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 6.5 p -88.26 -177.96 5.8 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 129.66 3.184 . . . . 0.0 111.579 173.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.07 -15.5 61.5 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 117.528 -3.232 . . . . 0.0 113.629 167.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -70.63 -25.81 63.19 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 161.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -78.96 -34.68 44.14 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -176.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 56.85 72.64 0.92 Allowed Pre-proline 0 N--CA 1.447 -0.612 0 O-C-N 126.582 2.426 . . . . 0.0 115.48 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . 0.595 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.326 0.1 OUTLIER 24.07 33.51 0.0 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.283 0 N-CA-C 116.502 1.693 . . . . 0.0 116.502 45.509 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 63.1 t -59.14 -31.17 45.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 173.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . 0.595 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.327 0.0 OUTLIER -67.91 -35.18 78.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.528 -2.607 . . . . 0.0 115.166 176.384 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 30.6 tp -66.89 -53.08 35.79 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 126.754 2.533 . . . . 0.0 107.043 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 23.8 ttp180 -52.28 -38.52 58.54 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 120.967 3.692 . . . . 0.0 120.967 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.18 -24.95 54.75 Favored 'General case' 0 N--CA 1.444 -0.729 0 O-C-N 126.23 2.206 . . . . 0.0 109.979 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 54.8 t90 -87.72 -41.12 13.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 127.693 3.12 . . . . 0.0 110.508 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 29.6 mt -60.61 -32.05 71.2 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 114.934 -2.46 . . . . 0.0 109.655 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -58.89 -44.79 91.26 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 123.013 2.642 . . . . 0.0 114.868 177.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -91.8 -5.35 53.61 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 129.186 2.994 . . . . 0.0 113.743 -173.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 98.8 t -95.44 -41.7 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 O-C-N 118.658 -2.526 . . . . 0.0 112.611 164.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 16.9 mt -97.17 -27.71 14.43 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 121.055 0.455 . . . . 0.0 111.538 -172.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.352 3.3 mp -108.38 54.98 0.65 Allowed 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 121.22 -0.925 . . . . 0.0 112.149 167.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -78.12 176.75 8.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 126.983 3.277 . . . . 0.0 112.789 -173.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 59.7 m -61.72 -27.16 68.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 117.424 2.379 . . . . 0.0 117.424 -172.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 130.831 3.652 . . . . 0.0 110.576 176.454 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 N--CA 1.447 -0.6 0 CA-C-O 115.95 -1.976 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.59 -25.6 68.04 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 120.329 1.422 . . . . 0.0 112.433 170.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -75.63 -38.9 58.53 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 117.682 -3.136 . . . . 0.0 109.817 175.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -66.0 -45.43 81.6 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.639 -0.696 . . . . 0.0 109.296 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -63.11 -22.2 66.7 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 128.729 2.811 . . . . 0.0 116.481 169.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -80.71 -48.91 11.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 125.543 1.777 . . . . 0.0 112.046 173.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -65.05 -20.82 66.67 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 125.526 1.53 . . . . 0.0 112.82 172.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -72.13 -48.95 39.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 170.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.42 ' CH2' HD13 ' B' ' 39' ' ' LEU . 0.2 OUTLIER -62.01 -37.16 83.8 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.56 2.744 . . . . 0.0 115.535 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . 0.299 51.9 mt -63.73 -13.77 46.45 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.812 1.645 . . . . 0.0 115.247 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -75.31 -26.65 58.84 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 118.343 -2.723 . . . . 0.0 117.633 173.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -68.25 -26.8 65.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 124.655 1.182 . . . . 0.0 111.446 163.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.7 t -80.6 -23.71 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 122.061 2.21 . . . . 0.0 114.287 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -77.57 -41.3 39.34 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 128.744 2.817 . . . . 0.0 114.892 161.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.0 tp -67.17 -40.97 86.69 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 124.937 1.398 . . . . 0.0 113.02 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.9 tp -70.23 -31.54 69.0 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 119.447 -2.033 . . . . 0.0 113.613 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -71.12 -38.09 72.31 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 127.361 2.913 . . . . 0.0 110.801 178.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -64.68 -37.87 89.06 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 174.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.87 -36.5 82.46 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 120.038 1.29 . . . . 0.0 113.42 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -54.28 -35.26 62.39 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 118.074 2.62 . . . . 0.0 118.074 166.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -74.02 -25.66 60.0 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.208 -2.182 . . . . 0.0 115.539 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -98.81 0.06 43.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 128.541 2.736 . . . . 0.0 113.172 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 39.42 35.69 0.18 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 118.242 2.682 . . . . 0.0 118.242 -155.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.1 mt -89.02 2.41 54.06 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -71.38 -43.8 66.17 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 117.705 -3.122 . . . . 0.0 115.946 -161.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.44 -42.56 5.27 Favored Pre-proline 0 N--CA 1.452 -0.356 0 CA-C-N 121.626 2.012 . . . . 0.0 107.193 -177.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -42.4 -55.61 2.49 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 124.991 3.794 . . . . 0.0 111.895 162.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 52.7 tp -64.88 -33.17 75.37 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 177.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.3 mt -77.86 -30.63 51.0 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 122.136 2.244 . . . . 0.0 110.781 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -65.41 -29.67 70.39 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 122.297 2.317 . . . . 0.0 112.92 165.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.4 tp -67.09 -49.4 65.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 117.451 -3.281 . . . . 0.0 109.689 171.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 32.6 mmt -76.52 -36.11 57.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 126.421 1.889 . . . . 0.0 115.578 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 48.2 mt -111.39 132.91 54.08 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 122.149 2.25 . . . . 0.0 115.153 -175.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.9 p -61.79 166.41 6.09 Favored Pre-proline 0 N--CA 1.448 -0.527 0 CA-C-O 114.393 -2.717 . . . . 0.0 117.573 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -64.86 -23.4 62.31 Favored 'Trans proline' 0 N--CA 1.452 -0.943 0 N-CA-C 119.684 2.917 . . . . 0.0 119.684 -177.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -94.48 -24.2 17.39 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 124.465 1.103 . . . . 0.0 111.533 -174.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -75.31 -22.29 57.79 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 118.416 -1.314 . . . . 0.0 111.124 168.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.3 mtm-85 -72.94 -48.94 32.46 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 114.948 -2.454 . . . . 0.0 109.443 172.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -66.69 -32.05 73.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 127.306 2.879 . . . . 0.0 112.618 175.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.96 -48.77 75.18 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.193 2.269 . . . . 0.0 110.517 167.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.5 mt -65.16 -45.05 86.51 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 116.598 -3.814 . . . . 0.0 113.792 -175.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.16 -36.61 83.05 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 118.779 2.272 . . . . 0.0 118.779 171.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.3 m -67.27 -34.65 77.85 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 119.788 -2.007 . . . . 0.0 114.102 173.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -69.19 -16.92 63.73 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 115.937 1.829 . . . . 0.0 115.937 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 52.3 t -72.34 -38.49 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 126.273 1.829 . . . . 0.0 109.457 167.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 33.5 ttt180 -61.79 -42.62 99.23 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 121.927 2.149 . . . . 0.0 112.045 167.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.1 mt -53.84 -50.97 48.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 3.3 t -76.25 -25.21 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -172.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -70.97 -52.5 19.41 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 116.293 -1.813 . . . . 0.0 106.355 171.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -69.61 -23.48 63.52 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 123.525 2.875 . . . . 0.0 115.282 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.311 80.6 mt -69.48 -49.23 56.75 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 128.553 2.741 . . . . 0.0 116.136 171.022 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 40.7 tp -65.81 -40.2 91.62 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 128.219 2.607 . . . . 0.0 111.407 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -74.97 -48.31 24.91 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.974 2.11 . . . . 0.0 111.302 172.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.6 16.17 75.8 Favored Glycine 0 C--O 1.224 -0.47 0 C-N-CA 124.829 1.204 . . . . 0.0 113.517 167.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -70.83 -44.88 65.6 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.235 -3.509 . . . . 0.0 113.174 173.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 50.9 mtp -79.78 124.45 28.62 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 131.612 3.965 . . . . 0.0 111.212 168.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.5 p -97.21 177.34 5.6 Favored 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 127.215 2.822 . . . . 0.0 112.804 -174.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -54.0 -44.68 71.1 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 118.981 -2.324 . . . . 0.0 114.863 -178.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 50.2 tpt85 -71.43 -29.02 64.39 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 125.747 1.905 . . . . 0.0 107.281 -175.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -73.23 -44.05 60.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 117.199 -1.381 . . . . 0.0 108.967 178.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 36.2 mt -70.13 -10.8 59.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 116.005 -1.95 . . . . 0.0 114.219 -175.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -75.33 -42.16 55.01 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 113.479 -3.153 . . . . 0.0 109.182 171.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -55.05 -31.71 61.34 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 128.436 3.585 . . . . 0.0 117.219 171.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -91.04 -41.33 11.14 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 118.443 -2.66 . . . . 0.0 114.724 -166.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 44.5 mt -109.51 -9.5 14.91 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -176.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 83.38 -29.38 3.59 Favored Glycine 0 C--N 1.339 0.709 0 CA-C-O 115.139 -3.034 . . . . 0.0 116.237 170.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -85.77 -159.18 0.44 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 117.984 2.587 . . . . 0.0 117.984 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.49 154.74 40.67 Favored Glycine 0 C--N 1.337 0.599 0 CA-C-O 116.809 -2.106 . . . . 0.0 111.348 -166.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.3 mt -59.62 -30.04 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-O 116.221 -1.847 . . . . 0.0 111.034 170.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.91 -18.57 65.33 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.628 2.467 . . . . 0.0 115.544 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 44.0 p -60.35 -29.59 69.0 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 118.137 -0.935 . . . . 0.0 111.895 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.9 mm -83.69 -53.67 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 C-N-CA 127.789 2.436 . . . . 0.0 105.153 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.2 m -54.4 -56.27 20.29 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.606 1.962 . . . . 0.0 112.786 -174.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -58.79 -36.34 74.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.77 -37.18 75.73 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 114.05 -1.432 . . . . 0.0 114.533 177.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 5.4 m -63.44 -51.27 66.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 113.447 -1.377 . . . . 0.0 111.122 173.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -62.42 -43.38 98.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 127.028 2.131 . . . . 0.0 111.576 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.9 m -65.65 -26.75 67.94 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 114.635 -2.602 . . . . 0.0 116.916 169.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.452 ' O ' ' HB3' ' A' ' 92' ' ' ALA . 19.7 tp -76.38 -34.15 58.88 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 127.418 2.949 . . . . 0.0 110.433 177.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -61.08 -31.75 71.41 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 118.032 2.604 . . . . 0.0 118.032 161.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -86.66 -4.76 59.22 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 124.284 1.992 . . . . 0.0 113.359 170.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 89' ' ' LEU . . . -58.46 150.53 54.87 Favored Pre-proline 0 N--CA 1.445 -0.684 0 O-C-N 117.934 -2.979 . . . . 0.0 115.636 167.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -65.8 158.04 55.82 Favored 'Trans proline' 0 N--CA 1.448 -1.176 1 C-N-CA 125.895 4.397 . . . . 0.0 108.787 162.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.5 m -77.35 -38.54 26.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 O-C-N 122.204 -0.31 . . . . 0.0 111.752 -166.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -59.68 -24.3 63.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 119.561 -1.962 . . . . 0.0 112.33 177.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 16.4 tp -67.02 -55.87 12.55 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 119.903 1.228 . . . . 0.0 113.138 172.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 46.2 mtm-85 -57.1 -45.8 83.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 115.708 1.744 . . . . 0.0 115.708 169.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -63.09 -28.53 70.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.164 -2.835 . . . . 0.0 111.852 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 29.7 t90 -73.49 -44.67 57.32 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 169.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 104' ' ' LEU . 70.7 mt -59.72 -27.89 66.86 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 115.449 -2.215 . . . . 0.0 109.751 174.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -74.3 -24.16 59.2 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 123.599 2.909 . . . . 0.0 115.024 175.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -86.28 -30.0 22.64 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.697 0.799 . . . . 0.0 112.666 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.4 t -84.37 -34.99 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 O-C-N 118.951 -2.343 . . . . 0.0 110.627 173.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 100' ' ' LEU . 27.3 mt -94.02 -45.3 7.65 Favored 'General case' 0 N--CA 1.45 -0.454 1 O-C-N 114.857 -4.902 . . . . 0.0 112.287 -167.07 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 56.8 mt -111.5 0.69 16.58 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 120.799 3.629 . . . . 0.0 120.799 -169.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.254 67.9 tttt . . . . . 0 N--CA 1.45 -0.469 0 O-C-N 116.473 -3.892 . . . . 0.0 113.748 -165.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.47 0 CA-C-O 123.326 1.536 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 13.1 mmt -63.01 -40.16 96.93 Favored 'General case' 0 N--CA 1.449 -0.496 1 O-C-N 115.948 -4.22 . . . . 0.0 112.885 176.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.01 -44.83 79.34 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.873 3.269 . . . . 0.0 111.545 -178.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -62.97 -30.93 71.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 120.791 1.632 . . . . 0.0 114.313 168.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -69.94 -36.56 75.39 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 114.555 -2.64 . . . . 0.0 111.314 172.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -72.71 -27.17 61.9 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 115.433 -2.222 . . . . 0.0 113.016 176.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -71.95 -36.6 69.92 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 124.822 3.465 . . . . 0.0 113.505 168.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -67.01 -37.14 83.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 117.103 -1.427 . . . . 0.0 110.302 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -72.84 -24.62 60.91 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 114.308 -2.758 . . . . 0.0 107.741 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 7.1 t-105 -69.5 -51.39 36.27 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 124.512 3.324 . . . . 0.0 108.965 169.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.65 -16.53 49.47 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 126.52 1.928 . . . . 0.0 115.441 177.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -64.03 -48.23 77.13 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.093 1.757 . . . . 0.0 110.733 173.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -56.54 -40.41 75.05 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.213 1.405 . . . . 0.0 113.185 173.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 14.0 t -80.61 -33.93 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 O-C-N 118.968 -2.332 . . . . 0.0 114.659 -178.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -66.78 -39.22 87.75 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.113 0.965 . . . . 0.0 113.067 169.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 25.4 tp -50.62 -63.38 1.14 Allowed 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 118.979 -2.326 . . . . 0.0 107.427 161.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.252 41.8 tp -59.72 -45.83 90.97 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 121.421 1.919 . . . . 0.0 115.244 -172.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -51.93 -43.17 63.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 116.828 2.159 . . . . 0.0 116.828 170.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -67.42 -37.5 83.14 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 116.677 2.103 . . . . 0.0 116.677 170.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.28 -38.37 52.39 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.498 1.919 . . . . 0.0 111.87 173.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -64.31 -48.14 76.76 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 128.176 2.591 . . . . 0.0 113.264 175.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -44.26 -31.86 1.13 Allowed 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 117.631 -3.168 . . . . 0.0 114.523 171.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -108.57 -3.84 17.68 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 129.46 3.104 . . . . 0.0 115.167 -175.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.33 4.9 m-20 60.28 10.68 2.48 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 -176.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -69.22 1.19 3.92 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 167.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -64.4 -44.7 90.46 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 115.868 -2.015 . . . . 0.0 114.97 -171.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 65.5 tp -72.58 -36.79 3.91 Favored Pre-proline 0 N--CA 1.447 -0.609 0 CA-C-N 121.631 2.014 . . . . 0.0 112.315 -173.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 0.8 OUTLIER -58.2 -29.35 87.24 Favored 'Trans proline' 0 N--CA 1.445 -1.349 0 N-CA-C 121.537 3.63 . . . . 0.0 121.537 161.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 27.2 tp -72.75 -35.29 67.47 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 172.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' LEU . . . . . 0.42 HD13 ' CH2' ' A' ' 19' ' ' TRP 0.253 60.8 mt -73.61 -22.81 59.91 Favored 'General case' 0 N--CA 1.445 -0.677 1 O-C-N 115.717 -4.364 . . . . 0.0 114.456 176.502 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -70.04 -33.41 71.93 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.836 0.854 . . . . 0.0 108.952 171.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 48.8 tp -84.26 -46.63 11.63 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.077 1.751 . . . . 0.0 106.343 -178.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 15.7 mmt -86.12 -17.41 35.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 123.861 0.726 . . . . 0.0 112.296 -161.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mp -126.34 138.4 53.57 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 120.867 -1.146 . . . . 0.0 112.521 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 46.8 p -78.64 161.52 69.05 Favored Pre-proline 0 N--CA 1.446 -0.626 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -46.68 -45.39 20.04 Favored 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 123.012 2.475 . . . . 0.0 114.261 175.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.48 -36.08 68.7 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 126.626 3.108 . . . . 0.0 117.338 177.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -90.56 -25.17 20.34 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 112.062 -2.336 . . . . 0.0 113.22 -178.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 62.8 mtm-85 -61.09 -35.11 76.11 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 119.421 3.119 . . . . 0.0 119.421 155.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -73.05 -35.65 66.75 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 126.332 2.27 . . . . 0.0 111.826 174.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.35 -53.73 53.85 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 115.442 -2.218 . . . . 0.0 110.358 167.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.282 33.1 mt -63.93 -52.34 60.24 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 121.595 1.998 . . . . 0.0 112.609 178.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.97 -27.12 12.68 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 118.456 2.142 . . . . 0.0 118.456 173.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 32.0 m -80.87 -50.63 9.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 116.132 -1.89 . . . . 0.0 112.806 163.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -53.18 -32.48 48.09 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 122.774 2.534 . . . . 0.0 110.104 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.4 -41.05 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 O-C-N 117.253 -3.404 . . . . 0.0 107.78 176.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -80.92 -26.34 36.83 Favored 'General case' 0 N--CA 1.449 -0.497 1 O-C-N 114.898 -4.876 . . . . 0.0 112.265 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 68.7 mt -65.58 -45.18 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 O-C-N 118.918 -2.364 . . . . 0.0 108.436 173.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 65.6 t -69.66 -36.92 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 O-C-N 117.943 -2.973 . . . . 0.0 108.92 -179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -61.92 -47.34 85.38 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 124.357 2.027 . . . . 0.0 113.834 169.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -74.92 -22.02 58.86 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 116.359 -3.963 . . . . 0.0 111.94 -177.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 79.8 mt -70.3 -14.83 62.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.764 0.826 . . . . 0.0 111.601 167.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 84.2 mt -106.77 -13.81 15.16 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.421 1.088 . . . . 0.0 113.511 177.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 20.4 ttm105 -87.41 -47.57 8.67 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.162 -2.836 . . . . 0.0 111.962 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 65.37 69.9 1.23 Allowed Glycine 0 C--N 1.334 0.465 1 O-C-N 130.018 4.574 . . . . 0.0 115.201 -175.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -139.39 -30.69 0.71 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 119.745 1.773 . . . . 0.0 113.511 176.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 33.2 mtt -81.62 134.67 35.51 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.132 2.271 . . . . 0.0 117.132 -172.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 83.0 p -81.88 168.6 17.76 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 128.574 3.671 . . . . 0.0 112.218 179.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.404 ' HA ' HD12 ' B' ' 71' ' ' LEU . 67.1 mt-30 -64.22 -17.25 63.38 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 121.291 1.859 . . . . 0.0 114.658 -175.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -74.03 -51.11 16.87 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 168.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -75.11 -22.56 58.14 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 116.619 -2.032 . . . . 0.0 115.981 -175.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' B' ' 68' ' ' GLN . 78.5 mt -57.66 -45.48 85.47 Favored 'General case' 0 N--CA 1.451 -0.417 1 CA-C-O 131.311 5.339 . . . . 0.0 111.79 170.101 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -66.33 -28.32 68.58 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 117.958 -2.964 . . . . 0.0 113.021 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -87.29 -75.56 0.4 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 121.614 2.007 . . . . 0.0 116.241 167.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -56.58 -33.56 66.3 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 120.563 3.542 . . . . 0.0 120.563 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 29.5 mt -101.11 -8.75 21.98 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 120.014 1.279 . . . . 0.0 109.726 169.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.54 7.49 40.75 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-O 118.285 -1.286 . . . . 0.0 112.421 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.36 156.89 21.73 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 -174.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.17 158.2 52.17 Favored Glycine 0 C--N 1.334 0.434 0 CA-C-N 110.737 -2.938 . . . . 0.0 113.922 167.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 37.3 mm -71.16 -31.85 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 C-N-CA 124.331 1.052 . . . . 0.0 111.634 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.76 -43.81 90.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 120.368 -1.458 . . . . 0.0 114.169 165.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 3.5 m -54.19 -36.9 63.92 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 113.319 -3.229 . . . . 0.0 111.56 169.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 19.2 mm -73.0 -40.66 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 O-C-N 126.361 2.288 . . . . 0.0 105.265 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 32.2 m -74.85 -33.87 62.19 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 115.586 1.698 . . . . 0.0 115.586 -167.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -49.43 -44.1 45.15 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 114.634 -2.603 . . . . 0.0 112.478 155.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.4 -55.34 15.78 Favored Glycine 0 C--N 1.335 0.479 0 C-N-CA 126.387 1.946 . . . . 0.0 111.789 177.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 2.4 p -50.52 -37.37 38.78 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 123.574 3.687 . . . . 0.0 114.189 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -71.31 -35.69 71.36 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 119.741 -1.85 . . . . 0.0 115.57 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 44.3 m -67.3 -27.96 67.6 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 166.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.91 -42.67 66.44 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.156 1.535 . . . . 0.0 109.977 178.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -67.53 -38.91 84.91 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 172.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.14 -4.51 39.15 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 115.423 -2.227 . . . . 0.0 113.229 177.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.41 157.8 55.46 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 120.626 1.557 . . . . 0.0 111.331 -169.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -54.91 132.94 55.05 Favored 'Trans proline' 0 N--CA 1.45 -1.082 1 C-N-CA 125.841 4.361 . . . . 0.0 110.461 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.309 16.6 m -59.8 -26.39 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 116.158 1.91 . . . . 0.0 116.158 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.309 17.5 pm0 -49.57 -52.67 28.53 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 126.681 1.993 . . . . 0.0 114.53 165.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 17.4 tp -63.32 -42.82 99.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 124.894 2.283 . . . . 0.0 108.344 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 60.5 mtp85 -63.62 -47.4 81.53 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.855 -1.778 . . . . 0.0 113.858 -175.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -61.37 -37.92 85.14 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 115.584 -2.151 . . . . 0.0 115.009 170.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 16.7 t90 -70.68 -38.13 73.71 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 119.97 1.259 . . . . 0.0 108.519 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 26.1 mt -68.58 -37.49 79.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 119.826 1.194 . . . . 0.0 111.86 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -65.56 -38.71 90.34 Favored 'General case' 0 N--CA 1.445 -0.678 1 O-C-N 115.443 -4.535 . . . . 0.0 114.841 173.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -62.18 -55.21 30.87 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 118.893 -2.379 . . . . 0.0 112.181 164.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.23 -34.5 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 C-N-CA 123.139 0.575 . . . . 0.0 110.015 -164.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 87.9 mt -90.38 -49.72 6.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 118.688 2.847 . . . . 0.0 118.688 -176.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 19.1 mt -82.59 -34.31 27.71 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.488 1.613 . . . . 0.0 112.921 -166.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -67.3 -16.69 64.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.971 164.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 48.9 m -103.05 6.12 38.51 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.935 -2.978 . . . . 0.0 118.944 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.312 33.6 t70 . . . . . 0 C--O 1.25 1.084 0 N-CA-C 120.112 3.375 . . . . 0.0 120.112 -169.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 1' ' ' MET . . . . . . . . . . . . 0.257 6.1 mtt . . . . . 0 N--CA 1.469 0.516 0 CA-C-O 123.926 1.822 . . . . 0.0 106.951 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.94 179.25 7.82 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 125.745 1.618 . . . . 0.0 112.629 179.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -151.28 119.25 6.22 Favored 'General case' 0 N--CA 1.448 -0.529 1 O-C-N 116.115 -4.116 . . . . 0.0 107.519 -171.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -108.3 149.47 28.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.443 -2.036 . . . . 0.0 107.685 171.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 25.0 p -129.94 148.16 68.45 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 103.476 -2.787 . . . . 0.0 103.476 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -53.6 -38.93 84.42 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.071 2.514 . . . . 0.0 118.12 -171.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -145.98 166.27 26.53 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 117.568 -3.208 . . . . 0.0 107.021 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 3.1 t -154.55 132.15 11.35 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 105.143 -2.169 . . . . 0.0 105.143 170.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.35 -41.33 89.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.44 1.496 . . . . 0.0 112.676 168.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.25 86.84 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 119.028 -2.295 . . . . 0.0 111.384 177.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 37.4 mtt -60.61 -35.6 76.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 120.046 -1.659 . . . . 0.0 113.086 171.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.76 -25.2 63.7 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.116 1.366 . . . . 0.0 113.659 168.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -71.02 -26.57 63.17 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 122.679 1.228 . . . . 0.0 109.036 171.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -77.29 -38.61 50.33 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.247 -2.783 . . . . 0.0 108.665 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -37.1 86.32 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 124.193 1.949 . . . . 0.0 112.039 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -62.76 -41.63 99.31 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 112.813 -1.994 . . . . 0.0 105.985 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 -69.95 -24.32 63.33 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 117.828 -3.045 . . . . 0.0 112.346 178.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -62.93 -48.41 79.04 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 126.088 2.851 . . . . 0.0 114.206 169.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 54.9 t-105 -55.58 -42.44 74.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 116.453 -3.904 . . . . 0.0 118.058 160.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 3.8 mp -63.08 -15.16 55.7 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 122.019 2.19 . . . . 0.0 115.975 167.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 43.6 ttt-85 -87.43 -32.55 19.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 122.539 1.162 . . . . 0.0 111.363 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -54.48 -42.65 70.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.449 -3.282 . . . . 0.0 113.112 157.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 17.1 t -78.79 -26.93 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 126.462 1.905 . . . . 0.0 107.115 -171.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -83.02 -29.38 28.94 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.418 0.687 . . . . 0.0 112.627 172.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 33.2 tp -68.26 -47.3 68.09 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 121.078 -1.014 . . . . 0.0 111.03 172.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 67.2 tp -68.36 -32.11 71.96 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -176.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -55.46 -53.37 57.19 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.825 -2.422 . . . . 0.0 109.381 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -68.3 -22.58 64.71 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 125.976 2.048 . . . . 0.0 116.051 174.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.89 -27.34 65.7 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 116.869 -3.645 . . . . 0.0 113.454 -177.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -61.23 -30.95 70.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 117.795 2.517 . . . . 0.0 117.795 167.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -71.91 -22.24 61.51 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 118.345 2.72 . . . . 0.0 118.345 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 51.0 p-10 -114.8 24.19 11.99 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 120.264 -1.522 . . . . 0.0 112.342 161.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.331 18.3 m-20 57.21 24.42 9.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.914 2.486 . . . . 0.0 114.767 173.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 mt -85.96 -12.44 50.43 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 173.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -40.39 -56.3 2.05 Favored 'General case' 0 N--CA 1.448 -0.529 1 O-C-N 115.621 -4.425 . . . . 0.0 114.035 174.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 81.0 mt -68.53 -48.13 33.94 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-O 116.802 -1.57 . . . . 0.0 111.925 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 37' ' ' PRO . . . . . . . . . . . . 0.31 30.3 Cg_endo -55.69 -25.32 50.25 Favored 'Trans proline' 0 N--CA 1.449 -1.098 1 C-N-CA 127.279 5.32 . . . . 0.0 115.216 168.666 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild core ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -73.92 -48.15 32.78 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 123.178 2.717 . . . . 0.0 107.109 172.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 84.8 mt -63.99 -25.34 68.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 125.752 1.907 . . . . 0.0 114.723 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -68.19 -27.79 66.71 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 119.352 0.978 . . . . 0.0 112.809 165.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 14.2 tp -78.59 -55.18 5.39 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 126.634 3.112 . . . . 0.0 110.969 172.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 55.3 mmm -67.76 -18.25 64.81 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 121.679 3.955 . . . . 0.0 121.679 -168.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 43' ' ' LEU . . . . . . . . . . . . 0.269 8.5 mp -131.5 165.37 23.72 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 117.971 -2.956 . . . . 0.0 106.156 -178.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 29.3 p -91.51 154.54 44.29 Favored Pre-proline 0 N--CA 1.449 -0.509 0 C-N-CA 124.935 1.294 . . . . 0.0 112.226 165.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_exo -49.71 -31.26 24.94 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 N-CA-C 115.596 1.345 . . . . 0.0 115.596 167.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.65 -24.92 60.06 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 176.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -76.68 -36.33 57.34 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 120.416 -1.427 . . . . 0.0 113.929 168.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 48' ' ' ARG . . . . . . . . . . . . 0.252 90.3 mtm-85 -57.82 -37.69 74.25 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 115.193 -2.337 . . . . 0.0 109.856 176.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -70.41 -53.34 16.88 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 128.954 3.909 . . . . 0.0 109.319 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 50' ' ' ALA . . . . . . . . . . . . 0.343 . . -44.88 -49.87 10.7 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 116.301 -3.999 . . . . 0.0 117.715 165.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 33.6 mt -63.81 -44.14 94.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 117.102 -1.427 . . . . 0.0 112.817 177.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.45 -26.59 69.65 Favored Glycine 0 CA--C 1.523 0.54 0 O-C-N 126.409 2.318 . . . . 0.0 111.309 -177.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 6.0 m -80.65 -32.95 36.01 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.41 -2.818 . . . . 0.0 114.241 173.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.25 91.1 mtt180 -71.71 -19.77 62.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 115.801 -2.047 . . . . 0.0 113.092 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 55' ' ' VAL . . . . . 0.424 ' HA ' ' HE1' ' D' ' 42' ' ' MET . 23.7 t -69.14 -40.79 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 C-N-CA 128.045 2.538 . . . . 0.0 109.977 162.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -68.75 -37.0 79.09 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 112.158 -3.782 . . . . 0.0 110.507 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 57' ' ' ILE . . . . . 0.492 HG23 HD23 ' C' ' 75' ' ' LEU . 37.7 mt -60.39 -43.11 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 O-C-N 126.576 2.422 . . . . 0.0 109.25 175.05 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 47.4 t -67.48 -42.36 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 120.917 1.69 . . . . 0.0 111.297 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -51.0 -49.31 60.64 Favored 'General case' 0 N--CA 1.449 -0.514 1 C-N-CA 131.707 4.003 . . . . 0.0 114.479 166.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -64.56 -38.23 90.28 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 118.193 -2.817 . . . . 0.0 114.479 173.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 20.1 mt -78.23 -30.53 48.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 122.406 2.366 . . . . 0.0 109.642 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 35.1 mt -80.4 -22.21 41.5 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.56 -3.212 . . . . 0.0 114.443 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -66.76 -37.16 84.08 Favored 'General case' 0 N--CA 1.449 -0.494 1 C-N-CA 134.502 5.121 . . . . 0.0 110.218 169.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.25 19.75 64.42 Favored Glycine 0 CA--C 1.521 0.431 0 CA-C-O 116.629 -2.206 . . . . 0.0 114.423 177.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -96.83 -30.76 12.98 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -171.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 18.8 mmt -55.3 142.75 30.68 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 118.003 2.594 . . . . 0.0 118.003 166.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 30.7 p -95.18 170.17 9.58 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 129.543 3.137 . . . . 0.0 109.005 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.57 -35.21 75.52 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 116.19 -1.862 . . . . 0.0 113.014 -172.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 32.8 ttp180 -67.47 -41.73 84.15 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 120.935 1.698 . . . . 0.0 115.456 172.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.11 -35.53 64.15 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 -175.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 24.2 mt -57.99 -21.1 42.98 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.311 3.044 . . . . 0.0 110.341 169.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -106.34 -29.64 9.64 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 123.87 3.032 . . . . 0.0 112.688 175.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -97.78 -37.33 9.9 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 115.539 1.681 . . . . 0.0 115.539 -174.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -90.04 -43.47 10.49 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 119.438 -2.039 . . . . 0.0 109.939 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 75' ' ' LEU . . . . . 0.492 HD23 HG23 ' C' ' 57' ' ' ILE . 10.9 mp -86.04 9.03 18.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-O 124.275 1.988 . . . . 0.0 114.922 173.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 58.97 -142.13 46.62 Favored Glycine 0 C--N 1.337 0.597 1 C-N-CA 130.834 4.064 . . . . 0.0 112.238 161.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.36 -26.8 23.18 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 119.469 -2.195 . . . . 0.0 113.413 164.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.13 2.81 3.68 Favored Glycine 0 CA--C 1.525 0.713 1 CA-C-O 112.586 -4.452 . . . . 0.0 116.41 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tt -66.67 -40.38 86.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 120.748 2.274 . . . . 0.0 115.259 165.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.49 -23.78 52.01 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.474 2.31 . . . . 0.0 115.775 171.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 1.7 m -71.75 -28.32 63.58 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 119.885 -1.76 . . . . 0.0 112.704 169.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 9.2 mm -92.65 -22.91 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 1 O-C-N 115.525 -4.485 . . . . 0.0 117.127 -171.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 73.0 p -123.32 -1.23 8.68 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 118.177 2.658 . . . . 0.0 118.177 -164.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 69.1 mtp85 -125.8 158.93 33.74 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 129.021 2.929 . . . . 0.0 111.575 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 76.96 164.08 19.64 Favored Glycine 0 C--O 1.224 -0.497 0 O-C-N 121.168 -0.957 . . . . 0.0 112.807 -177.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 66.7 m -67.96 -7.98 33.25 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 112.205 -3.76 . . . . 0.0 117.016 -163.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -117.82 18.62 14.01 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 131.078 3.751 . . . . 0.0 112.697 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 17.0 p -68.38 178.19 2.07 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 89' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' C' ' 89' ' ' LEU . 20.4 tp -59.86 -38.59 82.56 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 118.468 -1.293 . . . . 0.0 112.338 -173.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.346 94.1 mttt -101.75 6.41 41.74 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 127.537 2.335 . . . . 0.0 117.027 -176.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -120.61 -9.07 9.44 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 125.189 1.396 . . . . 0.0 112.135 167.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.19 160.21 18.13 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-O 125.743 2.687 . . . . 0.0 112.276 164.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -58.57 125.68 19.06 Favored 'Trans proline' 0 N--CA 1.447 -1.217 1 C-N-CA 126.221 4.614 . . . . 0.0 110.5 -177.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 50.7 t -37.64 -41.08 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 125.851 1.66 . . . . 0.0 110.711 178.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.9 pm0 -74.88 -18.3 60.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 116.285 -1.817 . . . . 0.0 110.83 -174.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -81.43 -38.42 26.48 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 122.596 2.453 . . . . 0.0 110.694 165.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 68.0 mtp180 -59.37 -52.42 65.72 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 118.605 -2.559 . . . . 0.0 110.096 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -47.6 -54.23 12.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 126.241 2.213 . . . . 0.0 114.521 166.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -66.12 -42.1 89.66 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.316 -1.311 . . . . 0.0 114.046 -173.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 61.0 mt -61.49 -48.53 80.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.449 1.9 . . . . 0.0 108.984 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -45.67 -41.42 10.37 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 116.721 -3.737 . . . . 0.0 118.823 164.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -73.95 -32.62 63.57 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.607 1.163 . . . . 0.0 109.529 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 38.9 t -88.38 -46.42 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 -175.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 51.0 mt -82.84 -18.55 40.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 117.63 -3.169 . . . . 0.0 113.028 -158.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 35.0 mt -118.33 3.31 11.92 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 120.573 1.533 . . . . 0.0 114.797 -173.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.352 21.6 pttp . . . . . 0 N--CA 1.449 -0.479 0 C-N-CA 129.771 3.228 . . . . 0.0 111.53 -170.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 98.1 p . . . . . 0 N--CA 1.448 -0.539 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -92.24 -23.35 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.927 0 N-CA-C 116.717 1.776 . . . . 0.0 116.717 175.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -151.12 129.56 12.11 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.63 3.172 . . . . 0.0 106.377 -169.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.83 137.64 42.0 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 112.444 -2.162 . . . . 0.0 110.854 176.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.24 -30.98 69.77 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 120.255 -1.528 . . . . 0.0 111.377 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.56 -14.89 59.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 114.897 -2.478 . . . . 0.0 111.695 175.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 7.2 mmt -70.25 -27.37 64.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 121.782 2.083 . . . . 0.0 113.73 169.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.45 -41.66 72.54 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 120.622 -1.299 . . . . 0.0 112.291 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 21.4 tp10 -63.4 -36.22 83.0 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 113.591 -3.1 . . . . 0.0 107.014 170.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -73.92 -34.84 64.51 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 121.533 1.969 . . . . 0.0 107.797 -174.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 15' ' ' ARG . . . . . 0.408 ' HE ' ' HA ' ' D' ' 15' ' ' ARG 0.298 0.0 OUTLIER -65.63 -29.37 69.94 Favored 'General case' 0 N--CA 1.447 -0.62 1 O-C-N 114.432 -5.168 . . . . 0.0 113.728 -176.997 . . . . . . . . 5 4 . 1 . 015 nuclear nobuild core ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -77.63 -29.72 51.89 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 167.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -73.87 -28.4 61.55 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 123.003 1.382 . . . . 0.0 111.04 -178.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -89.56 -18.1 27.25 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 120.325 -1.484 . . . . 0.0 107.652 -176.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 -76.06 -47.35 24.99 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 116.914 -1.517 . . . . 0.0 111.251 162.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.48 -35.38 80.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.196 2.295 . . . . 0.0 117.196 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -63.94 -26.31 68.53 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 118.143 -1.423 . . . . 0.0 113.982 170.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -62.85 -53.46 53.79 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 113.844 -2.979 . . . . 0.0 111.142 166.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.62 -35.09 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 121.179 1.809 . . . . 0.0 110.716 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.33 -41.3 81.0 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 170.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 13.4 tp -63.73 -48.66 76.13 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 26' ' ' LEU . . . . . 0.472 HD13 HD21 ' D' ' 39' ' ' LEU . 53.7 tp -51.67 -48.12 63.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 115.36 -2.257 . . . . 0.0 116.402 173.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 19.5 ttpp -59.32 -52.32 66.17 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 125.397 1.685 . . . . 0.0 110.078 174.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -61.62 -33.83 74.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.713 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.75 -38.75 89.97 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 123.674 2.943 . . . . 0.0 114.975 171.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -61.65 -29.89 70.36 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 123.769 1.747 . . . . 0.0 115.535 172.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -81.28 -25.18 36.75 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -177.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 32' ' ' ASN . . . . . . . . . . . . 0.329 54.3 p30 -102.74 3.74 37.24 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 120.56 -1.338 . . . . 0.0 114.011 164.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.254 1.7 m-20 63.72 26.5 14.51 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 128.744 2.818 . . . . 0.0 113.337 177.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 43.9 mt -93.71 16.86 12.94 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 165.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -52.22 -58.42 6.67 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 126.972 2.109 . . . . 0.0 110.152 174.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.415 22.6 mt -41.87 -63.86 0.78 Allowed Pre-proline 0 N--CA 1.448 -0.549 0 C-N-CA 128.05 2.54 . . . . 0.0 110.964 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -58.87 -36.65 96.6 Favored 'Trans proline' 0 N--CA 1.451 -0.992 0 CA-C-O 114.81 -2.246 . . . . 0.0 115.916 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 33.1 tp -56.0 -54.41 45.16 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 125.226 3.648 . . . . 0.0 112.292 171.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 39' ' ' LEU . . . . . 0.472 HD21 HD13 ' D' ' 26' ' ' LEU . 88.6 mt -62.55 -31.63 72.45 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 115.846 -2.026 . . . . 0.0 110.652 176.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -74.71 -28.35 60.76 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 117.236 -1.786 . . . . 0.0 114.474 170.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -74.07 -51.9 14.31 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 118.44 -2.662 . . . . 0.0 108.615 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 42' ' ' MET . . . . . 0.424 ' HE1' ' HA ' ' C' ' 55' ' ' VAL . 24.8 mmt -63.36 -43.63 97.11 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 113.827 -2.987 . . . . 0.0 116.664 173.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 61.4 mt -121.26 142.58 49.79 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 124.81 3.459 . . . . 0.0 107.144 -166.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 38.9 p -77.65 159.26 77.19 Favored Pre-proline 0 N--CA 1.444 -0.738 0 C-N-CA 129.848 3.259 . . . . 0.0 115.729 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -41.84 -50.35 5.08 Favored 'Trans proline' 0 N--CA 1.451 -0.99 0 O-C-N 125.052 2.08 . . . . 0.0 114.341 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -73.53 -20.63 60.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 122.285 2.311 . . . . 0.0 116.288 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -70.32 -38.27 74.87 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 123.321 2.782 . . . . 0.0 109.946 170.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 26.0 mtm-85 -74.16 -36.6 64.11 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 118.36 2.726 . . . . 0.0 118.36 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.44 -45.62 84.5 Favored 'General case' 0 N--CA 1.447 -0.62 0 O-C-N 128.672 3.732 . . . . 0.0 114.018 161.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.77 -36.68 62.56 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 117.174 2.287 . . . . 0.0 117.174 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 47.4 mt -62.18 -32.02 72.6 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 120.063 -1.648 . . . . 0.0 107.671 171.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.93 -41.69 71.39 Favored Glycine 0 C--N 1.338 0.677 0 O-C-N 119.109 -2.244 . . . . 0.0 112.365 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 24.8 m -62.77 -31.52 72.5 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.05 2.14 . . . . 0.0 112.971 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 54' ' ' ARG . . . . . 0.463 ' HA ' ' HB ' ' D' ' 57' ' ' ILE . 24.3 mtt180 -71.6 -24.68 61.94 Favored 'General case' 0 N--CA 1.448 -0.544 1 O-C-N 116.134 -4.104 . . . . 0.0 111.834 -177.086 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.66 -43.26 98.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 O-C-N 118.694 -2.504 . . . . 0.0 111.044 170.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.357 3.7 ptm180 -81.92 -25.63 34.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 172.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 57' ' ' ILE . . . . . 0.463 ' HB ' ' HA ' ' D' ' 54' ' ' ARG . 54.0 mt -67.0 -32.84 59.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 122.024 0.129 . . . . 0.0 110.775 170.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 57.9 t -68.94 -48.25 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.69 165.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -70.15 -27.1 64.27 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 117.721 -1.592 . . . . 0.0 115.095 -174.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -74.96 -7.93 55.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 116.242 -1.837 . . . . 0.0 113.898 165.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.13 -7.75 55.1 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 121.691 2.041 . . . . 0.0 114.288 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 44.0 mt -97.65 -35.75 10.49 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 165.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -75.33 -32.41 60.9 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 112.08 -3.819 . . . . 0.0 111.768 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 47.03 55.4 8.57 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 121.042 3.177 . . . . 0.0 121.042 168.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -130.73 -30.19 1.86 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.082 1.353 . . . . 0.0 107.579 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 22.5 mmt -94.88 51.83 1.42 Allowed 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.844 2.458 . . . . 0.0 106.18 172.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 59.1 p -66.34 171.01 5.21 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 112.194 -2.276 . . . . 0.0 115.277 -169.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.303 6.6 tp-100 49.86 -89.28 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.73 1.612 . . . . 0.0 114.774 166.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -80.82 -35.14 33.3 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.273 -2.767 . . . . 0.0 110.238 -172.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -78.24 -31.69 49.37 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 126.459 1.904 . . . . 0.0 112.294 -172.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mt -51.67 -31.1 24.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.82 1.648 . . . . 0.0 113.566 168.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -104.63 -38.65 6.65 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 128.055 2.542 . . . . 0.0 108.43 -172.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -111.33 -14.32 13.8 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 121.982 2.174 . . . . 0.0 113.141 -164.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -118.32 -24.66 6.82 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 113.346 -3.216 . . . . 0.0 115.555 167.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 75' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' D' ' 75' ' ' LEU . 2.5 mm? -83.86 -27.55 28.61 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.332 2.333 . . . . 0.0 110.752 162.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 95.13 -175.34 33.44 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 129.64 3.495 . . . . 0.0 115.647 169.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.293 . . -68.64 -10.73 57.9 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 119.887 -1.949 . . . . 0.0 115.803 -164.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.39 -23.82 43.35 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 127.415 2.436 . . . . 0.0 111.094 169.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -46.5 -33.56 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 175.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -100.67 -4.56 28.08 Favored 'General case' 0 N--CA 1.45 -0.452 1 O-C-N 116.085 -4.135 . . . . 0.0 114.678 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 53.3 m -67.86 -33.45 74.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 120.19 1.359 . . . . 0.0 109.75 148.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.389 41.1 mm -85.85 -24.32 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 C-N-CA 131.449 3.899 . . . . 0.0 112.597 -168.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 66.7 p -129.55 6.68 5.23 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 112.106 -2.315 . . . . 0.0 115.203 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -134.16 177.21 7.92 Favored 'General case' 0 N--CA 1.452 -0.354 1 O-C-N 114.616 -5.053 . . . . 0.0 108.318 165.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 84.03 157.59 25.92 Favored Glycine 0 C--N 1.337 0.587 0 O-C-N 117.043 -3.536 . . . . 0.0 111.634 -147.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 38.7 p -72.09 -26.78 62.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 118.888 2.922 . . . . 0.0 118.888 -166.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -133.54 85.81 2.24 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 124.925 2.298 . . . . 0.0 109.62 -170.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 88' ' ' SER . . . . . 0.474 ' H ' ' HB3' ' D' ' 91' ' ' ALA . 59.5 p -131.25 -169.28 2.15 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.644 2.778 . . . . 0.0 109.301 175.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.392 5.4 mp -87.85 27.85 1.1 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 124.091 1.9 . . . . 0.0 109.886 -177.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -107.17 10.59 30.0 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 119.879 -1.763 . . . . 0.0 115.006 147.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 91' ' ' ALA . . . . . 0.474 ' HB3' ' H ' ' D' ' 88' ' ' SER . . . -144.65 -3.81 0.79 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 112.414 -3.66 . . . . 0.0 109.818 -162.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 92' ' ' ALA . . . . . 0.498 ' HA ' ' N ' ' D' ' 94' ' ' VAL . . . 66.01 85.85 0.15 Allowed Pre-proline 0 N--CA 1.448 -0.564 0 CA-C-N 124.676 3.398 . . . . 0.0 117.91 169.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.309 0.0 OUTLIER 30.42 23.23 0.0 OUTLIER 'Cis proline' 0 N--CA 1.451 -1.018 0 N-CA-C 121.107 3.464 . . . . 0.0 121.107 17.373 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' D' D ' 94' ' ' VAL . . . . . 0.498 ' N ' ' HA ' ' D' ' 92' ' ' ALA . 15.1 t -65.74 -31.91 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 119.571 1.078 . . . . 0.0 110.526 161.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.358 0.0 OUTLIER -78.52 -36.76 44.38 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 128.716 2.806 . . . . 0.0 109.607 -178.769 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' D' D ' 96' ' ' LEU . . . . . . . . . . . . 0.286 16.3 tp -55.96 -57.41 12.2 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.718 168.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 26.4 ttp-105 -49.09 -40.57 32.46 Favored 'General case' 0 N--CA 1.451 -0.381 1 CA-C-O 110.793 -4.432 . . . . 0.0 115.75 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -62.35 -24.12 67.17 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 127.7 3.125 . . . . 0.0 115.183 177.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -98.22 -35.12 10.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.661 -3.149 . . . . 0.0 110.84 175.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 48.0 mt -53.46 -39.74 64.71 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 120.631 1.559 . . . . 0.0 114.839 168.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 101' ' ' GLU . . . . . . . . . . . . 0.297 15.5 tt0 -80.05 -13.13 59.54 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 117.016 -1.874 . . . . 0.0 107.986 -176.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -104.59 4.76 33.18 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 119.244 -2.16 . . . . 0.0 113.611 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 2.5 t -123.49 -27.06 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 114.401 -2.714 . . . . 0.0 113.73 162.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 29.0 mt -92.99 -27.39 17.05 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 123.985 3.084 . . . . 0.0 118.261 166.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.313 74.7 mt -114.66 30.45 7.32 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 122.615 2.462 . . . . 0.0 107.628 172.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -61.49 174.71 0.7 Allowed 'General case' 0 N--CA 1.449 -0.481 1 C-N-CA 131.993 4.117 . . . . 0.0 111.626 -174.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 14.6 m -58.13 -38.1 75.89 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 112.776 -2.011 . . . . 0.0 113.655 -169.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.953 2.501 . . . . 0.0 115.423 -174.478 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 ttp . . . . . 0 N--CA 1.467 0.411 0 N-CA-C 117.144 2.276 . . . . 0.0 117.144 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . 0.256 . . -58.11 -27.95 64.19 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 121.622 2.01 . . . . 0.0 114.75 -176.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -45.92 -51.51 13.12 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 128.195 2.598 . . . . 0.0 112.727 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -64.07 -30.52 71.59 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 111.747 -2.479 . . . . 0.0 113.134 -174.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.3 p -90.29 175.73 3.53 Favored Pre-proline 0 N--CA 1.447 -0.599 0 CA-C-O 117.284 -1.341 . . . . 0.0 114.598 -165.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -74.11 -33.99 5.4 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 123.028 2.486 . . . . 0.0 112.785 -169.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -133.7 128.3 34.67 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 119.11 -2.244 . . . . 0.0 110.4 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 24.1 t -104.41 114.75 29.19 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 118.514 -2.617 . . . . 0.0 112.956 168.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.39 -4.05 56.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 115.612 -2.137 . . . . 0.0 115.046 168.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . 0.265 . . -86.79 -42.35 13.36 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 115.834 -2.031 . . . . 0.0 108.376 177.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.1 ttm -64.56 -33.29 75.56 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 121.859 2.118 . . . . 0.0 109.299 173.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.2 -39.98 84.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.973 1.471 . . . . 0.0 114.973 171.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -74.42 -46.52 39.57 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -54.37 -52.94 60.07 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 118.968 0.804 . . . . 0.0 112.173 176.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -60.2 -37.0 78.92 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 173.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 40.5 t60 -62.71 -48.99 76.86 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 115.321 -2.276 . . . . 0.0 113.762 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -66.78 -36.57 82.71 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 121.127 1.785 . . . . 0.0 113.889 175.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.3 mt-10 -58.69 -33.47 70.19 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 117.47 -3.269 . . . . 0.0 110.963 169.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -77.74 -40.81 39.86 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 117.881 2.549 . . . . 0.0 117.881 175.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.8 mt -63.08 -17.88 62.77 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 117.825 2.528 . . . . 0.0 117.825 172.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -62.21 -52.28 64.42 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 115.275 -2.298 . . . . 0.0 109.991 167.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -53.47 -46.14 69.84 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 127.346 2.904 . . . . 0.0 108.358 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.8 t -72.46 -19.86 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 O-C-N 117.056 -3.527 . . . . 0.0 116.767 -179.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -83.77 -39.02 20.57 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 117.516 -3.24 . . . . 0.0 112.543 163.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.4 tp -49.11 -52.28 26.88 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 124.466 2.079 . . . . 0.0 112.838 170.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 55.8 tp -81.24 -16.5 52.49 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 118.14 -2.85 . . . . 0.0 108.792 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -64.27 -49.85 70.25 Favored 'General case' 0 N--CA 1.449 -0.481 1 CA-C-N 126.014 4.006 . . . . 0.0 108.771 168.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 58.0 m-20 -71.34 -15.08 62.38 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 118.47 -2.644 . . . . 0.0 112.832 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.17 -36.8 61.45 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 115.265 -2.303 . . . . 0.0 115.457 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -63.0 -37.22 86.3 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.217 2.207 . . . . 0.0 116.003 170.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -67.16 -9.54 41.02 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 113.071 -1.877 . . . . 0.0 114.151 171.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -120.71 4.59 10.57 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.723 -2.486 . . . . 0.0 112.6 173.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.322 13.2 m-20 56.93 29.39 16.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 116.385 1.995 . . . . 0.0 116.385 -170.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.7 mt -102.71 0.61 33.26 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 117.802 -3.061 . . . . 0.0 115.3 175.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 36.5 p-80 -57.24 -45.75 83.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.927 2.091 . . . . 0.0 110.983 173.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.354 77.2 mt -55.44 -51.44 79.95 Favored Pre-proline 0 N--CA 1.445 -0.69 2 O-C-N 115.938 -4.226 . . . . 0.0 113.368 178.064 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -77.73 -37.77 0.83 Allowed 'Trans proline' 0 N--CA 1.449 -1.126 0 CA-C-O 115.634 -1.903 . . . . 0.0 108.95 -176.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.6 tp -58.6 -40.79 84.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 120.035 1.289 . . . . 0.0 113.562 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 81.3 mt -70.62 -36.98 73.76 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 116.031 -1.938 . . . . 0.0 113.376 174.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -62.16 -23.15 66.42 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 119.469 3.137 . . . . 0.0 119.469 166.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.0 tp -74.25 -48.3 29.56 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 125.872 1.982 . . . . 0.0 115.7 166.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 79.0 mmm -77.29 -8.78 58.19 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.384 -1.293 . . . . 0.0 113.692 -167.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 53.2 mt -144.51 128.84 17.86 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 125.245 1.591 . . . . 0.0 113.741 -166.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 62.3 p -71.78 152.38 93.31 Favored Pre-proline 0 N--CA 1.446 -0.644 0 CA-C-O 122.281 1.038 . . . . 0.0 109.528 176.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -62.38 -13.07 30.55 Favored 'Trans proline' 0 N--CA 1.446 -1.297 0 C-N-CA 122.607 2.205 . . . . 0.0 114.398 -174.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.97 -27.17 18.86 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 119.406 -2.059 . . . . 0.0 112.205 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.81 -46.39 78.81 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 158.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 60.8 mtm-85 -63.2 -40.82 98.59 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 117.971 -1.492 . . . . 0.0 111.286 -178.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -62.03 -36.69 82.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 115.242 1.571 . . . . 0.0 115.242 166.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.24 -25.78 66.26 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 117.322 -3.361 . . . . 0.0 113.798 173.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.1 mt -76.81 -40.9 46.42 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 124.956 2.313 . . . . 0.0 115.348 -177.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -47.23 -56.42 7.99 Favored Glycine 0 CA--C 1.523 0.567 0 CA-C-N 110.85 -2.886 . . . . 0.0 117.065 161.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.1 m -71.86 -35.2 69.74 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 112.542 -1.829 . . . . 0.0 114.311 175.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 60.4 mtt180 -61.75 -34.96 76.78 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 121.229 1.831 . . . . 0.0 111.275 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.4 t -59.29 -42.13 86.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 O-C-N 117.126 -3.484 . . . . 0.0 109.241 171.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -72.73 -26.32 61.53 Favored 'General case' 0 N--CA 1.449 -0.492 1 O-C-N 115.461 -4.525 . . . . 0.0 112.033 -178.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 52.7 mt -67.6 -47.04 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 117.126 -1.416 . . . . 0.0 107.696 178.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.4 t -62.99 -38.57 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-O 116.412 -1.756 . . . . 0.0 112.069 171.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -61.84 -49.62 75.54 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 125.127 3.603 . . . . 0.0 112.704 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -76.08 -18.07 59.35 Favored 'General case' 0 N--CA 1.448 -0.546 1 CA-C-O 111.047 -4.311 . . . . 0.0 114.18 -173.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 34.9 mt -77.55 -33.02 54.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 124.944 3.52 . . . . 0.0 111.795 160.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.2 mt -78.1 -26.42 48.03 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 119.566 -0.854 . . . . 0.0 112.189 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -85.42 -30.99 23.13 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 123.682 1.706 . . . . 0.0 114.855 172.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.25 25.32 61.77 Favored Glycine 0 C--N 1.339 0.718 0 O-C-N 117.203 -3.436 . . . . 0.0 115.749 161.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -110.88 -36.46 5.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 120.544 2.172 . . . . 0.0 110.047 -170.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 55.6 mtp -64.08 139.76 58.8 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 174.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 54.0 p -83.83 173.36 11.33 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 111.793 -2.458 . . . . 0.0 111.442 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -70.72 -28.61 64.86 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 177.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.46 ' NH2' HD21 ' A' ' 73' ' ' ASN . 34.7 ttt85 -80.74 -34.79 34.09 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 114.083 -2.865 . . . . 0.0 107.656 175.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -65.37 -42.93 92.2 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 120.71 1.595 . . . . 0.0 108.761 175.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 40.4 mt -68.13 -20.26 64.89 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 123.083 2.674 . . . . 0.0 110.02 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -87.33 -38.82 15.89 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 120.787 1.63 . . . . 0.0 108.659 -177.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.46 HD21 ' NH2' ' A' ' 69' ' ' ARG . 7.5 m120 -77.11 -30.9 55.47 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 117.002 2.223 . . . . 0.0 117.002 174.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -101.59 -37.9 8.18 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 121.265 1.848 . . . . 0.0 112.215 -170.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.8 mt -106.75 -8.55 16.77 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 130.348 3.459 . . . . 0.0 115.22 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 88.28 -15.43 56.33 Favored Glycine 0 CA--C 1.526 0.742 0 O-C-N 120.033 -1.667 . . . . 0.0 114.717 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.48 119.6 16.92 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 126.833 2.053 . . . . 0.0 115.5 -159.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.59 179.15 26.67 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 119.377 2.511 . . . . 0.0 119.377 172.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 76.1 mt -53.15 -47.86 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 117.838 -1.077 . . . . 0.0 108.141 163.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.36 -49.48 72.15 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -176.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 93.1 m -65.5 -48.84 71.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.814 0.816 . . . . 0.0 110.958 -167.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.6 mm -65.51 -26.8 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 124.663 2.173 . . . . 0.0 114.917 175.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 55.9 m -71.62 -40.3 69.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 119.433 -2.042 . . . . 0.0 111.075 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 60.9 ttt180 -79.17 -31.45 43.9 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 127.799 2.439 . . . . 0.0 106.15 -176.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -58.37 -55.06 32.79 Favored Glycine 0 CA--C 1.521 0.436 0 O-C-N 120.013 -1.679 . . . . 0.0 112.307 165.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.6 m -69.2 -19.61 63.98 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -81.82 -38.92 24.77 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 116.316 -3.99 . . . . 0.0 107.239 174.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.3 m -66.02 -28.61 68.99 Favored 'General case' 0 N--CA 1.451 -0.415 1 O-C-N 116.192 -4.067 . . . . 0.0 116.589 171.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.85 -42.03 22.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 117.55 -3.219 . . . . 0.0 107.997 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 31.6 mttm -62.85 -27.08 69.09 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 125.328 1.643 . . . . 0.0 114.274 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.56 -17.25 20.59 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 126.043 1.737 . . . . 0.0 112.792 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.57 153.08 11.07 Favored Pre-proline 0 N--CA 1.45 -0.443 0 O-C-N 119.032 -2.293 . . . . 0.0 113.959 165.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -76.42 155.94 36.63 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 N-CA-C 109.279 -1.085 . . . . 0.0 109.279 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 21.5 m -66.57 -37.32 79.32 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-O 126.397 2.999 . . . . 0.0 113.578 -175.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.4 pm0 -62.46 -19.18 63.27 Favored 'General case' 0 N--CA 1.447 -0.598 1 O-C-N 114.939 -4.851 . . . . 0.0 116.947 170.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 50.8 tp -83.08 -38.67 22.18 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 124.378 1.049 . . . . 0.0 111.805 169.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -73.56 -34.29 65.09 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 117.932 -1.507 . . . . 0.0 109.525 -175.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -68.43 -33.43 74.19 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 177.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 84.0 t90 -81.7 -26.83 34.31 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.871 2.068 . . . . 0.0 112.711 -176.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 75.6 mt -69.92 -44.97 68.56 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 116.609 -3.807 . . . . 0.0 115.75 164.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -64.34 -2.85 2.42 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 163.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -91.08 -62.94 1.34 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 119.584 -0.847 . . . . 0.0 109.42 154.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 77.9 t -66.98 -35.81 75.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-O 118.096 -0.954 . . . . 0.0 109.032 -154.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 33.1 mt -96.01 -7.02 37.5 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 117.698 -3.127 . . . . 0.0 110.794 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 50.4 mt -124.32 7.61 8.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 123.452 2.842 . . . . 0.0 111.857 -172.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.286 60.1 tttt -107.54 -15.89 14.49 Favored 'General case' 0 N--CA 1.444 -0.735 0 O-C-N 117.133 -3.479 . . . . 0.0 114.635 -177.082 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.5 t -75.19 -32.31 61.19 Favored 'General case' 0 N--CA 1.45 -0.449 1 N-CA-C 123.13 4.493 . . . . 0.0 123.13 175.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 . . . . . 0 C--O 1.249 1.072 1 C-N-CA 132.539 4.336 . . . . 0.0 114.512 166.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 39.8 ttp . . . . . 0 N--CA 1.473 0.725 0 CA-C-O 116.205 -1.855 . . . . 0.0 115.602 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.41 -26.42 64.62 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 122.544 2.429 . . . . 0.0 115.233 -159.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -76.89 -13.52 59.98 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 124.797 1.311 . . . . 0.0 111.64 173.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -95.59 -30.74 13.64 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 120.261 -1.524 . . . . 0.0 108.145 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . 0.421 ' HA ' ' HD3' ' B' ' 6' ' ' PRO . 16.0 m -67.63 149.92 98.08 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.664 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' B' ' 5' ' ' SER . 23.4 Cg_exo -72.05 -16.55 28.81 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 CA-C-O 112.809 -3.08 . . . . 0.0 115.988 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -142.9 142.66 31.79 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 124.255 3.207 . . . . 0.0 113.414 161.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 30.2 t -125.09 110.22 13.87 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.561 1.945 . . . . 0.0 111.227 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.02 -21.5 54.5 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 119.553 -1.967 . . . . 0.0 114.313 173.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.52 -40.56 68.72 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 118.493 2.775 . . . . 0.0 118.493 163.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 26.2 ttm -76.68 -29.63 56.4 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 113.808 -2.996 . . . . 0.0 109.948 173.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . 0.295 . . -62.22 -44.15 97.22 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 123.364 2.802 . . . . 0.0 110.588 170.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.5 tp10 -61.6 -56.43 19.99 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 115.976 -1.964 . . . . 0.0 112.45 170.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -45.6 -43.1 11.96 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 171.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . 0.26 39.4 mmt180 -70.13 -42.05 73.11 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 119.246 -2.159 . . . . 0.0 115.706 171.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 28.9 t60 -57.59 -41.88 82.07 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 117.326 -3.359 . . . . 0.0 112.588 171.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -75.51 -25.21 57.06 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 113.519 -3.134 . . . . 0.0 115.093 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -59.15 -45.58 90.6 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 122.682 2.492 . . . . 0.0 115.574 158.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 53.2 t-105 -64.04 -52.6 58.66 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.586 2.354 . . . . 0.0 116.811 175.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 89.1 mt -56.16 -31.67 63.6 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 117.295 -3.378 . . . . 0.0 111.625 169.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -69.84 -32.08 70.3 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 122.324 2.329 . . . . 0.0 106.748 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -65.24 -48.46 73.21 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 117.317 -1.325 . . . . 0.0 112.669 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 95.9 t -60.2 -49.84 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 CA-C-O 112.362 -3.685 . . . . 0.0 112.259 175.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -50.58 -45.92 57.54 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 124.892 3.496 . . . . 0.0 114.845 167.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 24.5 tp -56.92 -45.97 82.32 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 27.2 tp -73.44 -26.63 61.02 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 47.2 tttt -73.0 -43.26 62.36 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 116.763 -1.589 . . . . 0.0 110.125 176.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -62.42 -44.01 97.45 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 164.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.8 70.21 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 119.55 -1.969 . . . . 0.0 112.64 -175.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -68.38 -30.56 69.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.456 -2.652 . . . . 0.0 111.132 171.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -80.92 -4.34 54.6 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.118 -0.989 . . . . 0.0 113.291 174.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . 0.265 1.1 m-80 -124.67 13.27 8.65 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 116.304 -1.808 . . . . 0.0 113.237 170.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 53.76 23.43 3.73 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 117.064 2.246 . . . . 0.0 117.064 -175.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 25.1 mt -98.72 15.48 25.16 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 126.512 2.382 . . . . 0.0 112.313 172.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -74.4 -41.65 60.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 123.189 2.722 . . . . 0.0 113.534 -168.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 20.5 mt -69.99 -44.98 22.59 Favored Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-O 117.344 -1.312 . . . . 0.0 113.001 176.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -50.48 -46.21 30.56 Favored 'Trans proline' 0 N--CA 1.452 -0.968 0 CA-C-N 124.257 2.556 . . . . 0.0 113.475 170.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 61.2 tp -56.87 -52.23 65.93 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 127.187 2.195 . . . . 0.0 113.268 178.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 29.9 mt -60.48 -35.34 75.68 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 116.013 -1.946 . . . . 0.0 115.625 178.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -70.78 -32.3 69.37 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 128.336 2.655 . . . . 0.0 113.39 171.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 57.8 tp -67.55 -36.18 80.47 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 121.903 -0.498 . . . . 0.0 112.107 165.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 96.7 mmm -90.64 -24.77 20.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 121.553 3.909 . . . . 0.0 121.553 -178.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 10.1 mt -125.69 131.63 52.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 114.3 -2.762 . . . . 0.0 109.28 -176.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . 0.252 73.0 p -71.55 153.69 93.54 Favored Pre-proline 0 N--CA 1.447 -0.583 0 O-C-N 128.545 3.653 . . . . 0.0 118.979 175.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_exo -44.87 -45.25 14.0 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.53 2.82 . . . . 0.0 108.568 -175.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -41.45 80.81 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.011 2.069 . . . . 0.0 114.376 -177.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.12 -39.46 90.09 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.084 2.153 . . . . 0.0 110.975 171.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 48.4 mtm-85 -71.38 -41.82 69.2 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.86 1.664 . . . . 0.0 110.891 -177.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.271 37.1 tt0 -68.88 -31.49 70.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 174.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.47 -35.91 73.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.812 -1.089 . . . . 0.0 111.527 172.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 12.9 mt -75.06 -33.1 61.67 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 116.505 -3.872 . . . . 0.0 112.899 176.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.75 -29.8 75.26 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 117.453 -2.308 . . . . 0.0 116.32 172.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 99.3 m -80.56 -33.27 36.29 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 126.83 2.135 . . . . 0.0 109.278 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -59.65 -30.7 68.92 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 118.366 2.728 . . . . 0.0 118.366 173.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 9.4 t -65.75 -45.63 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 174.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -70.29 -31.61 69.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.108 -1.425 . . . . 0.0 112.988 177.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 68.5 mt -68.03 -39.67 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 123.311 2.778 . . . . 0.0 109.537 178.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.388 78.5 t -78.38 -41.07 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 128.057 2.543 . . . . 0.0 112.982 -175.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -48.57 -46.88 39.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 123.384 1.564 . . . . 0.0 109.898 167.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -76.73 -35.73 57.6 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 119.435 -2.041 . . . . 0.0 109.705 -171.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 39.5 mt -67.39 -17.38 64.71 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.801 -1.571 . . . . 0.0 111.945 174.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 70.4 mt -94.19 -29.76 14.95 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 114.429 -2.701 . . . . 0.0 114.428 168.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 26.2 ttm105 -72.23 -37.2 69.24 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 130.286 3.434 . . . . 0.0 109.745 173.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.98 18.59 64.73 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 128.52 2.962 . . . . 0.0 117.919 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -115.71 54.18 0.82 Allowed 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 129.93 3.959 . . . . 0.0 115.351 -171.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 6.8 mtt -144.71 146.62 32.3 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 129.52 3.128 . . . . 0.0 111.956 164.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 91.4 p -81.16 175.57 10.53 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 117.42 2.378 . . . . 0.0 117.42 161.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -64.85 -38.58 91.46 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 119.487 -2.008 . . . . 0.0 112.055 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . 0.41 HH21 ' HD2' ' B' ' 69' ' ' ARG . 20.0 ttt85 -56.01 -54.3 46.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 122.373 1.082 . . . . 0.0 113.235 174.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -58.16 -48.86 78.97 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.486 1.915 . . . . 0.0 112.937 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.41 -34.83 77.52 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 118.338 -2.726 . . . . 0.0 116.995 166.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 tptt -66.63 -36.02 81.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 121.627 2.012 . . . . 0.0 110.507 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -102.35 -45.15 5.18 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 120.876 -1.14 . . . . 0.0 108.997 -162.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -87.36 -34.72 18.71 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -171.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 63.7 mt -109.97 -10.93 14.7 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 117.23 2.308 . . . . 0.0 117.23 173.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.04 21.79 70.08 Favored Glycine 0 CA--C 1.526 0.73 0 C-N-CA 126.837 2.161 . . . . 0.0 111.614 177.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -103.74 96.17 6.52 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 122.423 3.111 . . . . 0.0 111.006 -177.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.37 178.61 41.28 Favored Glycine 0 C--N 1.335 0.489 0 O-C-N 126.127 2.142 . . . . 0.0 110.212 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 19.8 mt -42.12 -54.87 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 114.331 -0.935 . . . . 0.0 111.639 174.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.41 -56.0 11.15 Favored 'General case' 0 N--CA 1.451 -0.378 1 N-CA-C 121.856 4.021 . . . . 0.0 121.856 177.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 17.3 m -58.71 -47.17 85.47 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 173.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 40.7 mm -52.81 -45.61 50.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 124.581 1.152 . . . . 0.0 113.279 166.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 3.5 m -61.94 -36.92 82.83 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 123.962 1.839 . . . . 0.0 112.404 179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -84.3 -27.96 27.45 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 117.578 -3.201 . . . . 0.0 109.456 -174.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.17 -38.89 28.53 Favored Glycine 0 C--N 1.334 0.434 0 O-C-N 118.435 -2.666 . . . . 0.0 111.694 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 18.8 m -65.03 -49.41 70.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 129.311 3.044 . . . . 0.0 107.658 175.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -52.55 -50.02 63.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 127.558 2.343 . . . . 0.0 111.313 170.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 13.5 m -66.06 -33.45 75.83 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.961 -1.712 . . . . 0.0 114.246 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 13.4 mt -61.45 -42.56 98.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 123.798 0.839 . . . . 0.0 112.861 167.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 39.3 mttm -65.73 -38.31 88.79 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 125.509 1.755 . . . . 0.0 113.551 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.06 -25.41 62.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.954 1.701 . . . . 0.0 111.875 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.38 165.74 6.46 Favored Pre-proline 0 N--CA 1.45 -0.464 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -69.11 162.1 43.12 Favored 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.788 2.326 . . . . 0.0 112.645 168.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 m -74.67 -30.56 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 O-C-N 119.109 -2.245 . . . . 0.0 111.156 171.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -70.85 -20.02 62.59 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.481 2.312 . . . . 0.0 111.254 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' B' ' 96' ' ' LEU . 13.3 tp -75.88 -56.46 4.65 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 114.538 -2.649 . . . . 0.0 110.1 167.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 92.9 mtm-85 -56.51 -46.67 80.41 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 121.22 1.827 . . . . 0.0 109.893 -178.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -59.25 -30.35 68.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.729 -176.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 80.5 t90 -96.89 -33.09 11.74 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.066 -2.271 . . . . 0.0 112.488 -173.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.55 -33.38 73.75 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 118.664 -1.214 . . . . 0.0 111.798 166.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.7 -32.49 74.08 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 117.284 2.327 . . . . 0.0 117.284 171.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -75.32 -16.59 60.4 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 112.732 -2.031 . . . . 0.0 115.319 169.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 48.7 t -103.26 -41.14 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 O-C-N 117.069 -3.519 . . . . 0.0 115.416 171.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 88.6 mt -85.07 -35.47 21.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 121.903 2.138 . . . . 0.0 115.266 -168.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 33.2 mt -101.62 -10.34 20.14 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 118.828 -2.42 . . . . 0.0 109.543 -171.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -77.88 -7.69 57.06 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.339 1.855 . . . . 0.0 112.308 174.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . 0.25 14.4 m -89.36 -17.68 28.38 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.67 2.388 . . . . 0.0 116.549 178.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.27 70.4 m-20 . . . . . 0 C--O 1.248 0.986 0 C-N-CA 129.183 2.993 . . . . 0.0 109.129 171.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 62.4 ttp . . . . . 0 N--CA 1.474 0.751 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.92 168.96 11.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 120.491 1.496 . . . . 0.0 107.051 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -133.4 149.53 51.82 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.499 -2.626 . . . . 0.0 109.789 176.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -157.22 138.71 13.9 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 105.834 -1.913 . . . . 0.0 105.834 -177.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 32.6 p -139.91 171.4 7.94 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 130.62 3.568 . . . . 0.0 111.808 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -50.05 -33.42 34.72 Favored 'Trans proline' 0 N--CA 1.446 -1.278 0 N-CA-C 119.477 2.837 . . . . 0.0 119.477 174.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -151.02 148.06 27.89 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 115.851 -2.023 . . . . 0.0 107.109 -161.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 26.0 t -150.55 131.37 14.13 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 168.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.06 -23.66 60.59 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 114.653 -2.594 . . . . 0.0 113.269 167.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.85 -35.04 78.64 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 113.026 -3.369 . . . . 0.0 114.426 169.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 53.9 mtt -68.98 -43.23 75.34 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 127.178 2.799 . . . . 0.0 108.635 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . 0.254 . . -57.2 -37.62 72.48 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 174.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 25.1 tp10 -64.96 -28.31 69.43 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 117.438 -3.289 . . . . 0.0 116.61 170.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -72.84 -44.94 60.81 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 120.373 -1.454 . . . . 0.0 113.401 170.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -36.15 71.76 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 126.144 1.778 . . . . 0.0 111.994 167.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -61.92 -44.89 95.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 120.251 -1.53 . . . . 0.0 111.234 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -75.52 -22.05 57.45 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 177.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -62.39 -45.22 94.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.838 1.255 . . . . 0.0 111.931 167.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 23.6 t-105 -59.5 -52.71 64.41 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 123.459 1.6 . . . . 0.0 114.423 169.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 15.3 mt -69.14 -24.63 64.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.148 -1.387 . . . . 0.0 112.858 -171.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -78.1 -32.35 50.55 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 117.17 -1.395 . . . . 0.0 113.555 165.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -58.9 -58.77 7.16 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 117.75 -1.58 . . . . 0.0 113.576 168.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.56 -46.42 95.03 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-O 122.452 1.12 . . . . 0.0 110.451 -171.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -58.74 -42.71 89.45 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 -177.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 60.9 tp -67.67 -46.51 72.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 131.389 3.876 . . . . 0.0 107.064 172.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.75 -31.46 72.46 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 128.015 3.322 . . . . 0.0 114.819 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . 0.32 27.3 ttpp -65.21 -41.33 94.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 117.621 2.452 . . . . 0.0 117.621 162.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -58.49 -27.57 64.57 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 124.327 3.239 . . . . 0.0 114.557 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.76 -38.01 86.41 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.757 1.623 . . . . 0.0 113.765 177.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -60.94 -16.75 46.07 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 177.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -82.71 -21.33 34.85 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 34.1 p-10 -126.62 8.03 6.95 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.374 2.0 m-20 73.59 23.18 2.47 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 119.862 -1.774 . . . . 0.0 114.006 175.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 19.6 mt -85.61 5.57 31.18 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 122.026 2.194 . . . . 0.0 114.626 171.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -67.85 -43.48 79.37 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.203 -2.811 . . . . 0.0 116.557 -166.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.295 82.5 mt -72.1 -43.35 10.28 Favored Pre-proline 0 N--CA 1.45 -0.435 0 O-C-N 125.245 1.591 . . . . 0.0 114.139 170.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.61 -32.03 95.86 Favored 'Trans proline' 0 N--CA 1.447 -1.206 0 CA-C-O 124.57 1.821 . . . . 0.0 113.627 172.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 19.2 tp -72.39 -33.93 67.55 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.358 -2.714 . . . . 0.0 115.837 172.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 40.4 mt -77.33 -28.27 53.06 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.93 0.892 . . . . 0.0 109.757 173.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -73.46 -31.17 63.63 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 131.015 3.726 . . . . 0.0 109.883 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -72.29 -51.05 22.58 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 128.206 2.603 . . . . 0.0 115.766 168.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 91.7 mmm -85.4 -29.11 24.67 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.147 -1.406 . . . . 0.0 110.632 -164.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 9.1 mp -115.61 153.26 31.57 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 119.308 0.958 . . . . 0.0 110.153 -175.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 11.9 p -75.59 159.04 82.47 Favored Pre-proline 0 N--CA 1.449 -0.477 0 C-N-CA 127.03 2.132 . . . . 0.0 112.514 163.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.61 -24.77 46.79 Favored 'Trans proline' 0 N--CA 1.451 -1.024 1 C-N-CA 126.404 4.736 . . . . 0.0 116.446 173.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.76 -26.85 25.59 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 125.029 1.332 . . . . 0.0 109.412 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -77.37 -35.24 54.66 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 118.668 0.667 . . . . 0.0 112.558 172.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 86.6 mtm-85 -55.43 -52.17 64.49 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 124.955 1.302 . . . . 0.0 111.615 166.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -69.27 -39.51 78.34 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 115.603 -2.141 . . . . 0.0 110.846 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.39 -46.37 88.88 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.629 2.013 . . . . 0.0 111.454 169.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . 0.265 28.8 mt -63.89 -27.48 69.18 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 120.273 1.397 . . . . 0.0 113.658 -174.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.85 -25.1 42.67 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 117.62 1.808 . . . . 0.0 117.62 174.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 24.3 m -74.2 -37.56 63.87 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 116.015 -1.945 . . . . 0.0 112.07 166.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -56.78 -38.58 72.71 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 128.973 2.909 . . . . 0.0 114.877 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 69.1 t -59.31 -43.99 91.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 115.806 -2.045 . . . . 0.0 108.997 170.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 48.9 mtp180 -68.11 -34.13 75.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 122.006 2.185 . . . . 0.0 110.487 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . 0.434 HG22 HG13 ' C' ' 82' ' ' ILE . 50.0 mt -72.51 -36.85 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 120.009 -1.682 . . . . 0.0 111.735 176.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 78.4 t -56.83 -47.59 82.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 N-CA-C 118.086 2.625 . . . . 0.0 118.086 160.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -53.91 -48.24 70.35 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 129.113 2.965 . . . . 0.0 115.92 175.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -69.06 -19.37 64.08 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 117.124 -1.417 . . . . 0.0 111.825 -177.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 95.8 mt -89.0 -30.07 19.01 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.161 -1.876 . . . . 0.0 114.666 177.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 37.8 mt -64.44 -43.86 92.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 119.357 0.981 . . . . 0.0 111.703 165.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -62.74 -51.04 68.71 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 127.405 2.282 . . . . 0.0 113.464 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.36 -5.05 79.27 Favored Glycine 0 C--N 1.338 0.644 0 CA-C-O 115.355 -2.914 . . . . 0.0 112.383 158.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -69.65 -15.16 63.13 Favored 'General case' 0 N--CA 1.447 -0.599 1 N-CA-C 121.879 4.029 . . . . 0.0 121.879 -174.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . 0.263 39.2 mtt -59.44 127.1 30.37 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 129.902 3.281 . . . . 0.0 110.199 173.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 96.4 p -81.47 168.29 18.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 125.517 1.761 . . . . 0.0 109.71 175.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -56.83 -26.28 57.89 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 117.061 -1.447 . . . . 0.0 114.248 174.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 mtp-105 -69.44 -26.21 64.49 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 126.448 1.899 . . . . 0.0 112.553 167.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -99.78 -34.31 10.21 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 128.126 2.57 . . . . 0.0 116.653 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . 0.25 24.7 mt -62.5 -22.51 66.32 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.88 -1.763 . . . . 0.0 109.251 168.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 53.4 tttp -91.11 -53.74 4.24 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 125.467 1.729 . . . . 0.0 113.689 168.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -104.87 -1.02 26.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 119.39 3.108 . . . . 0.0 119.39 -166.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 23.9 tp10 -122.74 -31.94 3.62 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 128.698 2.799 . . . . 0.0 116.502 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 tp -88.93 -31.39 18.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 121.464 -0.772 . . . . 0.0 112.583 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 93.05 -179.37 39.49 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-O 117.828 -1.54 . . . . 0.0 116.235 172.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -58.75 -21.13 54.69 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 125.168 2.413 . . . . 0.0 112.308 169.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.67 -15.47 18.76 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-O 124.894 2.386 . . . . 0.0 116.547 171.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 6.0 tt -70.16 -34.38 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 120.276 -1.72 . . . . 0.0 112.451 176.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.89 -27.29 68.04 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 171.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 25.2 m -72.63 -27.75 62.33 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 122.22 2.282 . . . . 0.0 110.414 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . 0.434 HG13 HG22 ' C' ' 57' ' ' ILE 0.317 39.2 mm -97.56 -22.8 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 126.876 2.07 . . . . 0.0 116.173 -173.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 39.4 p -118.39 -3.14 10.98 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 120.833 3.642 . . . . 0.0 120.833 -176.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -126.18 153.06 45.16 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 117.865 -3.022 . . . . 0.0 111.962 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 94.13 167.64 37.33 Favored Glycine 0 C--N 1.335 0.505 0 N-CA-C 117.484 1.754 . . . . 0.0 117.484 -172.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 93.9 p -80.61 2.92 23.7 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 117.854 2.539 . . . . 0.0 117.854 -174.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -117.72 -9.65 10.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.962 -1.971 . . . . 0.0 112.607 171.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 57.5 p -47.77 168.28 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 120.109 3.374 . . . . 0.0 120.109 -173.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 tp -53.78 -38.96 65.01 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 120.714 3.598 . . . . 0.0 120.714 -163.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.256 57.1 mttt -88.51 -12.56 42.56 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 124.808 1.318 . . . . 0.0 114.406 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.13 -10.63 41.2 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 129.789 3.235 . . . . 0.0 112.242 169.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.05 150.59 69.56 Favored Pre-proline 0 N--CA 1.446 -0.648 0 CA-C-O 115.142 -2.361 . . . . 0.0 112.997 172.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -39.06 141.21 0.39 Allowed 'Trans proline' 0 N--CA 1.45 -1.054 0 C-N-CA 123.794 2.996 . . . . 0.0 118.45 166.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 2.1 t -59.78 -45.28 94.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 CA-C-O 113.536 -3.126 . . . . 0.0 110.441 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.6 pm0 -61.12 -16.87 49.01 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 121.145 1.793 . . . . 0.0 115.414 -176.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 14.8 tp -82.64 -41.54 19.32 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 117.017 2.229 . . . . 0.0 117.017 164.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -60.82 -37.17 81.08 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 116.519 -3.863 . . . . 0.0 110.038 176.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -71.23 -35.02 71.32 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.971 1.708 . . . . 0.0 111.68 175.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -75.11 -40.27 59.99 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 31.1 mt -61.35 -36.71 80.95 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.972 1.709 . . . . 0.0 109.744 -175.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -66.99 -27.92 67.84 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 170.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -79.36 -17.64 54.07 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 122.504 2.411 . . . . 0.0 111.137 174.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 92.8 t -108.93 -28.77 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 O-C-N 117.901 -2.999 . . . . 0.0 114.28 -176.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 65.9 mt -95.79 -45.9 6.8 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 122.079 0.942 . . . . 0.0 109.696 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 33.1 mt -92.98 16.85 11.73 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 120.992 -1.068 . . . . 0.0 113.271 -171.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -52.05 163.38 0.36 Allowed 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 118.506 -2.621 . . . . 0.0 116.813 157.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -132.12 39.24 3.44 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 117.426 -3.296 . . . . 0.0 109.124 172.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 25.1 t70 . . . . . 0 C--O 1.251 1.18 0 CA-C-N 121.77 2.077 . . . . 0.0 112.721 -160.523 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 29.5 ttp . . . . . 0 N--CA 1.47 0.565 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.04 122.46 16.12 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 -162.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -150.18 58.14 0.96 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -170.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -84.44 148.67 26.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 123.588 0.755 . . . . 0.0 111.003 -173.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 21.0 p -126.62 153.13 75.45 Favored Pre-proline 0 N--CA 1.447 -0.583 0 C-N-CA 124.333 1.053 . . . . 0.0 108.519 175.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 99.5 Cg_exo -53.25 -49.91 15.82 Favored 'Trans proline' 0 N--CA 1.449 -1.142 1 C-N-CA 125.651 4.234 . . . . 0.0 115.522 177.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -151.35 126.05 9.61 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.341 1.856 . . . . 0.0 114.547 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 14.5 t -47.12 113.66 0.71 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 166.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.16 -44.83 32.71 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 113.244 -1.798 . . . . 0.0 109.686 171.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.88 -26.47 62.36 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.612 2.078 . . . . 0.0 116.612 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . 0.431 ' O ' ' HD2' ' D' ' 15' ' ' ARG . 17.8 mmt -71.32 -31.22 67.16 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 126.058 2.098 . . . . 0.0 111.244 168.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.42 -21.99 52.23 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 118.374 -2.704 . . . . 0.0 111.064 176.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -79.22 -34.87 42.43 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 119.817 1.189 . . . . 0.0 109.705 166.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -62.39 -43.3 99.13 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 123.666 1.698 . . . . 0.0 111.325 -177.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . 0.431 ' HD2' ' O ' ' D' ' 11' ' ' MET . 0.0 OUTLIER -64.57 -33.14 75.21 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 118.99 2.959 . . . . 0.0 118.99 169.719 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -72.51 -12.88 61.26 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 119.089 -2.257 . . . . 0.0 113.228 166.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 57.0 mm-40 -94.09 -32.54 13.73 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 118.894 2.924 . . . . 0.0 118.894 176.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -67.62 -26.55 66.3 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 111.248 -2.705 . . . . 0.0 109.019 169.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 8.2 t-105 -74.04 -53.44 10.0 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 123.727 1.727 . . . . 0.0 110.97 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.92 -15.64 44.71 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 117.926 -2.983 . . . . 0.0 112.764 173.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -75.46 -23.83 56.93 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 120.256 1.389 . . . . 0.0 113.99 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -78.51 -35.05 46.87 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.748 2.019 . . . . 0.0 109.328 174.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 91.9 t -62.2 -47.23 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 O-C-N 124.209 0.943 . . . . 0.0 109.174 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -70.87 -40.11 72.49 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.574 1.15 . . . . 0.0 112.468 174.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 20.7 tp -50.92 -45.11 60.27 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 121.129 1.786 . . . . 0.0 113.255 168.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 56.6 tp -73.87 -38.06 64.55 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 123.445 1.593 . . . . 0.0 115.187 -176.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . 0.46 ' HA ' ' CD2' ' D' ' 30' ' ' TYR . 27.9 ttpt -61.84 -49.29 76.86 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 120.358 -1.464 . . . . 0.0 108.163 169.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -58.84 -22.08 58.17 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.931 -2.981 . . . . 0.0 117.557 171.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . 0.42 ' HA ' ' OD1' ' D' ' 32' ' ' ASN . . . -85.81 -26.43 25.74 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 120.27 -1.519 . . . . 0.0 112.455 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . 0.46 ' CD2' ' HA ' ' D' ' 27' ' ' LYS . 16.7 m-30 -56.69 -45.42 81.81 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 118.941 -2.35 . . . . 0.0 110.442 166.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -73.16 -25.59 60.86 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.886 2.074 . . . . 0.0 108.069 -163.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . 0.42 ' OD1' ' HA ' ' D' ' 29' ' ' ALA . 43.2 p30 -115.22 5.35 14.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.211 1.804 . . . . 0.0 114.963 174.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 57.61 28.45 15.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 -178.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 15.3 mt -83.59 1.43 42.19 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.234 2.214 . . . . 0.0 112.067 164.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.01 -60.08 3.73 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 118.212 2.671 . . . . 0.0 118.212 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 9.0 mt -57.37 -54.31 56.27 Favored Pre-proline 0 N--CA 1.451 -0.412 0 CA-C-O 114.396 -2.716 . . . . 0.0 109.677 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -43.68 -46.24 10.42 Favored 'Trans proline' 0 N--CA 1.447 -1.238 0 CA-C-N 124.696 2.713 . . . . 0.0 115.393 159.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 22.5 tp -74.44 -39.09 62.8 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 116.379 -3.951 . . . . 0.0 114.744 -176.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' D' ' 39' ' ' LEU . 42.4 mt -59.7 -48.44 81.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.18 -2.2 . . . . 0.0 107.185 166.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 33.0 m-20 -63.43 -31.57 72.76 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 121.393 1.906 . . . . 0.0 114.516 -178.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 31.4 tp -71.15 -41.78 69.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 116.175 -1.869 . . . . 0.0 106.601 172.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 8.0 mmm -83.47 -23.3 32.26 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -170.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 29.5 mt -127.45 141.74 51.59 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 104.69 -2.337 . . . . 0.0 104.69 -173.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 71.7 p -60.22 158.05 29.88 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-O 114.745 -2.55 . . . . 0.0 116.82 171.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -48.15 -50.52 11.82 Favored 'Trans proline' 0 N--CA 1.447 -1.237 1 C-N-CA 126.684 4.923 . . . . 0.0 114.386 170.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -71.82 -17.83 62.13 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 117.738 2.496 . . . . 0.0 117.738 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -73.15 -42.14 63.16 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.412 163.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -61.18 -41.89 97.61 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 126.815 2.046 . . . . 0.0 108.02 175.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -66.07 -38.75 89.1 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.528 1.131 . . . . 0.0 110.927 -178.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.59 -33.94 23.27 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.776 2.031 . . . . 0.0 112.911 -177.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 84.0 mt -58.65 -43.54 89.84 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.065 -2.397 . . . . 0.0 116.183 160.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.7 -34.44 70.41 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-N 121.102 1.774 . . . . 0.0 113.691 170.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 17.8 m -77.07 -38.14 53.12 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 122.335 1.064 . . . . 0.0 112.929 -177.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -61.54 -31.17 71.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 112.444 -3.646 . . . . 0.0 110.852 178.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.71 -49.94 70.95 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 CA-C-N 123.702 2.956 . . . . 0.0 112.515 170.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.307 9.4 ptm180 -65.64 -22.18 66.63 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 118.267 2.691 . . . . 0.0 118.267 169.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 10.2 mt -70.93 -42.49 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 124.194 3.179 . . . . 0.0 112.484 171.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 3.2 t -61.9 -48.12 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 128.163 3.415 . . . . 0.0 111.724 169.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -63.06 -38.82 92.73 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.313 -2.742 . . . . 0.0 108.976 -174.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . 0.425 ' HA ' ' HB3' ' D' ' 63' ' ' ARG . 75.5 mm-40 -75.14 -26.9 59.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 115.679 -2.105 . . . . 0.0 112.305 174.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 63.4 mt -68.73 -23.62 64.36 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 116.734 -1.603 . . . . 0.0 110.389 174.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 29.8 mt -84.09 -38.72 20.43 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 115.174 1.546 . . . . 0.0 115.174 170.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . 0.425 ' HB3' ' HA ' ' D' ' 60' ' ' GLU . 40.1 ttm180 -69.64 -29.32 66.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 127.327 2.892 . . . . 0.0 114.455 175.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 60.42 36.99 92.5 Favored Glycine 0 N--CA 1.445 -0.757 0 CA-C-O 115.727 -2.707 . . . . 0.0 113.481 158.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -111.63 -25.17 9.67 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 114.774 -2.536 . . . . 0.0 110.157 173.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . 0.256 33.6 mtm -89.23 30.84 0.93 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 169.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 77.7 p -85.36 172.83 10.77 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 119.47 -2.019 . . . . 0.0 111.022 -163.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.268 5.5 tp60 65.15 -17.64 0.09 Allowed 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 116.598 -3.814 . . . . 0.0 119.305 169.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 35.0 ttt85 -146.96 -59.85 0.28 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 129.995 3.318 . . . . 0.0 116.169 176.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -84.38 -35.86 22.87 Favored 'General case' 0 N--CA 1.446 -0.644 1 O-C-N 115.47 -4.519 . . . . 0.0 114.16 -152.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.72 -41.99 15.96 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 116.369 -3.957 . . . . 0.0 116.05 178.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 41.4 mtmt -61.14 -38.91 88.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 112.822 -1.99 . . . . 0.0 108.997 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -84.2 -20.56 32.12 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 126.49 2.369 . . . . 0.0 114.233 -176.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -97.3 -38.88 9.49 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 127.963 2.505 . . . . 0.0 110.986 -173.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -120.9 -16.91 8.02 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 85.47 -171.23 45.4 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-O 123.707 1.726 . . . . 0.0 116.746 165.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.254 . . -43.43 -16.69 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 120.726 3.602 . . . . 0.0 120.726 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.88 -20.47 68.6 Favored Glycine 0 C--N 1.335 0.522 0 CA-C-N 122.585 2.448 . . . . 0.0 112.537 171.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 5.0 tt -46.05 -18.06 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 C-N-CA 126.498 1.919 . . . . 0.0 114.959 168.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -103.99 -21.9 13.54 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 117.866 -1.534 . . . . 0.0 112.65 -178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 17.7 m -66.72 -39.4 87.99 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.375 1.47 . . . . 0.0 109.816 165.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 8.5 mm -87.06 -18.18 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 O-C-N 117.755 -3.09 . . . . 0.0 114.444 -172.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 31.0 p -109.25 -24.89 10.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 120.99 3.7 . . . . 0.0 120.99 168.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.8 mtp85 -83.84 162.42 20.57 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.894 -3.004 . . . . 0.0 110.827 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.31 154.73 30.95 Favored Glycine 0 N--CA 1.446 -0.66 0 O-C-N 127.247 2.842 . . . . 0.0 112.275 -177.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 24.6 m -74.38 -7.2 52.08 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 115.847 -2.025 . . . . 0.0 114.943 -168.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . 0.276 18.2 m-80 -134.36 33.38 3.31 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 123.606 2.912 . . . . 0.0 105.963 -171.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 59.9 p -77.28 -175.5 3.72 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.415 2.746 . . . . 0.0 118.415 175.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 29.7 tp -56.24 -32.12 64.19 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 118.389 -2.695 . . . . 0.0 113.951 165.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -74.46 -16.92 60.84 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 123.161 0.584 . . . . 0.0 110.569 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -104.49 -15.24 15.42 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 113.634 -3.079 . . . . 0.0 113.372 -166.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . 0.478 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 45.07 87.19 0.12 Allowed Pre-proline 0 N--CA 1.449 -0.513 0 N-CA-C 116.698 2.11 . . . . 0.0 116.698 165.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . 0.478 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 50.7 Cg_exo 34.19 42.24 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.168 0 C-N-CA 122.447 -1.897 . . . . 0.0 115.861 36.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . 0.45 HG22 ' HB1' ' D' ' 92' ' ' ALA . 0.2 OUTLIER -72.73 15.19 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-N 111.062 -2.79 . . . . 0.0 110.743 -170.68 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . 0.442 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -144.25 -30.0 0.48 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -169.066 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 58.8 tp -50.82 -55.38 17.15 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.663 157.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . 0.31 24.2 ptt180 -59.3 -37.19 77.09 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 112.685 -3.531 . . . . 0.0 112.512 -176.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -71.16 -23.52 62.08 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.455 2.302 . . . . 0.0 110.72 176.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . 0.255 79.3 t90 -87.28 -42.48 12.89 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.709 1.204 . . . . 0.0 111.398 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 51.6 mt -59.76 -55.02 39.49 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 129.454 3.102 . . . . 0.0 106.432 169.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -44.47 -31.36 1.07 Allowed 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 173.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -89.49 -29.34 19.04 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 69.5 t -91.15 -22.83 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 O-C-N 121.316 -0.865 . . . . 0.0 110.729 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 65.9 mt -102.84 -27.67 12.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 119.915 -1.741 . . . . 0.0 112.308 -172.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 28.5 mt -101.78 12.01 37.78 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -62.2 152.16 34.03 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 127.478 2.986 . . . . 0.0 109.77 -171.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 47.8 m -66.38 -27.3 67.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 117.751 2.5 . . . . 0.0 117.751 -168.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . 0.255 0.6 OUTLIER . . . . . 0 C--O 1.25 1.099 0 O-C-N 126.899 2.625 . . . . 0.0 116.256 169.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.96 -28.78 69.16 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 116.587 2.069 . . . . 0.0 116.587 -163.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -77.89 -44.21 27.78 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 125.853 1.971 . . . . 0.0 112.257 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . 0.25 55.0 tt0 -79.33 -20.73 47.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.448 -178.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.7 p -57.54 172.67 0.4 Allowed Pre-proline 0 N--CA 1.45 -0.428 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 171.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -64.91 -32.22 55.3 Favored 'Trans proline' 0 N--CA 1.449 -1.113 0 N-CA-C 119.929 3.011 . . . . 0.0 119.929 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -156.05 127.71 7.3 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 176.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.0 t -85.66 95.73 9.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 121.802 -0.561 . . . . 0.0 110.738 172.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.12 -40.69 90.61 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.499 -1.239 . . . . 0.0 111.294 160.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.01 -38.57 86.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 120.602 1.546 . . . . 0.0 112.7 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.4 ttp -81.07 -24.92 37.45 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 121.433 1.924 . . . . 0.0 112.344 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.87 -25.5 60.07 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 124.617 2.151 . . . . 0.0 116.691 176.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -64.91 -30.41 71.4 Favored 'General case' 0 N--CA 1.445 -0.698 0 O-C-N 120.07 -1.644 . . . . 0.0 113.337 165.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -80.65 -38.69 28.68 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 118.563 -1.255 . . . . 0.0 108.232 -170.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.7 mmt-85 -62.11 -25.03 67.48 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 125.8 1.938 . . . . 0.0 114.839 176.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.0 t60 -61.52 -46.64 89.12 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 117.836 2.532 . . . . 0.0 117.836 171.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -68.93 -26.09 64.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 116.124 1.898 . . . . 0.0 116.124 171.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -72.13 -48.79 41.09 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.462 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG . 20.2 t-105 -60.91 -45.59 94.03 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.31 1.844 . . . . 0.0 112.22 172.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 34.4 mt -70.52 -18.94 62.95 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 177.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -69.45 -29.09 66.7 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 119.003 0.819 . . . . 0.0 110.205 170.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -62.1 -46.28 89.79 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 120.315 -1.491 . . . . 0.0 112.092 165.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.8 t -84.46 -0.21 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 115.6 1.704 . . . . 0.0 115.6 -170.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -96.52 -39.07 9.73 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 113.894 -1.503 . . . . 0.0 109.485 164.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 66.0 tp -60.68 -34.52 74.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 127.121 2.168 . . . . 0.0 108.382 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 61.6 tp -85.18 -22.87 28.58 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 126.8 2.563 . . . . 0.0 109.741 -169.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.3 tttt -79.62 -31.53 41.68 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 121.399 -0.813 . . . . 0.0 112.013 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . 0.256 25.9 m-20 -82.17 -22.27 36.14 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 118.683 -2.511 . . . . 0.0 111.153 175.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.76 -43.54 92.94 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 169.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -55.47 -46.51 76.84 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 123.684 1.707 . . . . 0.0 111.391 172.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -66.31 -24.86 66.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.562 1.945 . . . . 0.0 112.806 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -104.96 11.13 33.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 113.855 -2.974 . . . . 0.0 114.209 175.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.417 1.8 m-20 61.03 22.38 12.64 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 125.64 1.838 . . . . 0.0 112.144 174.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.3 mt -109.88 4.15 21.32 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.365 1.866 . . . . 0.0 112.837 177.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 p-80 -49.53 -43.55 45.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 -179.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 36' ' ' LEU 0.391 80.1 mt -58.13 -60.49 9.95 Favored Pre-proline 0 N--CA 1.45 -0.46 0 N-CA-C 116.314 1.968 . . . . 0.0 116.314 172.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . 0.269 27.2 Cg_endo -60.21 -39.97 63.75 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 117.225 -1.383 . . . . 0.0 112.704 -176.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 tp -55.29 -40.33 70.92 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.488 -2.633 . . . . 0.0 115.846 172.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 85.5 mt -75.12 -35.13 61.74 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.766 0.826 . . . . 0.0 109.036 178.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -62.74 -40.5 97.42 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 123.521 0.513 . . . . 0.0 111.052 176.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.9 tp -68.25 -30.39 69.41 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 115.674 -2.108 . . . . 0.0 114.088 174.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 85.3 mmm -97.64 -22.15 16.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 123.494 2.861 . . . . 0.0 112.372 -168.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mp -134.13 150.13 51.11 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 126.091 1.757 . . . . 0.0 109.661 -176.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.445 ' HB ' ' HD2' ' A' ' 45' ' ' PRO . 64.3 p -81.57 163.34 54.69 Favored Pre-proline 0 N--CA 1.451 -0.401 0 C-N-CA 126.704 2.002 . . . . 0.0 111.724 173.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.445 ' HD2' ' HB ' ' A' ' 44' ' ' THR . 24.7 Cg_endo -64.15 -32.45 63.31 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 CA-C-N 119.509 0.86 . . . . 0.0 111.998 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.19 -35.32 77.81 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 115.645 -2.121 . . . . 0.0 110.432 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.21 -24.07 60.47 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 122.955 2.616 . . . . 0.0 114.18 174.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.0 mtm-85 -84.98 -35.31 22.07 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 126.014 2.071 . . . . 0.0 115.204 171.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.3 -39.14 82.08 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.404 1.882 . . . . 0.0 110.316 170.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.47 83.86 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 130.565 3.546 . . . . 0.0 113.486 174.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 78.2 mt -72.33 -36.47 68.85 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 118.017 -2.927 . . . . 0.0 107.143 177.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.03 -51.39 54.14 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 174.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . 0.25 8.8 m -62.99 -30.82 71.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 128.889 2.876 . . . . 0.0 113.143 175.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.7 mtt180 -80.88 -32.79 34.75 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 117.715 -1.594 . . . . 0.0 108.373 -168.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.447 ' HA ' ' HE1' ' B' ' 42' ' ' MET . 83.8 t -45.43 -46.4 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-O 115.16 -2.353 . . . . 0.0 114.738 154.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -79.51 -27.98 41.41 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.448 2.386 . . . . 0.0 108.657 -169.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 47.6 mt -63.53 -55.21 24.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 C-N-CA 125.27 1.428 . . . . 0.0 110.49 166.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.1 t -61.72 -35.16 65.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 C-N-CA 117.019 -1.872 . . . . 0.0 113.514 -173.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . 0.256 28.8 tt0 -46.6 -60.09 2.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 118.137 -2.852 . . . . 0.0 113.136 166.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -58.82 -29.33 66.8 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 175.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 42.3 mt -76.09 -28.75 57.68 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 118.701 -1.2 . . . . 0.0 112.427 173.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.3 mt -74.28 -31.32 62.47 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 119.117 -2.239 . . . . 0.0 113.196 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 43.3 ttm105 -71.95 -41.48 67.73 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 129.805 3.242 . . . . 0.0 112.918 173.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.54 35.15 21.56 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 120.065 2.786 . . . . 0.0 120.065 -174.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -98.2 -37.43 9.7 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 119.863 1.831 . . . . 0.0 113.096 168.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 42.5 mtt -75.28 127.19 32.6 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 118.939 -1.105 . . . . 0.0 109.568 -177.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 54.0 p -47.94 165.75 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 127.227 2.211 . . . . 0.0 114.59 151.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -68.58 -33.65 74.43 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 127.407 2.283 . . . . 0.0 109.63 170.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.3 tpt85 -55.3 -54.35 44.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.248 1.019 . . . . 0.0 111.247 168.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -58.49 -48.58 80.34 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 175.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.5 mt -54.53 -29.09 49.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 115.463 1.653 . . . . 0.0 115.463 171.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -77.52 -50.03 13.48 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 118.305 -2.747 . . . . 0.0 109.084 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -64.18 -41.82 96.94 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 119.606 3.187 . . . . 0.0 119.606 172.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -81.06 -42.24 21.34 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 125.539 2.59 . . . . 0.0 114.072 -171.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.8 mt -120.9 -5.41 9.6 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 117.984 -2.948 . . . . 0.0 114.12 -172.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 82.32 -12.18 46.5 Favored Glycine 0 CA--C 1.523 0.577 0 O-C-N 116.664 -3.772 . . . . 0.0 115.686 175.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.45 ' HB1' HG12 ' A' ' 82' ' ' ILE . . . -71.55 120.69 17.49 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 125.498 1.352 . . . . 0.0 111.242 -174.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.8 -172.26 41.33 Favored Glycine 0 CA--C 1.524 0.645 0 CA-C-N 113.407 -1.724 . . . . 0.0 115.815 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 4.7 mt -55.37 -46.86 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-O 114.395 -2.717 . . . . 0.0 110.427 165.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.12 86.7 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 122.091 2.223 . . . . 0.0 115.228 -171.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 62.5 p -94.19 -25.57 17.03 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 124.003 1.859 . . . . 0.0 115.957 -174.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.45 HG12 ' HB1' ' A' ' 77' ' ' ALA . 31.1 mm -74.28 -34.2 36.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 O-C-N 118.446 -2.659 . . . . 0.0 107.717 171.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.1 m -62.39 -52.78 62.21 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 121.889 2.132 . . . . 0.0 109.071 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.6 ttt180 -63.17 -57.92 8.94 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 117.706 -1.14 . . . . 0.0 109.688 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.09 -31.42 4.38 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-O 123.19 1.439 . . . . 0.0 116.244 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.2 m -69.33 -50.79 43.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 119.998 -1.883 . . . . 0.0 111.108 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -56.82 -39.6 74.47 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 119.927 -1.733 . . . . 0.0 114.378 175.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.4 m -72.17 -41.32 67.17 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 115.018 -2.42 . . . . 0.0 112.263 176.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.7 tt -67.21 -40.91 86.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 122.844 2.566 . . . . 0.0 114.374 173.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -67.6 -23.3 65.36 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 118.121 2.637 . . . . 0.0 118.121 177.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.47 -13.66 25.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.848 1.659 . . . . 0.0 113.467 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.97 154.25 92.77 Favored Pre-proline 0 N--CA 1.452 -0.348 0 O-C-N 118.941 -2.349 . . . . 0.0 111.223 -177.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -64.99 141.52 70.9 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 125.008 3.805 . . . . 0.0 113.36 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.8 m -54.4 -32.04 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 O-C-N 126.877 2.611 . . . . 0.0 113.687 -177.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 8.5 pm0 -75.53 -22.91 56.69 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.559 -1.655 . . . . 0.0 113.739 -177.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 20.1 tp -76.76 -42.15 42.05 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 119.033 -2.292 . . . . 0.0 106.475 174.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . 0.331 22.9 mtm180 -67.76 -54.94 15.22 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 123.714 1.721 . . . . 0.0 114.415 -164.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -59.29 -13.96 9.7 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 129.983 3.313 . . . . 0.0 115.026 169.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 37.4 t90 -96.47 -28.49 14.4 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 115.092 -2.385 . . . . 0.0 109.675 174.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 84.9 mt -77.99 -35.79 49.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 123.834 3.015 . . . . 0.0 113.916 173.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.08 -30.5 71.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 116.551 -2.059 . . . . 0.0 115.305 170.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -65.79 -55.02 19.39 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 118.282 2.697 . . . . 0.0 118.282 162.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 84.9 t -80.83 -26.74 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 O-C-N 120.477 -1.389 . . . . 0.0 110.203 -167.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.9 mt -96.59 -32.53 12.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -175.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 44.2 mt -98.59 -11.27 22.31 Favored 'General case' 0 N--CA 1.446 -0.658 0 O-C-N 117.785 -3.072 . . . . 0.0 114.36 -171.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -98.18 42.22 1.1 Allowed 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 124.089 0.868 . . . . 0.0 112.182 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 8.0 m -119.73 -42.1 2.64 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 175.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 . . . . . 0 C--O 1.253 1.253 0 O-C-N 127.646 3.091 . . . . 0.0 113.136 179.258 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 27.7 ttp . . . . . 0 N--CA 1.469 0.508 0 CA-C-O 119.327 -0.368 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.48 -20.93 64.63 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 114.738 1.385 . . . . 0.0 114.738 -154.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -96.84 -22.27 17.02 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 120.844 1.657 . . . . 0.0 112.277 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -71.4 -34.47 70.39 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 126.216 1.806 . . . . 0.0 113.946 164.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 28.8 m -60.57 146.32 85.65 Favored Pre-proline 0 N--CA 1.446 -0.646 0 CA-C-O 116.803 -1.57 . . . . 0.0 112.302 177.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -71.0 -31.65 14.67 Favored 'Trans proline' 0 N--CA 1.449 -1.145 0 O-C-N 124.169 1.615 . . . . 0.0 113.654 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -144.98 159.99 42.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 127.539 2.336 . . . . 0.0 112.691 177.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 10.9 t -144.49 117.41 8.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 121.275 1.852 . . . . 0.0 112.433 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.46 -37.77 87.22 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 129.072 2.949 . . . . 0.0 111.475 -170.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.99 -50.85 72.53 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 128.466 2.706 . . . . 0.0 110.771 176.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 12.3 ttm -70.86 -32.79 69.92 Favored 'General case' 0 N--CA 1.45 -0.448 1 O-C-N 116.047 -4.158 . . . . 0.0 108.654 -177.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.56 -37.99 80.39 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.738 1.732 . . . . 0.0 111.825 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -61.76 -53.37 56.91 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.247 -2.158 . . . . 0.0 109.45 175.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -55.56 -20.37 13.11 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 117.497 2.406 . . . . 0.0 117.497 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 14.1 mmm180 -84.38 -33.51 23.79 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 115.567 1.691 . . . . 0.0 115.567 170.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -66.35 -34.07 77.15 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 115.439 -2.22 . . . . 0.0 112.764 166.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -79.59 -27.52 41.1 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 115.808 -2.044 . . . . 0.0 109.838 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -65.29 -30.29 71.14 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 120.929 1.695 . . . . 0.0 114.96 164.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 18.6 t-105 -74.84 -45.68 41.6 Favored 'General case' 0 N--CA 1.445 -0.685 1 O-C-N 114.806 -4.934 . . . . 0.0 112.903 173.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 8.9 mt -60.72 -23.36 64.85 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 113.15 -3.309 . . . . 0.0 114.038 166.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 53.6 ttt180 -72.31 -34.37 68.07 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 125.325 3.693 . . . . 0.0 111.55 173.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -55.82 -50.69 69.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 119.649 1.113 . . . . 0.0 112.416 167.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 87.3 t -74.08 -33.58 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 O-C-N 127.159 2.787 . . . . 0.0 108.874 -171.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -60.82 -45.76 93.18 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 119.878 -1.764 . . . . 0.0 115.384 167.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 23.0 tp -62.75 -46.75 86.59 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.14 175.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 59.7 tp -69.32 -25.7 64.35 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 118.353 -2.717 . . . . 0.0 117.178 177.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -59.02 -61.28 2.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 118.265 -2.772 . . . . 0.0 110.011 162.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -60.32 -29.52 68.92 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.179 -3.451 . . . . 0.0 111.82 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.67 -32.28 69.49 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 130.766 3.626 . . . . 0.0 115.034 175.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -66.05 -52.46 48.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.962 1.305 . . . . 0.0 110.653 172.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -50.57 -43.38 56.35 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 115.94 -1.981 . . . . 0.0 115.511 167.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -91.18 3.68 54.2 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 130.27 3.428 . . . . 0.0 108.775 -178.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.365 6.1 m-20 62.57 21.06 12.42 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 118.922 2.934 . . . . 0.0 118.922 -177.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -104.11 12.68 33.67 Favored 'General case' 0 N--CA 1.446 -0.636 1 O-C-N 114.46 -5.15 . . . . 0.0 114.651 -175.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 11.5 p-80 -57.86 -49.13 77.74 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 128.001 2.52 . . . . 0.0 116.151 -170.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 15.6 mt -66.21 -39.44 28.09 Favored Pre-proline 0 N--CA 1.449 -0.494 0 C-N-CA 126.881 2.072 . . . . 0.0 116.418 174.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.301 26.5 Cg_exo -59.03 -45.34 28.72 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 N-CA-C 115.193 1.19 . . . . 0.0 115.193 164.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 29.5 tp -56.62 -54.09 50.1 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 119.963 -1.711 . . . . 0.0 112.166 176.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 63.1 mt -54.58 -34.76 62.46 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 119.524 -1.985 . . . . 0.0 113.537 170.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -71.27 -29.44 65.08 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 117.796 -1.097 . . . . 0.0 110.685 173.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . 0.408 16.1 tp -75.04 -43.42 53.59 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 116.238 -1.839 . . . . 0.0 114.544 174.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . 0.447 ' HE1' ' HA ' ' A' ' 55' ' ' VAL . 19.5 mmt -94.84 -20.92 19.04 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 125.283 1.614 . . . . 0.0 112.272 -168.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -114.28 133.93 55.3 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 121.077 1.762 . . . . 0.0 111.122 173.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 73.2 p -72.98 152.95 90.93 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 122.038 2.199 . . . . 0.0 110.971 170.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 99.4 Cg_exo -28.3 -54.87 0.14 Allowed 'Trans proline' 0 N--CA 1.449 -1.105 1 C-N-CA 126.325 4.683 . . . . 0.0 112.559 166.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -62.3 -43.02 99.79 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 127.627 3.08 . . . . 0.0 115.847 -175.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -64.19 -39.23 93.56 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 119.611 3.189 . . . . 0.0 119.611 166.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . 0.462 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 37.8 mtm-85 -61.42 -40.34 94.05 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 115.006 -2.426 . . . . 0.0 107.209 169.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -66.5 -31.36 72.05 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 124.25 3.205 . . . . 0.0 113.151 175.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.2 -47.55 82.12 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 118.38 -2.7 . . . . 0.0 114.323 168.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.12 -37.57 83.28 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 120.007 3.336 . . . . 0.0 120.007 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.09 -18.76 76.72 Favored Glycine 0 C--N 1.34 0.767 0 C-N-CA 117.705 -2.188 . . . . 0.0 112.009 176.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 2.4 m -85.06 -36.31 21.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 119.243 -2.328 . . . . 0.0 109.82 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 85.9 mtt180 -60.3 -25.9 66.11 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.327 1.451 . . . . 0.0 114.216 171.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . 0.319 16.6 t -59.37 -56.96 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 C-N-CA 126.085 1.754 . . . . 0.0 111.025 164.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -72.25 -32.49 66.73 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 120.369 1.44 . . . . 0.0 112.422 -176.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 9.1 mt -59.6 -56.14 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 121.221 1.828 . . . . 0.0 113.214 162.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.261 29.6 t -66.7 -36.24 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 O-C-N 117.818 -3.051 . . . . 0.0 112.759 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -45.19 -59.49 2.61 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 128.972 2.909 . . . . 0.0 112.248 159.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -69.2 -21.07 63.98 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 119.024 -2.297 . . . . 0.0 114.852 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 12.2 mt -67.03 -19.03 65.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 116.705 -3.747 . . . . 0.0 110.468 167.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 10.3 mt -96.02 -40.56 9.2 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 122.694 2.497 . . . . 0.0 109.874 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 27.6 ttm180 -58.79 -59.24 5.75 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 125.006 1.441 . . . . 0.0 113.25 174.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.49 48.48 23.4 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 115.983 -3.008 . . . . 0.0 115.347 -179.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -126.49 -27.71 3.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 126.568 1.981 . . . . 0.0 114.371 -178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 16.9 mtt -62.77 141.52 58.56 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 115.44 1.645 . . . . 0.0 115.44 177.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 93.7 p -72.65 157.97 36.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 162.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -64.29 -16.12 61.54 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 115.719 -2.086 . . . . 0.0 113.894 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -67.3 -48.48 67.51 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.708 1.203 . . . . 0.0 113.788 166.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -67.43 -34.06 76.44 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 128.506 2.723 . . . . 0.0 110.314 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.541 HD22 HD11 ' B' ' 82' ' ' ILE 0.252 79.4 mt -61.07 -55.14 36.07 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 123.501 1.62 . . . . 0.0 112.194 175.517 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 tptt -63.73 -44.79 92.52 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 119.844 -1.785 . . . . 0.0 110.56 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -97.23 -24.65 15.6 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 116.356 -1.783 . . . . 0.0 113.402 -160.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -117.1 -35.39 4.09 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 116.826 -1.95 . . . . 0.0 112.373 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 45.0 mt -92.43 -7.3 47.97 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 129.018 2.927 . . . . 0.0 115.38 177.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 55.31 41.17 78.85 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-O 118.893 -0.948 . . . . 0.0 115.156 -176.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -119.28 101.37 7.93 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 117.003 -1.475 . . . . 0.0 111.599 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.8 171.28 30.99 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 119.966 2.746 . . . . 0.0 119.966 161.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . 0.251 55.0 mt -40.9 -41.33 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 175.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . 0.334 . . -58.73 -37.87 77.12 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.639 1.175 . . . . 0.0 113.136 176.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.2 m -79.76 -35.01 39.32 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 120.785 -1.197 . . . . 0.0 113.161 178.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . 0.541 HD11 HD22 ' B' ' 71' ' ' LEU . 16.3 mm -70.76 -39.66 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-O 118.011 -0.995 . . . . 0.0 109.943 174.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 93.1 m -59.68 -59.18 5.85 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.715 2.406 . . . . 0.0 112.41 171.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -70.91 -33.53 70.63 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -173.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.25 -34.52 85.92 Favored Glycine 0 CA--C 1.524 0.649 0 O-C-N 116.68 -3.762 . . . . 0.0 115.116 169.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 75.1 m -76.16 -34.39 59.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -67.52 -27.58 67.1 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 119.478 -2.014 . . . . 0.0 112.135 172.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 22.4 m -76.64 -32.91 58.3 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 126.842 2.057 . . . . 0.0 113.593 176.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.4 mt -65.4 -48.62 72.23 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 116.54 -1.695 . . . . 0.0 112.991 168.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -71.27 -25.98 62.69 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 126.987 2.68 . . . . 0.0 112.874 -178.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . 0.367 . . -84.47 4.62 30.88 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 116.943 -3.598 . . . . 0.0 114.969 170.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.53 167.47 29.88 Favored Pre-proline 0 N--CA 1.448 -0.555 0 CA-C-N 119.595 1.089 . . . . 0.0 113.77 166.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -74.21 155.54 46.79 Favored 'Trans proline' 0 N--CA 1.448 -1.191 0 N-CA-C 117.068 1.911 . . . . 0.0 117.068 169.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 m -61.58 -39.55 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 115.918 -1.991 . . . . 0.0 115.15 173.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 12.3 pm0 -66.78 -25.33 66.42 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 126.27 2.231 . . . . 0.0 110.636 173.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.5 tp -73.51 -39.76 64.57 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.408 -3.308 . . . . 0.0 111.458 174.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 89.5 mtm-85 -68.12 -33.2 74.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 114.029 -2.891 . . . . 0.0 115.163 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -66.05 -30.25 70.75 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 128.371 3.544 . . . . 0.0 105.593 168.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 71.0 t90 -84.69 -45.74 12.16 Favored 'General case' 0 N--CA 1.45 -0.465 1 O-C-N 115.882 -4.262 . . . . 0.0 105.63 -169.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 22.4 mt -70.8 -35.82 72.7 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 124.96 1.412 . . . . 0.0 114.661 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -61.85 -17.65 57.18 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 170.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -102.92 -19.77 14.5 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 177.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 92.6 t -95.02 -38.91 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 CA-C-O 124.115 1.912 . . . . 0.0 112.754 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 6.6 mt -86.74 -68.33 0.75 Allowed 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 117.768 -3.083 . . . . 0.0 111.13 -174.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 79.9 mt -64.01 -33.61 76.14 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 126.888 3.233 . . . . 0.0 113.459 -165.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -55.17 -17.23 3.96 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.11 2.964 . . . . 0.0 114.175 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 3.4 m -71.47 -20.75 62.04 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 170.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.695 2.798 . . . . 0.0 113.266 171.105 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.47 0.539 0 N-CA-C 104.908 -2.256 . . . . 0.0 104.908 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -51.26 134.65 27.46 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 124.783 2.23 . . . . 0.0 114.751 -175.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -109.11 148.72 30.4 Favored 'General case' 0 N--CA 1.445 -0.724 1 N-CA-C 121.97 4.063 . . . . 0.0 121.97 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -165.13 152.53 11.01 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 121.166 1.803 . . . . 0.0 109.062 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 12.6 p -152.71 162.67 25.83 Favored Pre-proline 0 N--CA 1.448 -0.55 0 C-N-CA 128.176 2.59 . . . . 0.0 108.896 164.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -47.73 -25.25 5.55 Favored 'Trans proline' 0 N--CA 1.449 -1.091 1 N-CA-C 124.069 4.603 . . . . 0.0 124.069 -158.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -142.81 160.72 39.79 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.288 178.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 13.6 t -157.32 125.94 5.7 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 127.095 2.158 . . . . 0.0 110.297 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.39 -27.73 59.2 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 119.412 -2.055 . . . . 0.0 112.697 175.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.15 -36.54 83.39 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 -170.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 34.0 mtt -77.82 -31.25 51.56 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 117.534 -3.229 . . . . 0.0 115.539 178.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.76 -39.76 95.16 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.811 1.244 . . . . 0.0 112.248 174.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 tp10 -72.54 -29.46 63.59 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 126.648 2.468 . . . . 0.0 111.54 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . 0.301 50.9 tt0 -72.26 -36.01 68.92 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.652 0.739 . . . . 0.0 111.991 164.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -31.53 71.74 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 118.061 -2.9 . . . . 0.0 114.88 177.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -64.58 -51.43 62.76 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.417 2.287 . . . . 0.0 112.869 170.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.376 80.8 mm-40 -55.97 -42.53 76.43 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 114.877 -2.487 . . . . 0.0 112.621 170.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 68.2 mt-10 -66.74 -52.47 44.0 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 125.777 1.923 . . . . 0.0 112.44 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -55.93 -37.75 69.38 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 117.888 2.551 . . . . 0.0 117.888 170.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.66 -29.64 68.98 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 117.849 -3.032 . . . . 0.0 115.165 167.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 37.5 ttt-85 -71.74 -27.26 62.87 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 127.126 2.766 . . . . 0.0 109.548 170.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -66.62 -54.13 26.71 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.894 -2.379 . . . . 0.0 111.397 171.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 88.7 t -57.7 -39.64 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 123.618 1.675 . . . . 0.0 112.429 -174.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -61.13 -58.5 8.11 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.712 2.005 . . . . 0.0 108.215 178.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 58.8 tp -50.78 -39.37 52.36 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 129.768 3.227 . . . . 0.0 112.321 175.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . 0.476 HD11 HD21 ' C' ' 39' ' ' LEU . 46.6 tp -68.03 -50.04 57.77 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.726 2.41 . . . . 0.0 105.602 179.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.2 ttpp -70.95 -29.39 65.4 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 120.23 -1.544 . . . . 0.0 114.868 -175.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -63.49 -32.09 73.44 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.848 -1.549 . . . . 0.0 113.85 166.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.99 -23.35 60.63 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.78 1.632 . . . . 0.0 112.852 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -69.88 -11.21 60.7 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 116.699 -3.75 . . . . 0.0 117.205 171.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -87.54 -25.61 23.56 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 128.955 2.902 . . . . 0.0 111.812 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 27.6 p30 -124.74 17.71 8.71 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 124.144 3.156 . . . . 0.0 111.44 -178.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 61.23 31.18 19.5 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 116.135 -1.888 . . . . 0.0 114.629 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 55.2 mt -103.36 13.99 32.48 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 175.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -78.39 -26.82 46.64 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 117.966 2.58 . . . . 0.0 117.966 -170.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.4 83.8 mt -69.42 -48.11 25.63 Favored Pre-proline 0 N--CA 1.448 -0.553 0 O-C-N 126.691 2.494 . . . . 0.0 114.772 168.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -55.51 -38.96 93.55 Favored 'Trans proline' 0 N--CA 1.447 -1.261 1 C-N-CA 127.576 5.518 . . . . 0.0 111.995 171.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 40.2 tp -77.35 -37.64 51.92 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 119.524 -1.985 . . . . 0.0 112.323 -176.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . 0.476 HD21 HD11 ' C' ' 26' ' ' LEU . 34.2 mt -74.42 -31.29 62.26 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 122.19 2.268 . . . . 0.0 107.344 178.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -70.16 -35.6 74.13 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 167.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 30.5 tp -63.52 -43.72 96.34 Favored 'General case' 0 N--CA 1.448 -0.543 1 O-C-N 115.969 -4.207 . . . . 0.0 111.136 170.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 12.9 mmt -74.01 -49.93 22.12 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.931 2.892 . . . . 0.0 116.374 -174.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.7 mp -106.5 130.0 54.36 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 129.948 3.299 . . . . 0.0 112.276 -176.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 71.0 p -56.35 153.45 19.65 Favored Pre-proline 0 N--CA 1.448 -0.555 0 O-C-N 127.241 2.838 . . . . 0.0 117.867 157.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . 0.271 13.5 Cg_exo -49.92 -39.96 49.18 Favored 'Trans proline' 0 N--CA 1.445 -1.345 0 C-N-CA 115.803 -2.331 . . . . 0.0 115.418 171.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -60.95 -31.6 71.15 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.706 1.602 . . . . 0.0 114.979 178.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -77.42 -30.94 53.73 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 113.666 -3.064 . . . . 0.0 111.429 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 46.4 mtm-85 -81.33 -27.68 34.85 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 126.478 2.361 . . . . 0.0 111.859 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -68.63 -43.38 76.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 119.261 -2.15 . . . . 0.0 113.199 163.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.29 86.5 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 116.845 -1.55 . . . . 0.0 112.5 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 19.4 mt -78.37 -25.66 46.36 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 117.876 2.547 . . . . 0.0 117.876 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.18 -35.72 70.74 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 119.07 -1.538 . . . . 0.0 114.157 169.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 7.0 m -54.55 -49.09 71.15 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 118.528 -2.748 . . . . 0.0 114.966 163.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -58.14 -24.14 57.76 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 126.014 2.071 . . . . 0.0 113.322 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 40.6 t -71.72 -37.27 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 115.541 -2.171 . . . . 0.0 110.003 170.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -73.29 -16.38 61.38 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 122.49 2.404 . . . . 0.0 113.429 174.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 11.6 mt -73.62 -35.27 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 121.271 -0.893 . . . . 0.0 111.354 170.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 47.6 t -70.78 -43.86 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 O-C-N 120.728 -1.233 . . . . 0.0 109.865 170.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -62.05 -42.22 98.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 117.671 -3.143 . . . . 0.0 115.852 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -68.71 -25.65 64.87 Favored 'General case' 0 N--CA 1.449 -0.508 1 O-C-N 115.741 -4.349 . . . . 0.0 113.822 174.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 86.7 mt -87.91 8.95 23.83 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 116.843 -3.661 . . . . 0.0 112.525 172.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 62.5 mt -112.99 -20.25 11.61 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 120.152 1.342 . . . . 0.0 111.935 162.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 39.0 ttm105 -78.15 -38.08 44.46 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 127.836 2.455 . . . . 0.0 112.978 171.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.58 25.71 67.52 Favored Glycine 0 CA--C 1.524 0.653 0 CA-C-O 126.22 3.122 . . . . 0.0 115.449 161.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -92.83 -33.9 14.07 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 112.306 -1.947 . . . . 0.0 113.989 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 53.9 mtt -62.87 142.74 58.14 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 127.356 2.91 . . . . 0.0 112.007 178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 61.0 p -71.54 159.31 34.69 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.91 1.284 . . . . 0.0 113.15 160.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -59.8 -28.47 67.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 166.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . 0.254 23.6 ttp-105 -53.13 -49.18 67.08 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 127.772 2.429 . . . . 0.0 113.366 162.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -68.39 -59.38 3.22 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.108 1.763 . . . . 0.0 111.13 170.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mt -44.23 -38.85 4.04 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.991 -2.943 . . . . 0.0 116.481 176.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -53.15 -43.45 67.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 126.761 2.024 . . . . 0.0 115.374 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -112.21 -41.98 3.82 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 120.637 1.562 . . . . 0.0 112.479 -171.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -90.54 -33.1 16.05 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 120.176 -1.578 . . . . 0.0 109.157 -166.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 6.2 tp -84.24 -21.88 31.0 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 119.447 -2.033 . . . . 0.0 114.778 168.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.95 -174.77 28.8 Favored Glycine 0 C--N 1.335 0.508 0 N-CA-C 121.393 3.317 . . . . 0.0 121.393 174.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.21 68.26 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 111.895 -2.153 . . . . 0.0 115.87 -168.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.58 -13.17 2.77 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 121.191 3.236 . . . . 0.0 121.191 169.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 9.3 tt -60.22 -20.57 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.82 -27.78 58.04 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 120.532 -1.355 . . . . 0.0 111.356 -179.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . 0.64 HG23 HG23 ' D' ' 44' ' ' THR . 93.2 m -64.83 -29.88 70.86 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 127.103 2.161 . . . . 0.0 110.2 172.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 7.5 mm -96.38 -31.17 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 115.835 -2.031 . . . . 0.0 110.98 -174.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 29.7 p -117.57 -0.86 11.78 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 125.425 1.703 . . . . 0.0 113.597 -163.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -124.06 148.94 46.68 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 120.998 -1.064 . . . . 0.0 113.007 172.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 98.79 169.74 31.18 Favored Glycine 0 C--N 1.338 0.639 0 CA-C-O 123.713 1.73 . . . . 0.0 112.19 -171.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 92.7 p -66.63 -34.52 78.06 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -177.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -89.34 10.69 21.48 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 115.195 -2.336 . . . . 0.0 112.022 -176.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 60.4 p -79.3 169.8 17.57 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 126.443 2.339 . . . . 0.0 114.542 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 21.0 tp -51.25 -42.76 61.25 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 116.822 -3.673 . . . . 0.0 113.922 -165.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -97.18 24.17 6.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 124.016 3.098 . . . . 0.0 111.791 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -141.43 -19.99 0.77 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 115.648 -2.12 . . . . 0.0 112.304 173.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.04 150.87 1.26 Allowed Pre-proline 0 N--CA 1.449 -0.495 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 164.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.54 156.1 62.71 Favored 'Trans proline' 0 N--CA 1.448 -1.18 0 CA-C-N 121.886 1.709 . . . . 0.0 113.475 -174.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 70.6 t -77.22 -27.5 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-O 112.757 -3.496 . . . . 0.0 108.338 -161.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pm0 -68.79 -29.32 67.66 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 124.849 3.477 . . . . 0.0 113.509 173.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 18.3 tp -78.75 -45.7 20.53 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 120.472 1.487 . . . . 0.0 108.547 176.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 77.1 mtp180 -50.38 -39.31 46.43 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 170.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -74.24 -35.88 63.87 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.235 -1.364 . . . . 0.0 108.347 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 36.2 t90 -81.55 -22.3 37.93 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 118.334 2.716 . . . . 0.0 118.334 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.15 -32.26 70.16 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.971 -0.456 . . . . 0.0 111.709 171.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.98 -35.18 80.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 115.0 1.482 . . . . 0.0 115.0 171.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -83.3 -29.29 28.47 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 118.512 -2.617 . . . . 0.0 115.258 -173.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 t -85.46 -41.24 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 171.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 7.0 mt -88.38 -5.02 58.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 121.771 3.989 . . . . 0.0 121.771 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . 0.286 99.3 mt -129.56 50.6 2.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 125.972 2.045 . . . . 0.0 112.11 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 16.8 pttt -115.1 139.05 50.21 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 117.925 -2.984 . . . . 0.0 113.07 -166.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 44.8 m -123.32 63.39 1.01 Allowed 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 123.011 1.386 . . . . 0.0 108.292 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 33.8 t0 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 116.277 -1.821 . . . . 0.0 113.324 -167.028 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 33.8 ttp . . . . . 0 N--CA 1.471 0.582 0 CA-C-O 122.061 0.934 . . . . 0.0 108.542 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.42 149.56 42.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -167.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 66.3 tt0 -150.9 130.57 13.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 128.249 2.62 . . . . 0.0 113.765 172.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -155.69 146.79 22.47 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 126.85 2.594 . . . . 0.0 109.21 168.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 3.4 p -87.36 167.84 19.68 Favored Pre-proline 0 N--CA 1.45 -0.432 0 C-N-CA 126.159 1.784 . . . . 0.0 108.991 175.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -62.64 -52.3 2.51 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-N 123.763 2.38 . . . . 0.0 110.808 177.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -141.73 128.87 20.91 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 128.905 2.882 . . . . 0.0 113.295 167.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.6 t -61.21 137.41 58.24 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 118.682 2.845 . . . . 0.0 118.682 -175.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.61 -35.49 72.54 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 131.047 3.739 . . . . 0.0 110.272 170.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.56 -14.23 59.71 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.494 -2.629 . . . . 0.0 112.21 175.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 11.3 mmt -87.14 -31.85 20.18 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.588 1.995 . . . . 0.0 115.381 168.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . 0.303 . . -62.88 -33.69 75.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.369 -2.253 . . . . 0.0 116.324 167.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -61.54 -38.26 86.78 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 128.382 3.551 . . . . 0.0 113.935 168.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -81.56 -35.47 30.2 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 114.179 -2.82 . . . . 0.0 109.534 -169.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . 0.45 HH11 ' HD3' ' D' ' 15' ' ' ARG . 0.0 OUTLIER -63.62 -21.5 66.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 117.392 2.367 . . . . 0.0 117.392 174.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -84.57 -37.16 21.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.995 2.118 . . . . 0.0 113.312 173.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -76.86 -37.23 55.96 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 125.08 1.487 . . . . 0.0 111.579 176.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -63.85 -18.99 64.71 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 116.072 -2.251 . . . . 0.0 112.422 166.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 3.4 t-105 -79.89 -47.61 14.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.835 1.254 . . . . 0.0 110.986 175.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 63.2 mt -52.52 -32.84 42.48 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.2 -2.333 . . . . 0.0 113.972 170.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 41.5 ttt180 -76.73 -19.49 57.6 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 114.867 -2.492 . . . . 0.0 110.265 173.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -75.56 -41.94 53.56 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 123.91 3.05 . . . . 0.0 114.836 155.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 77.8 t -60.19 -38.24 76.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 121.557 1.98 . . . . 0.0 111.826 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -74.44 -32.12 62.52 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 120.778 3.621 . . . . 0.0 120.778 168.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 21.4 tp -63.1 -44.08 96.69 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 165.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . 0.419 HD11 ' CE1' ' D' ' 30' ' ' TYR . 26.2 tp -67.71 -43.16 80.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 120.462 1.483 . . . . 0.0 109.377 178.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . 0.472 ' HE2' ' HB3' ' D' ' 27' ' ' LYS . 35.9 ttpt -57.34 -41.43 79.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 118.479 -2.638 . . . . 0.0 115.397 175.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -69.7 -32.49 71.12 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 116.674 -1.631 . . . . 0.0 110.243 171.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.263 . . -68.7 -20.93 64.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 121.419 1.918 . . . . 0.0 115.239 168.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . 0.419 ' CE1' HD11 ' D' ' 26' ' ' LEU . 15.2 m-85 -66.42 -45.61 79.32 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 123.236 2.744 . . . . 0.0 108.686 170.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -67.33 -5.79 15.88 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.628 -1.92 . . . . 0.0 114.644 -166.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 39.4 p-10 -137.25 16.08 2.99 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 125.428 1.705 . . . . 0.0 112.442 165.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 60.92 33.91 19.7 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 115.927 1.825 . . . . 0.0 115.927 172.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 48.1 mt -93.18 3.1 56.25 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 111.169 -2.741 . . . . 0.0 115.984 161.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -53.28 -60.68 2.99 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 130.753 3.621 . . . . 0.0 113.741 -178.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.13 -47.89 89.35 Favored Pre-proline 0 N--CA 1.451 -0.421 0 O-C-N 117.376 -3.327 . . . . 0.0 113.866 -174.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -64.01 -18.61 64.34 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 CA-C-N 123.035 2.119 . . . . 0.0 111.0 174.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . 0.315 38.1 tp -64.64 -70.81 0.21 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 123.353 2.797 . . . . 0.0 110.148 167.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . 0.427 ' H ' ' HG ' ' D' ' 39' ' ' LEU . 3.9 mt -36.09 -53.32 0.79 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 116.469 -1.729 . . . . 0.0 115.289 170.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . 0.291 26.8 m-20 -74.89 -22.27 58.74 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 116.998 -1.881 . . . . 0.0 111.194 -176.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 35.9 tp -65.65 -38.5 89.54 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 121.723 2.056 . . . . 0.0 112.84 166.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 72.1 mmm -89.85 -32.74 16.76 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 126.191 2.182 . . . . 0.0 114.223 -165.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 73.4 mt -105.61 122.3 45.76 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 118.041 -2.912 . . . . 0.0 112.888 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . 0.64 HG23 HG23 ' C' ' 81' ' ' THR 0.323 73.1 p -57.23 151.82 34.35 Favored Pre-proline 0 N--CA 1.45 -0.47 0 N-CA-C 119.223 3.046 . . . . 0.0 119.223 160.206 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -42.26 -53.3 3.7 Favored 'Trans proline' 0 N--CA 1.448 -1.201 0 C-N-CA 124.816 3.677 . . . . 0.0 116.864 -175.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.299 0.9 OUTLIER -84.22 -3.93 58.5 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 115.762 -2.066 . . . . 0.0 112.045 -169.704 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -75.41 -44.1 46.44 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 125.863 1.665 . . . . 0.0 109.199 162.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 36.9 mtm-85 -67.61 -33.58 75.27 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 115.318 -2.277 . . . . 0.0 111.781 171.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -67.59 -44.83 77.19 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 175.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.25 . . -56.31 -48.07 77.44 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 121.446 1.93 . . . . 0.0 113.289 176.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 7.0 mt -65.78 -39.38 90.94 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.877 -1.765 . . . . 0.0 114.429 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.33 -36.74 53.78 Favored Glycine 0 N--CA 1.448 -0.504 0 O-C-N 119.526 -1.984 . . . . 0.0 113.601 167.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 29.5 m -94.73 -31.83 13.61 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 120.203 -1.763 . . . . 0.0 109.438 -171.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -52.37 -33.84 45.09 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 119.273 3.064 . . . . 0.0 119.273 170.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.46 -39.47 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 N-CA-C 115.932 1.827 . . . . 0.0 115.932 173.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -80.25 -25.08 39.69 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 174.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 78.8 mt -56.22 -50.21 72.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 O-C-N 120.631 -1.293 . . . . 0.0 112.34 158.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 41.9 t -64.47 -50.54 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 O-C-N 125.338 1.649 . . . . 0.0 114.349 176.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -51.67 -42.28 62.01 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 125.165 2.412 . . . . 0.0 109.823 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -72.78 -19.3 61.38 Favored 'General case' 0 N--CA 1.451 -0.409 1 O-C-N 115.051 -4.78 . . . . 0.0 117.193 178.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 62.8 mt -79.49 -18.93 50.92 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 126.449 2.343 . . . . 0.0 115.425 166.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 10.4 mt -94.83 -25.99 16.39 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.956 2.102 . . . . 0.0 108.548 175.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 31.4 ttm105 -77.23 -38.47 51.17 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 122.627 2.467 . . . . 0.0 110.822 163.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.37 17.63 74.51 Favored Glycine 0 C--N 1.339 0.696 0 CA-C-N 123.441 2.837 . . . . 0.0 116.869 169.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -92.93 -40.49 10.55 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 119.034 1.417 . . . . 0.0 110.841 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 49.5 mtm -75.15 44.51 0.25 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 128.094 2.558 . . . . 0.0 108.154 173.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 85.5 p -87.24 175.45 8.03 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 119.673 3.212 . . . . 0.0 119.673 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 63.92 -33.33 0.13 Allowed 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 129.918 3.287 . . . . 0.0 112.797 174.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -146.75 -46.13 0.18 Allowed 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 129.119 2.968 . . . . 0.0 108.771 -176.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -75.39 -40.79 57.56 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 117.738 -3.101 . . . . 0.0 118.537 -149.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 tt -62.83 -43.0 99.96 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 123.81 0.844 . . . . 0.0 109.575 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -54.0 -22.51 10.68 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.133 0.973 . . . . 0.0 112.434 175.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -110.78 -37.56 5.39 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 116.942 2.201 . . . . 0.0 116.942 174.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -64.6 -51.12 64.37 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.435 3.094 . . . . 0.0 115.79 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.37 1.3 mm? -99.23 -22.75 15.48 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.563 1.545 . . . . 0.0 109.884 170.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 77.57 -149.7 35.49 Favored Glycine 0 CA--C 1.523 0.593 1 N-CA-C 123.949 4.34 . . . . 0.0 123.949 166.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -45.51 -24.1 0.29 Allowed 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 128.031 2.842 . . . . 0.0 118.154 -164.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.05 -20.43 79.97 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-O 125.72 2.845 . . . . 0.0 118.984 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . 0.308 2.1 tt -44.31 -39.13 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 111.846 -2.177 . . . . 0.0 114.739 176.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.79 -17.43 44.15 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 129.548 3.139 . . . . 0.0 110.414 -175.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 1.7 m -74.73 -39.61 61.76 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 125.473 2.558 . . . . 0.0 112.598 164.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 15.2 mm -73.62 -19.87 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 120.991 3.7 . . . . 0.0 120.991 173.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 72.5 p -111.54 -40.98 4.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 117.565 -3.209 . . . . 0.0 105.826 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.279 35.0 mtp85 -70.79 169.53 14.39 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 122.765 2.53 . . . . 0.0 114.28 171.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 100.73 133.37 8.11 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 104.763 -3.335 . . . . 0.0 104.763 -174.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -49.68 -24.79 2.44 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -145.11 42.89 1.31 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 127.688 2.395 . . . . 0.0 112.847 -169.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 60.2 p -75.95 -177.93 4.1 Favored 'General case' 0 N--CA 1.45 -0.464 1 O-C-N 129.252 4.095 . . . . 0.0 107.918 174.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.285 3.0 tt -52.98 -31.67 42.05 Favored 'General case' 0 N--CA 1.45 -0.44 1 N-CA-C 122.356 4.206 . . . . 0.0 122.356 160.152 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -72.09 -24.59 61.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.418 1.887 . . . . 0.0 112.214 172.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.69 -19.57 16.0 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.614 -1.66 . . . . 0.0 114.728 -175.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 41.5 84.5 0.18 Allowed Pre-proline 0 N--CA 1.449 -0.489 0 C-N-CA 128.736 2.814 . . . . 0.0 113.581 163.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . 0.473 ' C ' ' H ' ' D' ' 95' ' ' GLU . 50.2 Cg_exo 22.82 54.07 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 O-C-N 115.231 -3.089 . . . . 0.0 112.933 58.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 4.7 t -74.03 31.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 CA-C-O 122.612 1.196 . . . . 0.0 110.325 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . 0.473 ' H ' ' C ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -137.18 -37.42 0.64 Allowed 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 116.199 -1.858 . . . . 0.0 114.788 174.597 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . 0.259 26.4 tp -55.68 -46.46 77.57 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.588 -1.672 . . . . 0.0 109.204 163.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 26.2 ptt180 -65.38 -35.04 79.76 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 117.0 -1.88 . . . . 0.0 114.217 -176.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -71.08 -35.54 71.89 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 115.038 1.495 . . . . 0.0 115.038 -172.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 29.9 t90 -63.65 -46.91 83.48 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 160.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 21.2 mt -63.22 -38.79 92.57 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 122.776 1.274 . . . . 0.0 113.234 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -47.38 -42.71 22.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 117.797 2.517 . . . . 0.0 117.797 163.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -95.15 -20.59 19.13 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 118.349 -2.719 . . . . 0.0 108.352 -166.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 89.8 t -85.61 -32.79 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 128.532 2.733 . . . . 0.0 114.185 165.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 64.9 mt -102.26 -6.09 23.54 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -171.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 51.9 mt -120.54 21.33 11.62 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 119.992 -1.692 . . . . 0.0 108.465 170.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 14.1 pttp -59.59 159.89 7.86 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 116.648 2.092 . . . . 0.0 116.648 -173.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.8 m -71.46 5.64 2.23 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 119.881 3.289 . . . . 0.0 119.881 -172.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 C--O 1.248 0.992 0 C-N-CA 127.167 2.187 . . . . 0.0 112.68 150.33 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.61 -31.61 69.65 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 116.437 -3.914 . . . . 0.0 117.522 -169.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -82.45 -29.14 30.84 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 115.72 -2.086 . . . . 0.0 110.24 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -71.9 -26.83 62.48 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 121.2 1.818 . . . . 0.0 108.113 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.6 p -80.53 172.56 9.5 Favored Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 129.069 2.948 . . . . 0.0 109.407 -171.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -64.85 -32.41 55.57 Favored 'Trans proline' 0 N--CA 1.45 -1.076 0 CA-C-O 116.349 -1.604 . . . . 0.0 114.269 -170.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -149.65 132.91 16.43 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.989 2.115 . . . . 0.0 112.007 177.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.2 t -89.8 97.84 11.42 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 124.738 2.209 . . . . 0.0 110.334 -167.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.53 -16.08 44.27 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 112.518 -2.128 . . . . 0.0 111.806 173.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.32 -36.51 29.67 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 120.784 -1.197 . . . . 0.0 108.764 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.5 ttp -74.9 -26.27 59.53 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 125.254 2.454 . . . . 0.0 114.685 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.78 -26.43 67.25 Favored 'General case' 0 N--CA 1.452 -0.346 1 O-C-N 114.173 -5.329 . . . . 0.0 111.616 166.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -88.19 -27.21 21.97 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 127.077 2.151 . . . . 0.0 114.485 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -85.15 -44.01 13.33 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 103.447 -2.797 . . . . 0.0 103.447 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.414 ' HD3' ' HA ' ' A' ' 15' ' ' ARG . 9.8 mmt180 -67.18 -45.63 76.38 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 104.054 -2.573 . . . . 0.0 104.054 -175.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -59.09 -46.29 88.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 117.737 -1.585 . . . . 0.0 114.349 175.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.11 -24.18 67.36 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 120.318 -1.488 . . . . 0.0 108.42 178.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.54 -28.83 61.13 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.969 -2.957 . . . . 0.0 109.569 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 53.5 t-105 -94.52 -33.8 12.93 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 125.53 2.586 . . . . 0.0 112.583 -172.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 56.7 mt -60.75 -15.06 25.43 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 116.943 -3.598 . . . . 0.0 119.699 163.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -68.87 -48.32 63.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 130.472 3.509 . . . . 0.0 105.39 173.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -71.93 -37.29 70.04 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.549 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.3 t -65.45 -41.19 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-O 124.453 2.073 . . . . 0.0 112.264 -178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -69.96 -34.66 73.69 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 119.634 -1.916 . . . . 0.0 110.202 172.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 24.5 tp -73.96 -45.72 48.42 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 117.847 -3.033 . . . . 0.0 109.579 -173.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 tp -59.09 -36.59 75.38 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.432 ' HB2' ' CE1' ' B' ' 30' ' ' TYR . 69.8 tttt -62.62 -46.65 87.29 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 112.434 -2.166 . . . . 0.0 115.47 170.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -57.21 -39.19 74.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 126.205 1.802 . . . . 0.0 106.963 172.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.98 -31.27 56.39 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 114.395 -2.716 . . . . 0.0 108.597 -177.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -58.24 -42.2 85.86 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 173.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -75.68 -15.09 60.35 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 127.536 2.334 . . . . 0.0 110.553 -178.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -131.78 16.69 4.76 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.34 3.4 m-20 73.3 1.75 4.1 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 116.95 2.204 . . . . 0.0 116.95 168.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.2 mt -75.29 6.0 4.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.529 1.157 . . . . 0.0 113.562 168.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . 0.341 17.2 p-80 -67.47 -62.39 1.44 Allowed 'General case' 0 N--CA 1.451 -0.416 1 O-C-N 113.847 -5.533 . . . . 0.0 111.564 -166.436 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.262 26.7 mt -49.1 -46.79 76.12 Favored Pre-proline 0 N--CA 1.449 -0.515 0 CA-C-O 114.115 -2.85 . . . . 0.0 117.338 167.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -58.96 -42.88 47.71 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 124.665 3.577 . . . . 0.0 113.089 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 17.7 tp -69.69 -46.83 65.14 Favored 'General case' 0 N--CA 1.452 -0.372 1 O-C-N 115.025 -4.797 . . . . 0.0 110.726 177.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 74.7 mt -55.16 -42.46 73.15 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 126.416 2.323 . . . . 0.0 115.577 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.3 m-20 -77.82 -4.6 47.35 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 125.084 1.353 . . . . 0.0 113.388 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 23.6 tp -99.36 -29.13 12.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 114.144 -2.836 . . . . 0.0 113.276 169.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 59.8 mmm -107.72 -9.48 15.81 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.076 2.11 . . . . 0.0 116.543 -177.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.5 mp -118.36 152.11 36.46 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 118.839 -2.413 . . . . 0.0 109.339 159.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.8 p -110.46 165.45 12.66 Favored Pre-proline 0 N--CA 1.452 -0.343 0 C-N-CA 124.972 1.309 . . . . 0.0 107.79 -170.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -61.34 -40.68 47.2 Favored 'Trans proline' 0 N--CA 1.446 -1.315 0 C-N-CA 124.307 3.338 . . . . 0.0 117.994 -163.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -22.56 62.56 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 116.632 -1.651 . . . . 0.0 109.969 176.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -72.0 -41.86 67.1 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 121.219 1.827 . . . . 0.0 112.517 175.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 20.6 mtm180 -65.23 -49.82 68.2 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 123.946 0.899 . . . . 0.0 110.944 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -55.92 -39.3 71.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 171.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.43 -37.15 84.56 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 117.261 -1.352 . . . . 0.0 110.14 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 30.2 mt -74.88 -27.88 60.42 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 124.664 3.393 . . . . 0.0 110.571 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.41 -44.39 98.09 Favored Glycine 0 CA--C 1.522 0.517 0 O-C-N 119.757 -1.839 . . . . 0.0 113.67 171.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -60.66 -32.13 71.33 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.288 1.435 . . . . 0.0 114.131 171.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.262 93.9 mtt180 -68.67 -34.42 75.66 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.545 -0.74 . . . . 0.0 111.232 -177.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.96 -48.21 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 168.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -55.01 -39.43 69.07 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 112.624 -3.56 . . . . 0.0 114.473 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 52.8 mt -63.43 -49.13 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 123.285 2.766 . . . . 0.0 111.849 167.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.0 -35.33 71.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 O-C-N 117.772 -3.08 . . . . 0.0 108.541 -174.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -60.45 -54.53 44.4 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 118.824 -2.423 . . . . 0.0 108.686 174.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -60.5 -27.6 67.72 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 171.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.5 mt -76.28 -25.31 54.77 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 117.456 -3.277 . . . . 0.0 111.149 176.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.9 mt -92.35 -40.06 11.12 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 127.725 2.41 . . . . 0.0 112.226 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.6 ttm105 -46.73 -56.49 6.11 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 117.044 -3.535 . . . . 0.0 112.454 148.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.67 44.94 61.12 Favored Glycine 0 C--N 1.337 0.611 0 C-N-CA 117.602 -2.237 . . . . 0.0 112.702 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -121.04 -52.08 2.09 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 127.653 2.381 . . . . 0.0 114.762 178.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.0 mtt -67.7 130.81 44.17 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 119.101 -2.249 . . . . 0.0 114.516 175.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.1 p -83.54 178.32 8.05 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 120.459 1.481 . . . . 0.0 110.033 -178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -63.87 -46.45 84.92 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 116.507 -2.077 . . . . 0.0 112.855 172.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.9 tpt85 -63.01 -10.07 12.46 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 119.792 3.256 . . . . 0.0 119.792 170.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -86.66 -42.89 13.05 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 120.938 1.699 . . . . 0.0 110.668 165.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 19.8 mt -63.83 -26.32 68.57 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.963 -1.71 . . . . 0.0 111.259 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -63.45 -21.81 66.52 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.356 1.062 . . . . 0.0 111.427 -176.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -102.08 -53.03 3.02 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 129.36 3.064 . . . . 0.0 111.125 166.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -74.59 -27.06 60.32 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 124.011 3.096 . . . . 0.0 115.523 -168.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.4 mt -121.83 -5.23 9.11 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 118.707 2.854 . . . . 0.0 118.707 170.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 82.35 5.15 89.83 Favored Glycine 0 CA--C 1.523 0.555 0 CA-C-O 116.137 -2.48 . . . . 0.0 115.027 172.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.67 138.78 43.08 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 117.438 2.384 . . . . 0.0 117.438 -170.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.73 171.53 55.13 Favored Glycine 0 C--N 1.34 0.779 0 CA-C-O 124.552 2.196 . . . . 0.0 116.159 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.8 mt -54.31 -59.29 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 1 O-C-N 115.096 -4.767 . . . . 0.0 112.656 173.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.11 -34.96 75.79 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.99 1.716 . . . . 0.0 113.842 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.15 -36.2 66.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 124.121 0.968 . . . . 0.0 110.538 177.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.39 49.7 mm -69.33 -45.15 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 O-C-N 118.465 -2.647 . . . . 0.0 114.338 164.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.1 m -65.36 -52.35 54.26 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.629 -177.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -74.55 -32.86 62.57 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 121.201 1.818 . . . . 0.0 110.462 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -62.12 -34.97 90.75 Favored Glycine 0 C--N 1.338 0.668 0 O-C-N 120.142 -1.599 . . . . 0.0 111.566 169.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.0 m -68.67 -45.0 72.87 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.126 -2.985 . . . . 0.0 111.036 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -57.94 -40.87 81.57 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 172.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 75.8 m -72.16 -25.94 61.89 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 113.656 -1.611 . . . . 0.0 113.848 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.6 tp -71.0 -33.09 70.06 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 166.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -69.04 -32.51 72.07 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 113.491 -3.147 . . . . 0.0 112.193 169.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.91 -5.68 40.09 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 128.109 3.381 . . . . 0.0 114.892 170.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.4 143.0 87.33 Favored Pre-proline 0 N--CA 1.448 -0.538 1 O-C-N 115.679 -4.388 . . . . 0.0 108.692 172.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -73.2 149.15 45.31 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 123.574 2.849 . . . . 0.0 110.202 175.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.2 m -65.98 -32.47 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 116.873 -3.642 . . . . 0.0 107.953 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.265 18.2 pm0 -65.07 -26.24 68.15 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 119.92 1.236 . . . . 0.0 111.192 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 48.2 tp -80.99 -41.9 22.02 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 116.757 -1.592 . . . . 0.0 110.853 177.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -68.59 -38.09 80.37 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 121.89 2.132 . . . . 0.0 111.79 176.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -53.79 -37.27 63.31 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 129.534 3.133 . . . . 0.0 111.815 168.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 34.2 t90 -77.19 -49.69 14.61 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.891 1.276 . . . . 0.0 109.098 176.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 79.1 mt -68.64 -33.42 73.99 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 -174.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.21 -36.18 81.16 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 121.64 2.018 . . . . 0.0 113.855 169.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -74.55 -34.43 62.94 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 118.959 -2.338 . . . . 0.0 114.548 170.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.4 t -70.55 -44.07 77.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 O-C-N 119.589 -1.944 . . . . 0.0 110.184 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . 0.286 12.0 mt -97.34 -27.98 14.24 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -172.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 23.6 mt -103.82 19.81 19.26 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 117.162 -3.461 . . . . 0.0 114.991 -167.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -126.61 17.13 7.53 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 119.848 -1.783 . . . . 0.0 115.417 -170.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.8 m -99.54 -58.44 1.93 Allowed 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 126.779 2.549 . . . . 0.0 110.388 -168.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 . . . . . 0 C--O 1.252 1.198 0 N-CA-C 117.38 2.363 . . . . 0.0 117.38 -173.88 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 24.5 ttp . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.67 -16.98 63.64 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 126.719 2.512 . . . . 0.0 111.467 -159.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -86.85 -22.01 26.04 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 120.527 -1.358 . . . . 0.0 110.738 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -69.75 -37.24 76.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.23 -2.169 . . . . 0.0 110.616 172.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 14.6 m -75.21 143.71 77.39 Favored Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-N 114.532 -1.213 . . . . 0.0 109.865 -167.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -52.13 -42.76 57.43 Favored 'Trans proline' 0 N--CA 1.449 -1.121 1 C-N-CA 126.916 5.077 . . . . 0.0 112.369 163.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -116.83 148.06 41.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.138 1.775 . . . . 0.0 114.838 173.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.431 ' HB3' ' HG3' ' B' ' 11' ' ' MET . 13.8 t -148.09 132.48 17.58 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.713 1.605 . . . . 0.0 111.823 158.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.23 -44.91 43.9 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 124.907 2.289 . . . . 0.0 110.204 163.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.91 -24.02 62.38 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 116.617 -3.802 . . . . 0.0 109.581 -172.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.431 ' HG3' ' HB3' ' B' ' 8' ' ' SER . 4.0 mtt -87.61 -43.0 12.3 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 103.95 -2.611 . . . . 0.0 103.95 -176.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.65 -37.36 63.05 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 128.114 2.566 . . . . 0.0 116.183 170.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -66.23 -57.27 7.94 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 130.559 3.544 . . . . 0.0 107.724 -178.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -47.93 -46.14 31.71 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 129.397 3.079 . . . . 0.0 115.394 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -74.7 -43.27 55.99 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 126.407 1.883 . . . . 0.0 109.837 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -62.9 -26.66 68.9 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.179 1.354 . . . . 0.0 114.393 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -73.81 -50.72 19.14 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 116.278 -1.82 . . . . 0.0 110.581 174.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -43.12 -51.84 5.72 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 127.718 3.136 . . . . 0.0 114.26 163.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 -57.09 -49.84 74.64 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 125.934 1.694 . . . . 0.0 115.028 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 38.7 mt -63.46 -23.34 67.36 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 119.751 -1.843 . . . . 0.0 112.009 -176.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . 0.259 67.5 ttt180 -67.93 -30.19 69.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.788 2.035 . . . . 0.0 112.301 175.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -79.77 -36.83 36.59 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 115.899 -2.0 . . . . 0.0 111.358 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 20.9 t -59.28 -39.69 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 O-C-N 126.402 2.314 . . . . 0.0 112.914 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -80.1 -35.23 37.17 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 116.464 -1.732 . . . . 0.0 114.872 -179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 25.8 tp -58.74 -47.43 84.66 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 126.175 2.893 . . . . 0.0 114.63 168.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 28.8 tp -70.53 -32.93 70.58 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 116.863 -3.648 . . . . 0.0 112.526 -177.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . 0.317 59.2 tttt -49.7 -50.59 43.21 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 126.318 2.961 . . . . 0.0 110.854 165.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -81.91 -20.04 39.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 116.958 -3.588 . . . . 0.0 111.51 -174.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.49 -36.32 57.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 172.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . 0.432 ' CE1' ' HB2' ' A' ' 27' ' ' LYS . 6.3 m-85 -50.53 -39.73 49.78 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 116.127 1.899 . . . . 0.0 116.127 170.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -90.28 6.28 43.6 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.375 2.361 . . . . 0.0 117.375 178.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -119.67 6.21 11.01 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 119.409 -2.057 . . . . 0.0 107.93 175.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 57.82 43.5 21.65 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 117.231 -3.418 . . . . 0.0 112.793 -173.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 89.3 mt -125.15 5.51 7.86 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.46 -2.65 . . . . 0.0 111.523 -174.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -62.76 -39.49 94.31 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 119.197 -2.189 . . . . 0.0 113.555 -178.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' B' ' 36' ' ' LEU . 12.3 mt -66.54 -52.42 35.59 Favored Pre-proline 0 N--CA 1.446 -0.662 1 O-C-N 115.21 -4.681 . . . . 0.0 109.143 -173.281 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' B' ' 36' ' ' LEU . 38.9 Cg_endo -70.53 -26.16 24.26 Favored 'Trans proline' 0 N--CA 1.447 -1.215 0 C-N-CA 121.665 1.576 . . . . 0.0 110.833 -177.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 49.4 tp -64.76 -44.47 89.93 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.583 1.553 . . . . 0.0 114.864 174.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 83.1 mt -78.84 -32.03 45.97 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.848 2.459 . . . . 0.0 111.456 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -62.33 -28.06 69.48 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 123.567 2.894 . . . . 0.0 109.276 165.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 51.6 tp -89.36 -34.79 16.4 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 126.643 1.977 . . . . 0.0 113.844 -176.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 16.6 mmt -86.99 -21.47 26.15 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 115.085 -2.388 . . . . 0.0 112.077 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 44.5 mt -137.81 124.55 21.08 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 128.891 2.876 . . . . 0.0 110.153 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 77.1 p -68.9 166.79 24.23 Favored Pre-proline 0 N--CA 1.451 -0.423 0 C-N-CA 124.769 1.228 . . . . 0.0 112.292 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -40.54 -52.51 3.07 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 124.65 3.567 . . . . 0.0 113.726 167.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -66.7 -24.63 66.28 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 121.719 2.054 . . . . 0.0 114.816 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -83.49 -33.79 25.49 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 127.296 2.239 . . . . 0.0 115.912 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 56.6 mtm-85 -72.71 -40.53 66.11 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 127.442 2.297 . . . . 0.0 108.848 177.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . 0.286 38.8 tt0 -63.57 -37.47 87.45 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 126.579 2.425 . . . . 0.0 115.688 176.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.7 -53.44 58.01 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.987 174.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.0 mt -59.14 -37.48 77.37 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 121.134 3.753 . . . . 0.0 121.134 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.19 -30.73 74.6 Favored Glycine 0 CA--C 1.523 0.594 0 C-N-CA 126.638 2.066 . . . . 0.0 115.313 166.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 74.1 m -87.29 -45.08 10.92 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 112.191 -3.766 . . . . 0.0 104.221 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -51.01 -45.93 61.35 Favored 'General case' 0 N--CA 1.452 -0.359 1 CA-C-N 126.227 4.103 . . . . 0.0 109.879 176.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.0 t -50.62 -55.07 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 116.627 -1.654 . . . . 0.0 111.773 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -56.18 -35.02 66.77 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 116.116 1.895 . . . . 0.0 116.116 172.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 80.7 mt -67.55 -45.37 85.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 120.545 1.521 . . . . 0.0 113.33 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 43.7 t -83.56 -1.9 6.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 126.285 1.834 . . . . 0.0 114.608 -172.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . 0.292 57.4 tt0 -92.36 -28.21 17.05 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 106.062 -1.829 . . . . 0.0 106.062 171.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -78.57 -20.96 49.4 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 126.467 1.907 . . . . 0.0 115.616 177.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 91.9 mt -63.93 -33.79 76.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 160.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . 0.267 13.2 mt -77.03 -33.27 57.37 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 120.6 3.556 . . . . 0.0 120.6 174.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 37.4 ttm105 -87.42 -58.67 2.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 127.867 3.229 . . . . 0.0 108.5 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.71 39.5 20.93 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 118.98 2.352 . . . . 0.0 118.98 175.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -123.5 -6.09 8.15 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 117.705 -1.141 . . . . 0.0 111.648 -168.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 5.1 mtt -83.37 152.33 25.1 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 30.5 p -83.45 159.56 21.73 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 117.662 -3.149 . . . . 0.0 115.989 157.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -61.97 -31.15 71.48 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 119.86 -1.775 . . . . 0.0 109.119 -173.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -59.29 -39.76 84.03 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 119.275 -2.141 . . . . 0.0 114.497 171.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -72.1 -38.1 69.41 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 119.822 -1.799 . . . . 0.0 108.5 -176.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 46.3 mt -55.98 -48.85 75.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 118.95 -2.344 . . . . 0.0 107.554 176.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -66.39 -40.3 89.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 116.505 -2.078 . . . . 0.0 114.881 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -99.38 -17.86 17.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 125.691 2.663 . . . . 0.0 117.317 -164.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -105.2 -49.62 3.42 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 128.98 2.912 . . . . 0.0 112.236 176.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 60.7 mt -95.85 -4.83 42.98 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 126.452 2.345 . . . . 0.0 113.604 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.84 19.27 60.74 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-O 118.895 -0.947 . . . . 0.0 114.14 -178.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -100.79 118.25 36.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 116.418 2.007 . . . . 0.0 116.418 -165.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.01 167.98 54.36 Favored Glycine 0 CA--C 1.523 0.556 1 CA-C-O 128.364 4.313 . . . . 0.0 110.688 174.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 80.6 mt -52.23 -39.71 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 O-C-N 116.467 -3.961 . . . . 0.0 112.399 171.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . 0.275 . . -78.65 -39.29 37.39 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 116.798 -3.689 . . . . 0.0 115.013 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 9.2 m -56.92 -36.82 70.65 Favored 'General case' 0 N--CA 1.454 -0.272 1 O-C-N 114.22 -5.3 . . . . 0.0 113.171 166.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 14.3 mm -64.1 -53.07 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 170.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 24.1 m -55.07 -48.28 73.74 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 121.309 1.868 . . . . 0.0 114.455 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 20.1 ttt180 -63.88 -41.37 97.76 Favored 'General case' 0 N--CA 1.451 -0.408 1 O-C-N 116.239 -4.038 . . . . 0.0 112.524 175.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.68 -46.82 66.04 Favored Glycine 0 C--N 1.334 0.46 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 172.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 19.9 m -71.6 -29.66 64.93 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 117.008 -1.472 . . . . 0.0 113.953 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -61.27 -58.79 6.82 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 119.79 1.177 . . . . 0.0 111.119 169.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 3.3 m -60.04 -33.24 71.75 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.078 2.151 . . . . 0.0 114.225 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 20.2 mt -58.69 -36.25 73.92 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 113.59 -3.1 . . . . 0.0 114.446 162.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 58.8 mttt -70.33 1.79 4.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 122.6 2.455 . . . . 0.0 112.39 173.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -117.52 -5.79 11.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 127.897 2.479 . . . . 0.0 115.761 174.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.4 131.84 64.15 Favored Pre-proline 0 N--CA 1.448 -0.567 0 C-N-CA 124.225 1.01 . . . . 0.0 109.809 -174.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -61.69 153.27 68.51 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 117.843 -0.971 . . . . 0.0 109.839 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 3.0 m -55.89 -33.77 35.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 126.52 2.388 . . . . 0.0 114.084 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 -74.49 -27.89 60.76 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 117.508 2.41 . . . . 0.0 117.508 -177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 52.7 tp -66.34 -50.79 62.38 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 117.343 -3.348 . . . . 0.0 111.437 164.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 15.3 mtm180 -61.47 -45.02 96.03 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 -173.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -53.98 -38.8 65.43 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 118.679 -2.513 . . . . 0.0 115.651 163.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -74.16 -35.44 64.03 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.42 -31.31 72.43 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 175.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -75.54 -18.78 59.68 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 124.488 1.117 . . . . 0.0 113.035 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -84.6 -31.85 24.07 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 131.617 3.967 . . . . 0.0 115.663 170.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 84.8 t -104.68 -52.63 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 116.287 -1.816 . . . . 0.0 111.956 -170.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 79.1 mt -76.41 -50.11 14.98 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 121.446 1.93 . . . . 0.0 108.665 -173.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 45.0 mt -67.91 -30.45 69.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 126.226 2.204 . . . . 0.0 110.376 -173.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . 0.283 89.1 mttt -70.06 -11.69 61.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 120.038 -1.664 . . . . 0.0 114.281 172.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.3 m -82.31 -9.37 59.5 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 116.554 -3.842 . . . . 0.0 116.506 168.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 82.4 m-20 . . . . . 0 C--O 1.248 1.013 0 CA-C-N 123.608 2.913 . . . . 0.0 112.428 170.165 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 14.9 ttt . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 124.975 2.321 . . . . 0.0 108.466 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.53 159.44 31.28 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 111.867 -2.424 . . . . 0.0 114.166 -168.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -131.86 148.4 52.54 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -127.09 127.22 44.3 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 128.462 2.705 . . . . 0.0 110.943 169.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 74.5 p -119.95 167.92 11.41 Favored Pre-proline 0 N--CA 1.451 -0.382 0 O-C-N 127.735 3.147 . . . . 0.0 113.45 168.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . 0.269 87.4 Cg_exo -59.52 -31.59 94.84 Favored 'Trans proline' 0 N--CA 1.451 -0.998 0 C-N-CA 123.983 3.122 . . . . 0.0 117.18 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . 0.271 68.9 t80 -148.66 141.56 24.74 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 119.346 -2.096 . . . . 0.0 108.539 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 2.7 t -141.37 120.89 13.26 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.443 -1.253 . . . . 0.0 112.328 166.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.82 -5.74 22.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 121.558 3.91 . . . . 0.0 121.558 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.91 -17.02 59.2 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 117.596 2.443 . . . . 0.0 117.596 171.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 33.1 mtt -86.58 -39.31 16.29 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 126.215 1.806 . . . . 0.0 108.015 173.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.07 -28.06 54.5 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 177.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -70.89 -28.93 64.9 Favored 'General case' 0 N--CA 1.449 -0.494 1 O-C-N 116.287 -4.008 . . . . 0.0 109.942 170.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -76.07 -31.66 58.88 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 115.86 -2.019 . . . . 0.0 113.457 171.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -35.34 79.09 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 121.535 1.97 . . . . 0.0 109.576 165.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -66.29 -49.56 66.67 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 125.92 2.012 . . . . 0.0 107.414 -174.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 71.4 mm-40 -63.9 -30.58 71.65 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 114.936 1.458 . . . . 0.0 114.936 173.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -67.36 -34.31 77.03 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.199 -2.188 . . . . 0.0 109.207 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . 0.507 ' CE2' ' HD2' ' D' ' 48' ' ' ARG . 58.3 t-105 -82.98 -40.27 20.24 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 -175.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 21.8 mt -64.85 -37.14 86.62 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 117.463 -1.695 . . . . 0.0 112.318 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -53.59 -36.78 62.31 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 128.172 2.589 . . . . 0.0 113.627 167.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . 0.274 75.7 t80 -52.24 -59.92 3.82 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 127.239 2.216 . . . . 0.0 106.153 171.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 98.8 t -74.38 -32.48 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 125.162 1.538 . . . . 0.0 110.671 -170.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -68.4 -34.34 75.86 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 116.698 -3.751 . . . . 0.0 112.02 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . 0.438 ' CD1' HG11 ' D' ' 103' ' ' VAL . 35.8 tp -77.44 -28.35 52.44 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 119.095 -2.253 . . . . 0.0 109.276 174.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . 0.445 HD11 HD21 ' C' ' 39' ' ' LEU . 15.6 tp -70.72 -28.33 64.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 115.652 -2.118 . . . . 0.0 113.848 170.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp -88.11 -28.66 21.15 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 121.901 2.137 . . . . 0.0 110.365 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -60.98 -28.67 69.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.863 1.665 . . . . 0.0 110.952 164.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.44 -7.22 48.68 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 122.98 1.371 . . . . 0.0 111.786 -174.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -99.64 0.75 42.66 Favored 'General case' 0 N--CA 1.451 -0.402 1 O-C-N 115.968 -4.207 . . . . 0.0 110.89 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -70.69 -36.56 73.34 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 124.474 3.306 . . . . 0.0 111.402 175.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 49.8 p-10 -124.1 17.65 9.2 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 120.408 -1.432 . . . . 0.0 108.859 -171.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.292 4.2 m-20 56.31 32.55 20.64 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 116.939 2.2 . . . . 0.0 116.939 -175.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 21.9 mt -89.2 10.04 23.51 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.105 -2.872 . . . . 0.0 107.567 173.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -58.23 -47.03 84.8 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 123.011 2.641 . . . . 0.0 110.96 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.283 62.8 mt -67.55 -44.61 45.16 Favored Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-O 113.227 -3.273 . . . . 0.0 110.466 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -70.27 -20.3 32.6 Favored 'Trans proline' 0 N--CA 1.448 -1.189 0 CA-C-N 123.731 2.368 . . . . 0.0 111.629 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 26.5 tp -81.17 -30.02 34.5 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 122.088 2.222 . . . . 0.0 115.215 167.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . 0.634 HD13 ' CZ2' ' D' ' 19' ' ' TRP . 75.1 mt -65.34 -27.98 68.97 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 120.452 -1.405 . . . . 0.0 111.795 165.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -92.94 -0.64 57.18 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 126.913 2.085 . . . . 0.0 109.235 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 30.7 tp -100.63 -44.41 5.84 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 127.939 3.733 . . . . 0.0 115.106 167.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . 0.252 9.1 mmt -77.57 -36.47 52.04 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 117.51 -3.244 . . . . 0.0 114.284 -175.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.53 152.6 33.77 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 125.128 1.518 . . . . 0.0 111.787 -173.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 27.8 p -76.46 162.43 70.94 Favored Pre-proline 0 N--CA 1.452 -0.347 0 C-N-CA 127.024 2.129 . . . . 0.0 115.909 163.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -56.9 -37.29 98.62 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 CA-C-N 124.241 2.55 . . . . 0.0 116.72 -176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -79.61 -4.32 51.04 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 127.985 3.303 . . . . 0.0 114.871 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -97.38 -16.58 20.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.006 -1.452 . . . . 0.0 113.39 171.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -84.5 -44.62 13.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 117.613 -1.184 . . . . 0.0 111.02 167.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -57.4 -43.9 84.08 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 104.31 -2.478 . . . . 0.0 104.31 177.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.05 -40.61 64.96 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 118.62 -2.55 . . . . 0.0 110.887 -169.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . 0.442 HD22 ' CZ ' ' D' ' 22' ' ' PHE . 3.3 mt -60.29 -45.63 92.68 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 125.427 2.537 . . . . 0.0 108.988 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.66 -43.26 96.36 Favored Glycine 0 CA--C 1.524 0.652 0 CA-C-O 116.781 -2.122 . . . . 0.0 111.667 173.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 60.6 m -60.37 -42.67 96.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.152 1.976 . . . . 0.0 112.982 173.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.309 96.0 mtt180 -57.61 -24.61 57.3 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 119.716 -1.865 . . . . 0.0 112.543 -172.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 98.5 t -63.8 -38.84 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 106.322 -1.732 . . . . 0.0 106.322 178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 68.2 mtp180 -83.27 -15.53 49.87 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 123.855 1.788 . . . . 0.0 112.048 -171.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 32.6 mt -74.95 -47.23 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 C-N-CA 126.272 1.829 . . . . 0.0 106.522 169.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 35.1 t -61.16 -48.98 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 122.602 1.192 . . . . 0.0 113.553 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -49.83 -42.54 47.48 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 117.44 2.385 . . . . 0.0 117.44 173.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -69.4 -50.74 43.2 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 115.149 -2.357 . . . . 0.0 109.684 175.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 65.9 mt -66.06 -7.22 16.17 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 123.238 2.744 . . . . 0.0 117.464 177.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 80.1 mt -93.74 -33.25 13.69 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.449 2.3 . . . . 0.0 110.387 167.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 45.5 ttm180 -80.02 -38.7 31.47 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 116.811 2.152 . . . . 0.0 116.811 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.54 22.23 74.95 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 122.672 3.829 . . . . 0.0 122.672 170.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -83.54 -16.08 46.84 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 116.665 -3.844 . . . . 0.0 115.763 165.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 35.4 mtt -77.96 130.13 36.16 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 117.708 -1.597 . . . . 0.0 113.095 173.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 81.7 p -80.8 168.31 18.94 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 124.065 0.853 . . . . 0.0 111.992 159.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -41.37 -43.63 2.57 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 130.023 3.329 . . . . 0.0 110.52 172.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -52.77 -41.62 64.25 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 118.05 -2.906 . . . . 0.0 112.263 -176.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -90.38 -38.3 13.41 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 131.592 3.957 . . . . 0.0 109.616 -169.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 62.8 mt -62.23 -21.49 65.2 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 120.133 -1.604 . . . . 0.0 111.689 174.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 31.7 tttp -80.46 -46.43 15.93 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 118.133 -1.427 . . . . 0.0 113.199 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -86.59 -54.0 4.65 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 119.02 -2.3 . . . . 0.0 112.506 -176.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -71.41 -32.97 69.01 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.327 -1.483 . . . . 0.0 113.67 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 mp -101.22 -3.24 29.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 116.447 2.017 . . . . 0.0 116.447 174.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 72.23 -142.17 32.46 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-O 117.112 -1.938 . . . . 0.0 112.698 159.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -99.48 -7.04 26.56 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 131.446 3.899 . . . . 0.0 114.169 164.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.38 -32.45 52.07 Favored Glycine 0 C--N 1.337 0.595 0 C-N-CA 126.778 2.132 . . . . 0.0 112.567 172.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 13.1 tt -54.29 -40.9 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-O 114.705 -2.569 . . . . 0.0 117.161 175.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.65 -34.28 77.85 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.148 1.53 . . . . 0.0 109.972 -178.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . 0.464 HG23 ' CG2' ' D' ' 44' ' ' THR . 31.5 m -60.25 -33.13 71.87 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 115.418 -2.229 . . . . 0.0 114.054 168.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 28.1 mm -88.97 -17.41 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 126.825 2.05 . . . . 0.0 111.492 -177.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.2 p -117.48 -19.73 9.35 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -165.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -119.23 151.03 39.1 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 118.494 -2.629 . . . . 0.0 114.609 -175.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.7 170.0 44.17 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 120.879 3.111 . . . . 0.0 120.879 -164.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 67.8 p -84.96 0.85 49.89 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 118.103 -2.998 . . . . 0.0 113.654 -168.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -117.98 5.93 12.13 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.74 2.416 . . . . 0.0 114.325 175.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 74.6 p -61.14 158.35 14.03 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 119.939 3.311 . . . . 0.0 119.939 175.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 15.7 tp -57.11 -28.18 62.45 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 120.016 -1.677 . . . . 0.0 115.41 -163.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -103.4 16.67 25.93 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 173.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -119.68 -7.78 10.02 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 128.181 2.592 . . . . 0.0 112.867 169.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.64 163.32 61.74 Favored Pre-proline 0 N--CA 1.451 -0.379 0 C-N-CA 128.167 2.587 . . . . 0.0 109.587 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -61.63 146.68 96.63 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 123.504 2.803 . . . . 0.0 110.506 -176.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 12.9 t -67.15 -42.34 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 CA-C-N 113.376 -1.738 . . . . 0.0 113.42 -178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pm0 -56.5 -12.05 1.56 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 160.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . 0.285 14.3 tp -93.36 -41.3 9.92 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.632 -3.168 . . . . 0.0 115.073 164.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -51.68 -34.1 36.87 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 129.243 3.017 . . . . 0.0 113.69 167.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -94.47 -42.13 9.01 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 116.795 -1.574 . . . . 0.0 108.148 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -58.14 -40.49 81.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 116.713 -1.613 . . . . 0.0 113.562 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 82.6 mt -62.61 -38.67 91.09 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 125.707 1.879 . . . . 0.0 110.696 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -71.68 -8.23 52.88 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 172.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -99.25 -5.72 29.35 Favored 'General case' 0 N--CA 1.447 -0.595 2 CA-C-N 127.383 4.628 . . . . 0.0 110.75 175.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 90.0 t -125.49 -42.97 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.675 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 8.3 mt -80.6 -15.24 57.11 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.95 -2.344 . . . . 0.0 109.786 -176.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 83.9 mt -136.42 15.76 3.19 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 116.84 2.163 . . . . 0.0 116.84 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -74.09 132.5 42.35 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 118.441 -2.662 . . . . 0.0 116.409 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 1.5 m -111.49 3.79 18.34 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 125.964 1.706 . . . . 0.0 112.231 -168.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 17.1 t70 . . . . . 0 C--O 1.247 0.932 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 174.727 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 43.6 ttp . . . . . 0 N--CA 1.473 0.682 0 CA-C-O 116.497 -1.715 . . . . 0.0 113.691 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.95 165.15 22.91 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 119.267 0.939 . . . . 0.0 111.028 176.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -172.86 133.0 0.55 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.556 1.942 . . . . 0.0 110.268 -169.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -145.93 131.84 19.16 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 120.313 3.449 . . . . 0.0 120.313 -176.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 79.1 p -68.37 133.78 91.16 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 113.934 -2.936 . . . . 0.0 110.7 171.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.42 -27.97 46.68 Favored 'Trans proline' 0 N--CA 1.448 -1.148 1 C-N-CA 128.105 5.87 . . . . 0.0 113.973 -176.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -142.81 145.13 32.91 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 143.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 31.0 t -70.93 129.26 38.57 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 125.435 2.54 . . . . 0.0 110.829 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.45 -19.34 50.12 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 128.911 2.884 . . . . 0.0 108.485 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . 0.252 . . -67.61 -50.85 56.17 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 128.18 2.592 . . . . 0.0 110.285 167.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 17.1 mmt -63.27 -41.64 99.05 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 119.368 -2.082 . . . . 0.0 110.509 168.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.42 -33.62 72.77 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 120.588 1.54 . . . . 0.0 114.427 -176.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 20.7 tp10 -51.89 -65.21 0.6 Allowed 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 119.157 -2.214 . . . . 0.0 114.114 158.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -52.05 -35.5 47.48 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 118.53 2.789 . . . . 0.0 118.53 -174.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -34.67 78.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 120.261 -1.524 . . . . 0.0 113.768 171.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -78.76 -25.01 44.39 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 112.394 -3.67 . . . . 0.0 108.148 165.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -72.0 -33.33 67.99 Favored 'General case' 0 N--CA 1.45 -0.465 1 CA-C-N 126.17 4.077 . . . . 0.0 115.351 177.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -70.03 -25.25 63.49 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.095 1.758 . . . . 0.0 112.09 174.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . 0.634 ' CZ2' HD13 ' C' ' 39' ' ' LEU . 24.9 t-105 -79.83 -52.34 8.02 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 127.264 2.852 . . . . 0.0 106.451 177.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 61.5 mt -49.77 -32.97 15.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 116.762 2.134 . . . . 0.0 116.762 167.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -73.07 -31.0 64.1 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.611 1.564 . . . . 0.0 114.011 176.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . 0.442 ' CZ ' HD22 ' C' ' 51' ' ' LEU . 69.3 t80 -69.07 -46.43 67.83 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 126.656 2.472 . . . . 0.0 115.062 165.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 77.5 t -59.07 -36.92 65.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 120.255 1.389 . . . . 0.0 110.787 175.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . 0.326 20.8 t70 -61.26 -62.98 1.45 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 127.081 2.152 . . . . 0.0 111.7 169.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . 0.482 HD23 HD21 ' D' ' 38' ' ' LEU . 13.2 tp -47.68 -42.98 26.09 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 115.493 -2.194 . . . . 0.0 110.352 177.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 60.1 tp -71.27 -50.96 27.34 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 127.765 2.426 . . . . 0.0 108.8 -174.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 ttpt -56.35 -35.21 67.38 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.072 -2.268 . . . . 0.0 114.249 170.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -68.52 -40.46 80.77 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 116.962 -1.895 . . . . 0.0 110.597 173.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.76 -15.32 62.17 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 127.219 2.208 . . . . 0.0 113.578 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . 0.298 18.3 m-30 -75.26 -26.2 58.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 118.034 -2.916 . . . . 0.0 111.007 161.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -83.91 -23.95 30.97 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 124.288 3.222 . . . . 0.0 114.788 -168.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.4 p30 -103.28 4.74 36.89 Favored 'General case' 0 N--CA 1.451 -0.397 1 N-CA-C 121.863 4.024 . . . . 0.0 121.863 153.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.261 39.9 m-20 68.11 26.56 7.14 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.593 1.957 . . . . 0.0 113.762 170.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 91.1 mt -93.94 5.67 50.92 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 128.12 2.568 . . . . 0.0 113.294 175.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -52.79 59.83 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.531 2.332 . . . . 0.0 114.063 176.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.7 -45.91 66.79 Favored Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-O 115.808 -2.044 . . . . 0.0 108.758 -168.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.251 26.5 Cg_endo -64.4 -28.57 62.76 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 CA-C-N 122.428 1.903 . . . . 0.0 113.211 176.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . 0.482 HD21 HD23 ' D' ' 25' ' ' LEU . 44.4 tp -68.2 -50.17 55.96 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 -179.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 95.4 mt -58.28 -38.37 76.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.542 1.537 . . . . 0.0 114.128 166.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . 0.395 6.1 m-20 -68.01 -29.64 68.7 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 117.503 -1.237 . . . . 0.0 111.04 177.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 17.1 tp -75.29 -35.41 61.31 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 123.247 1.499 . . . . 0.0 113.439 172.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 7.4 mmm -87.24 -19.97 27.57 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 116.154 -2.218 . . . . 0.0 114.359 -176.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 93.8 mt -125.78 126.4 44.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.534 -2.604 . . . . 0.0 107.968 -172.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . 0.464 ' CG2' HG23 ' C' ' 81' ' ' THR . 61.8 p -62.67 157.97 54.34 Favored Pre-proline 0 N--CA 1.449 -0.524 0 CA-C-O 114.152 -2.832 . . . . 0.0 117.646 174.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -59.69 -37.42 87.67 Favored 'Trans proline' 0 N--CA 1.452 -0.921 0 CA-C-N 125.429 2.975 . . . . 0.0 117.221 -173.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -63.68 -31.81 73.1 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 120.44 -1.413 . . . . 0.0 113.327 169.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -73.15 -30.13 63.37 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 120.351 -1.468 . . . . 0.0 110.958 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . 0.507 ' HD2' ' CE2' ' C' ' 19' ' ' TRP . 77.9 mtm-85 -76.59 -41.17 47.2 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.933 2.093 . . . . 0.0 111.898 176.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -54.96 -60.44 3.37 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 125.379 1.472 . . . . 0.0 111.933 166.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.15 -43.23 66.85 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 117.271 2.323 . . . . 0.0 117.271 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 73.3 mt -64.58 -53.92 40.22 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 126.163 2.165 . . . . 0.0 114.08 173.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -37.89 -36.93 0.36 Allowed Glycine 0 C--N 1.336 0.534 0 CA-C-N 120.224 1.374 . . . . 0.0 116.315 159.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 87.3 m -77.84 -35.94 50.55 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.017 2.127 . . . . 0.0 110.633 -176.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . 0.43 ' HB3' HD11 ' D' ' 82' ' ' ILE . 22.7 mtt180 -71.87 -20.94 61.73 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 114.199 -2.81 . . . . 0.0 110.445 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 85.8 t -55.79 -46.63 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 116.285 1.957 . . . . 0.0 116.285 166.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -84.81 -26.52 27.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 126.689 2.493 . . . . 0.0 110.22 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 15.4 mt -70.31 -36.72 68.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 O-C-N 118.759 -2.463 . . . . 0.0 108.737 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . 0.483 ' CG2' HD12 ' D' ' 82' ' ' ILE . 94.9 t -67.93 -32.62 57.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 N-CA-C 118.097 2.629 . . . . 0.0 118.097 170.276 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -70.82 -45.22 64.96 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.407 -1.724 . . . . 0.0 111.667 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.18 -32.7 74.38 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.428 1.491 . . . . 0.0 110.045 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 19.7 mt -71.88 -17.09 62.14 Favored 'General case' 0 N--CA 1.447 -0.579 1 O-C-N 115.027 -4.796 . . . . 0.0 114.676 172.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -91.21 -32.11 15.91 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 124.249 1.976 . . . . 0.0 113.025 165.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . 0.576 ' HG2' ' HG3' ' D' ' 65' ' ' GLU . 20.6 ttm180 -61.78 -52.79 62.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.733 -1.854 . . . . 0.0 113.029 170.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.63 26.23 69.61 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-O 115.362 -2.91 . . . . 0.0 118.792 174.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . 0.576 ' HG3' ' HG2' ' D' ' 63' ' ' ARG . 81.4 mt-10 -99.75 -45.59 5.69 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 100.808 -3.775 . . . . 0.0 100.808 -166.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 5.1 mtm -88.88 56.57 3.78 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 23.7 p -90.36 -171.77 3.21 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 123.428 1.585 . . . . 0.0 113.629 -168.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.376 7.2 tp60 61.25 -82.64 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 121.3 3.815 . . . . 0.0 121.3 170.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 25.7 ttt85 -93.84 -31.96 14.14 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 126.247 2.217 . . . . 0.0 112.53 175.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -76.49 -44.22 36.27 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 118.959 2.948 . . . . 0.0 118.959 -165.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.54 -44.42 69.2 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 172.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . 0.285 27.1 mtmt -72.96 -19.2 61.28 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 114.988 -2.434 . . . . 0.0 109.674 -177.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -123.9 -11.31 7.66 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 125.872 1.983 . . . . 0.0 111.812 -168.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 34.2 tp10 -103.85 -47.6 4.16 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 128.642 2.777 . . . . 0.0 109.816 176.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.21 -45.06 11.0 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 128.316 3.51 . . . . 0.0 105.448 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 76.73 -135.0 16.1 Favored Glycine 0 N--CA 1.444 -0.822 0 O-C-N 117.784 -3.072 . . . . 0.0 118.035 172.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.298 . . -78.28 36.83 0.25 Allowed 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 118.683 2.846 . . . . 0.0 118.683 -154.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.41 -15.64 2.7 Favored Glycine 0 N--CA 1.447 -0.594 1 C-N-CA 130.861 4.077 . . . . 0.0 113.626 168.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 3.9 tt -68.21 -15.45 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-O 114.091 -2.862 . . . . 0.0 116.217 -172.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -95.75 -27.32 15.31 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 127.183 2.802 . . . . 0.0 109.853 178.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.3 m -52.46 -39.98 61.74 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 124.289 3.222 . . . . 0.0 111.65 159.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . 0.483 HD12 ' CG2' ' D' ' 58' ' ' VAL 0.259 34.2 mm -71.28 -45.03 72.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 C-N-CA 125.447 1.499 . . . . 0.0 112.237 -176.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 19.5 p -86.4 -24.02 25.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 115.465 -2.207 . . . . 0.0 114.606 174.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -90.95 168.23 11.83 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 126.479 3.038 . . . . 0.0 106.099 177.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 103.11 147.33 18.52 Favored Glycine 0 N--CA 1.447 -0.585 0 CA-C-O 125.102 2.501 . . . . 0.0 107.527 172.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 5.9 m -68.15 -27.99 66.91 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 118.155 -2.968 . . . . 0.0 114.742 -154.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 -128.42 33.99 4.61 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 122.786 1.279 . . . . 0.0 110.956 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 90.7 p -73.72 -177.84 2.92 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 118.16 -2.837 . . . . 0.0 111.686 170.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.6 tt -69.89 -23.88 63.32 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 117.364 -3.335 . . . . 0.0 112.725 -164.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -60.56 -17.46 46.29 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 128.802 2.841 . . . . 0.0 111.265 167.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.09 -35.62 10.75 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.062 -1.923 . . . . 0.0 110.311 175.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 56.96 80.54 0.28 Allowed Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 119.909 3.3 . . . . 0.0 119.909 -175.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . 0.559 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.413 67.2 Cg_exo 32.66 27.82 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.114 0 O-C-N 123.223 1.118 . . . . 0.0 114.399 46.197 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 47.9 t -51.17 -8.31 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 117.608 2.448 . . . . 0.0 117.608 174.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . 0.559 ' OE2' ' HA ' ' D' ' 93' ' ' PRO . 0.0 OUTLIER -117.72 -21.85 8.29 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 113.262 -1.79 . . . . 0.0 110.506 -173.195 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 40.3 tp -63.77 -53.79 45.47 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.761 -2.066 . . . . 0.0 109.657 151.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -46.1 -60.86 2.03 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 120.523 3.527 . . . . 0.0 120.523 171.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -60.41 -18.17 48.97 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 127.358 2.263 . . . . 0.0 115.03 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 59.1 t90 -88.3 -42.43 12.24 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 170.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 42.0 mt -51.62 -46.36 63.61 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 170.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -60.88 -35.08 75.71 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.797 2.839 . . . . 0.0 109.96 -170.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -87.61 9.31 21.69 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 127.194 2.197 . . . . 0.0 116.544 177.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . 0.438 HG11 ' CD1' ' C' ' 25' ' ' LEU . 88.6 t -125.24 -35.06 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 112.338 -2.21 . . . . 0.0 111.243 177.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 82.5 mt -97.7 -23.05 16.11 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.264 1.826 . . . . 0.0 114.376 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 60.0 mt -117.23 12.78 14.49 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 125.32 1.638 . . . . 0.0 107.021 -174.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -70.33 161.8 29.73 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 120.027 -1.67 . . . . 0.0 110.912 -174.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -62.67 -32.3 73.34 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 126.122 1.769 . . . . 0.0 111.928 -177.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 C--O 1.251 1.152 0 C-N-CA 127.823 2.449 . . . . 0.0 109.938 170.306 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.473 0.725 0 CA-C-O 118.425 -0.797 . . . . 0.0 109.843 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.46 -12.47 60.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.933 2.093 . . . . 0.0 113.848 -171.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -77.26 -29.93 54.17 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.429 -1.419 . . . . 0.0 111.183 162.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -83.84 -26.63 29.35 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 117.421 -1.712 . . . . 0.0 107.258 -171.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 53.6 p -84.36 151.17 58.95 Favored Pre-proline 0 N--CA 1.449 -0.508 0 O-C-N 119.908 -1.745 . . . . 0.0 112.588 -171.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . 0.304 77.0 Cg_exo -35.96 -52.16 1.02 Allowed 'Trans proline' 0 N--CA 1.448 -1.171 0 O-C-N 126.354 2.765 . . . . 0.0 115.691 -176.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -115.06 171.34 7.73 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 129.455 3.102 . . . . 0.0 111.803 174.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.5 t -130.01 108.38 10.05 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 128.951 2.9 . . . . 0.0 108.876 165.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.62 -19.83 61.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 126.091 2.12 . . . . 0.0 111.615 172.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.59 -33.43 69.03 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 131.409 3.883 . . . . 0.0 116.947 167.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 53.9 ttp -82.56 -23.25 34.56 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 120.524 -1.36 . . . . 0.0 110.453 169.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -38.2 90.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 126.786 2.554 . . . . 0.0 113.754 172.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -59.59 -48.42 81.73 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 115.127 -2.368 . . . . 0.0 109.112 170.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -67.48 -42.4 83.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 126.407 2.317 . . . . 0.0 110.981 -169.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 86.8 mmt-85 -66.01 -25.38 67.05 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 126.54 2.4 . . . . 0.0 114.504 175.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -82.1 -30.04 31.44 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.574 -0.704 . . . . 0.0 110.762 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -73.43 -27.97 61.72 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.813 -3.054 . . . . 0.0 112.039 169.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -63.18 -35.0 78.86 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 116.556 -3.84 . . . . 0.0 115.334 170.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -62.07 -53.61 53.1 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 128.151 3.834 . . . . 0.0 115.863 168.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.1 mt -67.59 -26.53 66.32 Favored 'General case' 0 N--CA 1.447 -0.609 1 O-C-N 112.933 -6.104 . . . . 0.0 116.977 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.445 HH12 ' CD ' ' B' ' 59' ' ' GLU . 67.0 ttt180 -49.33 -43.26 43.56 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 116.35 -1.786 . . . . 0.0 110.342 162.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -75.01 -23.21 58.18 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 114.954 -2.45 . . . . 0.0 115.764 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 4.3 t -81.65 -14.71 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 119.987 1.267 . . . . 0.0 113.177 171.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 82.8 m-20 -88.88 -45.97 9.29 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 117.863 -3.023 . . . . 0.0 116.258 161.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.3 tp -54.18 -42.19 69.38 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 118.264 -2.772 . . . . 0.0 111.239 170.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . 0.262 29.9 tp -67.12 -38.8 86.22 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 124.829 1.252 . . . . 0.0 114.092 175.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -67.47 -48.61 66.69 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 116.932 -1.508 . . . . 0.0 109.957 174.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.7 m-20 -59.06 -20.52 54.03 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 119.422 1.01 . . . . 0.0 113.586 174.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.29 -36.95 29.21 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -63.79 -44.58 92.94 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 119.314 -2.116 . . . . 0.0 112.538 168.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.77 -29.51 70.18 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 116.327 -1.797 . . . . 0.0 112.581 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -95.97 9.41 40.79 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.386 7.8 m-20 54.98 21.94 4.05 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 118.143 2.646 . . . . 0.0 118.143 -168.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.8 mt -89.47 9.15 27.53 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.27 -2.769 . . . . 0.0 107.143 172.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -55.63 -51.8 65.97 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.989 2.177 . . . . 0.0 113.587 -171.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.52 -53.36 52.47 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-O 115.84 -2.029 . . . . 0.0 114.221 177.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_exo -35.0 -53.02 0.69 Allowed 'Trans proline' 0 N--CA 1.448 -1.162 0 C-N-CA 122.563 2.175 . . . . 0.0 113.563 162.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 55.6 tp -74.87 -32.42 61.88 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.575 -3.203 . . . . 0.0 115.573 -171.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -63.43 -44.95 93.09 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 130.335 3.454 . . . . 0.0 114.782 171.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -60.76 -34.92 75.18 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 127.063 2.145 . . . . 0.0 108.995 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.0 tp -74.56 -42.87 58.03 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 120.517 3.525 . . . . 0.0 120.517 170.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 95.9 mmm -78.73 -21.5 47.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 114.745 -2.55 . . . . 0.0 116.857 177.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.4 mp -132.93 141.13 48.19 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.126 1.77 . . . . 0.0 108.041 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.3 p -80.39 153.76 74.03 Favored Pre-proline 0 N--CA 1.446 -0.628 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 174.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -55.68 -17.16 16.83 Favored 'Trans proline' 0 N--CA 1.452 -0.94 1 C-N-CA 125.594 4.196 . . . . 0.0 116.233 -173.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -76.88 -45.18 29.17 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 167.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . 0.279 42.1 mt-10 -74.7 -31.37 61.85 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 123.509 1.623 . . . . 0.0 109.997 -175.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -67.12 -54.41 21.64 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 119.361 -2.087 . . . . 0.0 115.374 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -47.75 -44.58 28.2 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.274 1.83 . . . . 0.0 112.738 163.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.81 -38.12 89.93 Favored 'General case' 0 N--CA 1.448 -0.561 1 O-C-N 114.787 -4.946 . . . . 0.0 114.962 174.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.3 mt -62.77 -37.29 86.05 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 116.402 -1.761 . . . . 0.0 113.366 165.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.51 -36.83 48.27 Favored Glycine 0 C--N 1.339 0.709 0 N-CA-C 119.999 2.76 . . . . 0.0 119.999 159.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.1 m -74.38 -40.62 61.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 120.996 2.398 . . . . 0.0 110.901 173.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . 0.267 97.6 mtt180 -53.16 -36.11 60.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 67.3 t -63.18 -38.94 83.43 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 167.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 34.6 mtp180 -74.71 -25.74 59.35 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 114.726 -2.559 . . . . 0.0 110.759 175.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.251 63.2 mt -68.84 -51.09 48.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 115.514 -2.184 . . . . 0.0 108.857 167.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 53.9 t -62.38 -31.26 51.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-O 115.041 -2.409 . . . . 0.0 115.036 177.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -59.34 -55.46 34.44 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 127.454 2.971 . . . . 0.0 108.274 169.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -73.26 -14.86 61.41 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 122.658 2.481 . . . . 0.0 115.85 -178.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 50.9 mt -84.25 -27.38 27.95 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.318 1.847 . . . . 0.0 113.148 173.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.5 mt -82.51 -18.37 41.78 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 117.934 -2.979 . . . . 0.0 118.336 165.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.6 ttm105 -82.22 -53.48 6.03 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 170.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.3 37.29 90.66 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 129.589 3.471 . . . . 0.0 107.727 170.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -86.32 -49.76 7.43 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 120.199 -1.765 . . . . 0.0 109.684 170.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 44.2 mtt -63.58 135.1 56.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 123.65 1.691 . . . . 0.0 109.527 165.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.2 p -99.37 -174.87 2.84 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 110.042 -3.254 . . . . 0.0 111.738 161.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -75.93 -33.49 59.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 117.359 -3.338 . . . . 0.0 109.132 -170.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.0 tpt85 -58.87 -26.97 64.74 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 131.067 3.747 . . . . 0.0 114.021 172.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -87.49 -42.93 12.42 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 120.283 -1.511 . . . . 0.0 111.971 173.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.31 -23.98 67.66 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -174.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.8 tptp -66.2 -40.1 90.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 113.958 -1.474 . . . . 0.0 110.864 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -83.64 -34.48 25.03 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 124.578 2.132 . . . . 0.0 112.456 179.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -85.25 -55.62 3.94 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.355 -2.716 . . . . 0.0 108.099 -170.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.0 mt -112.17 6.05 18.84 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 128.504 2.722 . . . . 0.0 114.343 -165.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.82 10.95 73.15 Favored Glycine 0 CA--C 1.526 0.728 0 CA-C-O 115.624 -2.765 . . . . 0.0 110.417 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.32 119.63 27.78 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 122.116 2.958 . . . . 0.0 118.312 -174.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.91 162.23 9.55 Favored Glycine 0 C--N 1.342 0.892 0 O-C-N 126.658 2.474 . . . . 0.0 118.396 159.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 52.1 mt -59.34 -45.84 92.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 C-N-CA 131.535 3.934 . . . . 0.0 111.791 -172.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.33 -39.2 63.0 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -178.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.6 p -63.77 -41.35 97.99 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 114.785 -2.531 . . . . 0.0 117.364 169.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 31.0 mm -62.05 -37.34 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 125.931 3.968 . . . . 0.0 112.795 163.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . 0.369 54.3 m -64.67 -49.62 70.26 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.189 -2.194 . . . . 0.0 113.386 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -62.58 -53.47 54.23 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.248 -2.158 . . . . 0.0 107.653 173.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -41.75 -38.57 2.36 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 126.368 1.937 . . . . 0.0 115.609 175.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.4 m -77.03 -36.12 56.42 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 117.863 0.832 . . . . 0.0 110.274 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 34.9 m120 -68.44 -35.52 77.72 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 121.597 -0.69 . . . . 0.0 112.718 170.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 7.8 m -62.68 -38.26 89.64 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 173.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . 0.259 35.7 tp -68.28 -31.16 70.42 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.986 2.114 . . . . 0.0 113.926 174.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -84.35 -33.61 23.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 119.75 1.159 . . . . 0.0 112.434 171.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . 0.261 . . -71.48 -18.4 62.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 117.485 2.402 . . . . 0.0 117.485 166.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.56 136.76 92.47 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 158.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.5 153.03 79.29 Favored 'Trans proline' 0 N--CA 1.446 -1.288 0 CA-C-O 126.836 2.765 . . . . 0.0 113.831 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.5 m -61.8 -26.17 39.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-O 115.344 -2.265 . . . . 0.0 111.461 -169.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.266 22.9 pm0 -69.47 -32.45 71.37 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 123.414 2.824 . . . . 0.0 110.108 175.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 4.6 tp -76.13 -38.24 57.06 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 124.288 3.222 . . . . 0.0 113.162 173.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 56.1 mtm-85 -56.7 -37.06 70.39 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.57 1.948 . . . . 0.0 115.126 161.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -72.41 -31.19 65.32 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 121.748 2.067 . . . . 0.0 112.304 170.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -72.59 -50.07 27.92 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 115.586 -2.15 . . . . 0.0 116.24 172.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 32.1 mt -74.27 -21.25 59.84 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 122.326 2.33 . . . . 0.0 110.912 -170.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -77.96 -15.39 59.02 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 126.691 1.996 . . . . 0.0 112.695 176.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -92.89 -33.27 14.28 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 121.854 2.116 . . . . 0.0 110.542 166.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . 0.411 47.0 t -84.16 -26.06 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-O 115.289 -2.291 . . . . 0.0 116.546 -168.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.7 mt -107.56 -3.99 18.8 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 123.692 1.71 . . . . 0.0 113.537 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 75.4 mt -133.45 8.64 3.95 Favored 'General case' 0 N--CA 1.447 -0.584 1 O-C-N 113.324 -5.86 . . . . 0.0 111.478 -156.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.6 mtpt -116.63 14.08 15.36 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 122.257 2.298 . . . . 0.0 115.668 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 67.1 m -110.24 -26.86 9.39 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 119.683 -1.886 . . . . 0.0 114.068 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 . . . . . 0 C--O 1.252 1.227 0 N-CA-C 121.721 3.971 . . . . 0.0 121.721 -165.876 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 47.3 ttp . . . . . 0 N--CA 1.474 0.759 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -52.83 -10.47 0.17 Allowed 'General case' 0 N--CA 1.45 -0.449 1 N-CA-C 122.763 4.357 . . . . 0.0 122.763 -177.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -106.86 -20.05 13.45 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 170.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -85.09 -37.99 19.64 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 116.527 -1.701 . . . . 0.0 109.272 174.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 29.4 m -78.36 140.13 60.34 Favored Pre-proline 0 N--CA 1.448 -0.535 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 177.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -63.12 -20.86 72.12 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 122.667 2.245 . . . . 0.0 114.094 178.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -131.73 130.81 42.42 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 120.906 1.685 . . . . 0.0 115.045 171.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.2 t -133.69 130.88 38.8 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 127.877 3.703 . . . . 0.0 107.386 166.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -86.71 -27.78 23.5 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 119.209 -2.182 . . . . 0.0 115.325 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.76 -34.51 73.07 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 122.651 1.215 . . . . 0.0 108.713 168.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . 0.295 42.6 mtt -65.13 -51.22 62.52 Favored 'General case' 0 N--CA 1.444 -0.751 0 O-C-N 121.523 -0.735 . . . . 0.0 111.226 176.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.59 -40.94 69.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.392 1.077 . . . . 0.0 113.834 177.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -70.74 -32.4 69.56 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 126.912 2.085 . . . . 0.0 110.68 177.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -73.93 -41.18 62.43 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 118.396 -2.69 . . . . 0.0 109.488 178.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -65.55 -42.51 91.78 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 169.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -63.8 -36.7 84.77 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 167.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -63.36 -40.74 98.09 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 117.307 -1.757 . . . . 0.0 113.476 170.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 85.2 mt-10 -53.17 -49.2 67.14 Favored 'General case' 0 N--CA 1.452 -0.36 1 O-C-N 115.79 -4.319 . . . . 0.0 111.617 172.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -52.64 -49.08 65.87 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 127.677 2.391 . . . . 0.0 110.631 171.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 79.4 mt -69.42 -30.32 68.23 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 116.175 -4.078 . . . . 0.0 109.677 -178.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -63.07 -26.43 68.83 Favored 'General case' 0 N--CA 1.453 -0.319 1 CA-C-N 126.057 4.026 . . . . 0.0 113.427 171.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -76.09 -46.12 30.56 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.186 1.794 . . . . 0.0 111.958 174.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 18.7 t -64.91 -37.81 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 119.941 -1.725 . . . . 0.0 106.417 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -64.36 -50.24 68.49 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.504 -1.998 . . . . 0.0 108.635 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 39.0 tp -60.67 -39.3 87.91 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 120.073 -1.642 . . . . 0.0 111.627 -174.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 23.8 tp -75.97 -35.94 59.45 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 119.449 -2.032 . . . . 0.0 112.375 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -48.36 -39.72 23.14 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 124.465 2.078 . . . . 0.0 112.988 168.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -89.06 -23.48 22.53 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 118.93 -2.357 . . . . 0.0 109.987 -176.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.55 -26.61 66.39 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-O 116.092 -1.909 . . . . 0.0 109.213 174.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -76.38 -30.32 57.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 127.15 2.18 . . . . 0.0 112.509 175.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -70.71 -26.25 63.32 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 118.568 2.803 . . . . 0.0 118.568 165.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -105.76 -4.86 20.4 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 124.678 2.18 . . . . 0.0 110.897 -175.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.278 7.4 m-20 57.21 42.34 25.55 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 116.522 -3.861 . . . . 0.0 111.797 -175.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 22.9 mt -120.31 13.46 11.93 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.842 2.457 . . . . 0.0 112.619 174.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -65.07 -39.91 93.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 112.78 -3.486 . . . . 0.0 114.375 174.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 11.3 mt -55.04 -48.28 96.43 Favored Pre-proline 0 N--CA 1.452 -0.346 0 CA-C-N 121.899 2.136 . . . . 0.0 112.857 -179.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.302 58.4 Cg_endo -66.77 -40.76 12.08 Favored 'Trans proline' 0 N--CA 1.445 -1.352 0 O-C-N 117.581 -1.852 . . . . 0.0 114.787 172.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' B' ' 38' ' ' LEU . 24.0 tp -52.66 -40.71 63.12 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 125.581 1.801 . . . . 0.0 109.722 174.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 68.8 mt -80.65 -36.64 32.23 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.133 -2.854 . . . . 0.0 110.335 -171.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -60.88 -42.0 97.1 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 173.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 46.4 tp -67.41 -45.11 77.11 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 124.866 1.266 . . . . 0.0 111.095 -175.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 14.9 mmt -75.1 -34.4 61.72 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.778 2.031 . . . . 0.0 115.415 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 33.7 mt -128.1 122.69 32.67 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 125.235 1.414 . . . . 0.0 109.218 -170.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 35.7 p -75.32 162.6 72.23 Favored Pre-proline 0 N--CA 1.448 -0.559 0 C-N-CA 126.331 1.852 . . . . 0.0 114.978 179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . 0.274 9.7 Cg_endo -67.8 -21.28 44.78 Favored 'Trans proline' 0 N--CA 1.446 -1.31 0 CA-C-N 125.136 2.87 . . . . 0.0 116.244 -164.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.61 -37.63 73.88 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.552 1.941 . . . . 0.0 111.543 169.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -72.62 -35.24 67.78 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 173.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 45.9 mtm-85 -66.61 -37.3 84.58 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 116.209 -1.853 . . . . 0.0 112.715 169.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.46 -46.75 87.87 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 126.3 2.25 . . . . 0.0 115.662 165.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.2 -30.11 66.0 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 116.734 -1.603 . . . . 0.0 109.307 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 17.7 mt -75.42 -28.43 59.4 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 121.238 1.836 . . . . 0.0 113.989 174.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.41 -41.47 77.47 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 125.504 1.526 . . . . 0.0 111.971 172.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 27.2 m -76.44 -37.65 56.69 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 118.011 -0.995 . . . . 0.0 112.119 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -58.92 -31.14 68.39 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 124.874 1.359 . . . . 0.0 108.797 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 91.9 t -59.16 -49.22 84.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 O-C-N 116.895 -3.628 . . . . 0.0 115.279 167.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -56.51 -32.92 65.53 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 116.94 -3.6 . . . . 0.0 109.432 176.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 62.9 mt -72.04 -44.59 65.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-O 115.912 -1.994 . . . . 0.0 114.746 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 54.7 t -66.88 -41.69 87.99 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 119.638 1.108 . . . . 0.0 110.439 176.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . 0.445 ' CD ' HH12 ' A' ' 21' ' ' ARG . 36.5 tt0 -52.47 -41.07 63.02 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 169.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -82.78 -25.19 33.0 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 117.579 2.437 . . . . 0.0 117.579 173.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.446 HD23 ' HA ' ' B' ' 61' ' ' LEU . 14.0 mt -48.79 -44.74 39.31 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 120.332 1.424 . . . . 0.0 113.657 154.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 44.3 mt -85.73 -2.61 58.39 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 115.158 -2.353 . . . . 0.0 114.426 -178.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 ttm105 -93.34 -71.7 0.64 Allowed 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 125.634 1.834 . . . . 0.0 114.701 176.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.16 55.75 1.92 Allowed Glycine 0 CA--C 1.525 0.702 0 CA-C-N 114.3 -1.318 . . . . 0.0 113.338 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -137.83 -8.3 1.62 Allowed 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 127.656 2.382 . . . . 0.0 115.441 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 40.4 mtt -89.82 133.37 34.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 167.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -62.27 160.41 13.18 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 127.883 2.473 . . . . 0.0 116.287 156.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -50.52 -43.29 55.87 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.576 -1.202 . . . . 0.0 111.237 172.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -58.88 -45.4 90.31 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 126.885 2.616 . . . . 0.0 114.281 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -67.12 -46.22 74.79 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 129.092 2.957 . . . . 0.0 109.998 -178.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' B' ' 71' ' ' LEU . 34.3 mt -48.77 -56.11 9.58 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.927 1.691 . . . . 0.0 109.014 171.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 34.7 tptt -66.9 -31.74 72.53 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 115.477 1.658 . . . . 0.0 115.477 -174.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -126.21 0.73 7.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 120.919 1.69 . . . . 0.0 112.914 -167.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -124.1 -6.4 7.79 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.77 1.228 . . . . 0.0 114.143 171.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 33.1 mt -127.88 -10.98 5.46 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 129.395 3.078 . . . . 0.0 117.051 165.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 79.45 11.87 84.4 Favored Glycine 0 CA--C 1.524 0.63 0 C-N-CA 126.453 1.978 . . . . 0.0 117.383 178.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.92 114.32 28.32 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 129.956 3.302 . . . . 0.0 115.038 -164.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.54 171.56 36.57 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 127.205 2.336 . . . . 0.0 111.736 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 mt -48.98 -47.2 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 131.603 3.961 . . . . 0.0 111.856 172.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.1 -55.77 16.86 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.997 -2.314 . . . . 0.0 114.211 176.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 27.2 m -46.18 -45.44 16.79 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 118.178 2.658 . . . . 0.0 118.178 165.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 18.4 mm -67.34 -45.42 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 O-C-N 116.909 -3.62 . . . . 0.0 113.896 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 5.7 m -47.75 -40.27 20.14 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 169.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -74.39 -37.74 63.33 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.853 2.461 . . . . 0.0 113.703 -176.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -72.73 -37.31 57.57 Favored Glycine 0 N--CA 1.447 -0.587 0 O-C-N 119.01 -2.306 . . . . 0.0 116.67 165.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 37.9 m -64.4 -42.06 96.32 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 119.097 -2.413 . . . . 0.0 113.834 176.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -61.8 -37.47 84.49 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 120.757 -1.214 . . . . 0.0 112.328 168.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 37.2 m -75.69 -30.2 59.27 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.913 0.863 . . . . 0.0 113.025 -175.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.83 -44.02 94.28 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 114.917 -2.468 . . . . 0.0 113.182 164.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 61.1 mttt -51.36 -45.62 62.46 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 127.109 2.755 . . . . 0.0 111.725 169.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.81 -30.55 65.64 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -176.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.76 155.06 92.39 Favored Pre-proline 0 N--CA 1.45 -0.44 0 C-N-CA 128.055 2.542 . . . . 0.0 113.221 -171.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . 0.271 23.9 Cg_exo -63.38 156.28 57.1 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 O-C-N 117.184 -2.061 . . . . 0.0 116.424 176.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -61.89 -40.83 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 O-C-N 118.41 -2.682 . . . . 0.0 113.791 170.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.325 23.0 pm0 -61.02 -26.07 67.35 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 114.08 -2.867 . . . . 0.0 114.984 170.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 28.3 tp -84.89 -44.58 13.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 122.311 2.323 . . . . 0.0 105.597 178.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 23.2 mtm-85 -64.5 -27.13 68.76 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 116.347 -3.971 . . . . 0.0 116.696 -177.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -75.2 -33.31 61.4 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.24 0.543 . . . . 0.0 111.657 178.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -69.74 -52.56 24.29 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.976 2.11 . . . . 0.0 105.886 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 87.3 mt -65.07 -43.68 91.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 123.697 0.799 . . . . 0.0 112.043 -172.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -59.86 -36.29 76.56 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.838 0.455 . . . . 0.0 110.245 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -68.83 -46.22 69.11 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 116.226 1.936 . . . . 0.0 116.226 171.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 34.7 t -71.16 -57.57 7.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 113.905 -2.95 . . . . 0.0 112.362 174.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.84 -18.81 63.46 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 126.544 2.402 . . . . 0.0 113.616 -163.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 31.4 mt -97.09 -36.27 10.54 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 116.941 -3.599 . . . . 0.0 109.236 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 69.7 mttt -88.3 19.79 3.59 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 116.37 -3.956 . . . . 0.0 109.508 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . 0.363 69.0 m -87.94 -25.62 23.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 131.289 3.836 . . . . 0.0 114.26 160.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 . . . . . 0 C--O 1.25 1.088 0 O-C-N 116.511 -3.868 . . . . 0.0 112.132 166.991 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ttt . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 118.036 -0.983 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.12 128.22 33.01 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 126.006 2.066 . . . . 0.0 110.668 -176.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -122.76 135.73 54.65 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 126.392 2.307 . . . . 0.0 113.277 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -120.58 156.38 31.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.078 0.951 . . . . 0.0 111.466 178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -129.85 165.68 31.63 Favored Pre-proline 0 N--CA 1.45 -0.438 1 C-N-CA 132.367 4.267 . . . . 0.0 113.214 169.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -81.6 -20.57 6.73 Favored 'Trans proline' 0 N--CA 1.449 -1.107 0 N-CA-C 116.175 1.567 . . . . 0.0 116.175 -179.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -138.96 160.61 39.36 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.891 1.994 . . . . 0.0 108.951 170.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 28.0 t -151.58 124.45 8.58 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 129.46 3.104 . . . . 0.0 110.405 176.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.68 -26.5 61.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 124.183 1.944 . . . . 0.0 113.188 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.87 -37.42 14.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 117.424 -3.298 . . . . 0.0 117.036 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 64.3 mtt -61.2 -33.85 74.14 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 126.27 2.232 . . . . 0.0 111.167 163.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.9 -42.65 99.86 Favored 'General case' 0 N--CA 1.446 -0.664 1 O-C-N 115.61 -4.431 . . . . 0.0 115.279 168.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -75.23 -25.73 58.36 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 120.283 -1.511 . . . . 0.0 113.945 175.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -62.03 -37.17 83.92 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 120.765 -1.209 . . . . 0.0 109.48 160.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -36.6 84.64 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 119.732 -1.855 . . . . 0.0 112.92 174.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -68.61 -33.31 73.83 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 124.302 2.001 . . . . 0.0 116.327 174.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -77.35 -24.12 50.77 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 129.918 3.287 . . . . 0.0 117.038 173.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -70.52 -36.56 73.81 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 125.092 2.377 . . . . 0.0 112.611 161.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 9.4 t-105 -63.45 -58.3 7.48 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 118.555 -2.59 . . . . 0.0 112.628 167.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 20.9 mt -56.63 -29.21 61.96 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 124.573 3.351 . . . . 0.0 109.772 -176.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -82.94 -23.92 33.26 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 122.007 2.185 . . . . 0.0 113.238 -177.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -62.6 -40.31 96.52 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 114.482 -2.675 . . . . 0.0 110.294 162.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.37 -49.94 67.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 116.002 -1.951 . . . . 0.0 110.202 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -60.52 -39.65 88.6 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 122.411 2.368 . . . . 0.0 115.902 176.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 63.7 tp -65.1 -41.63 94.78 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 127.291 2.236 . . . . 0.0 107.556 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 12.0 tp -74.1 -43.77 56.4 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 122.545 1.164 . . . . 0.0 111.682 -177.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -57.09 -28.93 63.07 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 164.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . 0.277 91.7 m-20 -79.02 -24.1 43.88 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 129.364 3.066 . . . . 0.0 113.812 176.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.24 -6.21 54.25 Favored 'General case' 0 N--CA 1.448 -0.555 1 O-C-N 115.607 -4.433 . . . . 0.0 112.018 176.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -76.09 -21.93 56.16 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.533 171.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -65.08 -23.92 67.3 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 120.287 -1.508 . . . . 0.0 111.342 177.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -138.43 7.73 2.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 119.817 -1.802 . . . . 0.0 113.107 -163.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 50.8 28.16 3.49 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.684 2.476 . . . . 0.0 117.684 -168.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 50.1 mt -88.86 19.12 4.25 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 118.873 0.76 . . . . 0.0 110.302 164.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -64.94 -46.33 82.04 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 119.243 -2.161 . . . . 0.0 115.43 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.333 71.6 mt -68.86 -41.93 22.01 Favored Pre-proline 0 N--CA 1.452 -0.358 0 C-N-CA 127.685 2.394 . . . . 0.0 113.936 169.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_exo -58.93 -48.83 13.0 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 C-N-CA 121.668 1.579 . . . . 0.0 115.569 170.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 66.3 tp -53.86 -45.56 71.02 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 118.132 -2.855 . . . . 0.0 115.05 167.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 20.5 mt -68.24 -26.42 65.68 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 118.938 -1.105 . . . . 0.0 112.986 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -77.85 -39.13 44.48 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 127.782 2.433 . . . . 0.0 108.159 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 38.7 tp -56.71 -48.03 78.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 125.217 2.437 . . . . 0.0 111.835 167.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 7.8 mmt -84.03 -15.48 47.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 112.194 -3.765 . . . . 0.0 113.721 -167.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mp -135.34 157.53 46.66 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 126.724 2.515 . . . . 0.0 114.662 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 34.7 p -76.44 151.78 83.28 Favored Pre-proline 0 N--CA 1.448 -0.555 0 CA-C-O 114.023 -2.894 . . . . 0.0 111.32 161.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -63.46 -27.23 70.45 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 CA-C-N 123.797 2.392 . . . . 0.0 112.177 179.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.05 -44.0 74.3 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 115.713 -2.089 . . . . 0.0 110.922 170.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -71.13 -28.57 64.39 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 116.465 -1.731 . . . . 0.0 110.754 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . 0.401 ' HD2' ' CZ2' ' D' ' 19' ' ' TRP . 88.1 mtm-85 -71.61 -46.49 59.02 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 121.722 2.056 . . . . 0.0 109.267 176.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.15 -30.71 71.81 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.851 -1.78 . . . . 0.0 114.237 174.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.31 -50.4 63.75 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 127.786 2.434 . . . . 0.0 110.095 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . 0.493 HD13 ' CE1' ' D' ' 22' ' ' PHE . 9.2 mt -65.81 -40.28 91.72 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 122.147 2.249 . . . . 0.0 108.676 -179.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.9 -38.57 94.29 Favored Glycine 0 C--N 1.337 0.605 0 O-C-N 117.186 -3.446 . . . . 0.0 115.706 171.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 20.8 m -66.65 -38.69 87.39 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 114.341 -2.742 . . . . 0.0 110.59 169.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -61.71 -29.91 70.42 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 121.109 1.777 . . . . 0.0 112.642 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 91.2 t -69.5 -43.07 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 123.113 2.688 . . . . 0.0 108.812 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 70.7 mtp180 -70.15 -28.8 65.63 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 113.144 -3.312 . . . . 0.0 113.065 174.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 9.4 mt -56.31 -57.61 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 124.852 3.478 . . . . 0.0 112.168 157.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 57.5 t -57.11 -40.48 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 CA-C-O 117.17 -1.395 . . . . 0.0 111.429 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -61.4 -45.82 92.72 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 126.719 2.008 . . . . 0.0 106.166 178.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -68.28 -32.96 73.5 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 120.309 1.413 . . . . 0.0 111.453 -176.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 22.4 mt -76.58 -22.89 53.64 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 124.564 1.146 . . . . 0.0 109.359 178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 80.7 mt -80.17 -44.18 20.28 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 117.509 -3.244 . . . . 0.0 113.713 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttm105 -57.0 -39.26 74.35 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.492 2.317 . . . . 0.0 115.664 170.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 57.77 26.83 58.26 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 126.81 2.148 . . . . 0.0 117.269 171.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -97.07 -7.37 32.96 Favored 'General case' 0 N--CA 1.449 -0.495 1 CA-C-O 111.474 -4.108 . . . . 0.0 108.569 170.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 50.6 mtt -69.55 147.68 50.45 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 125.864 3.938 . . . . 0.0 116.621 167.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 88.6 p -106.8 168.2 9.35 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.352 1.461 . . . . 0.0 107.706 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -46.53 -30.15 2.1 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 176.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 29.9 ttp-105 -59.01 -55.01 40.62 Favored 'General case' 0 N--CA 1.452 -0.332 0 O-C-N 126.22 2.2 . . . . 0.0 113.686 176.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . 0.319 1.7 mt-10 -70.27 -40.66 74.24 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 -174.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 22.5 mt -53.43 -35.63 60.65 Favored 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 119.073 -2.267 . . . . 0.0 112.469 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -91.32 -30.68 16.43 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.895 2.078 . . . . 0.0 112.747 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -97.83 -59.17 1.82 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 119.514 1.052 . . . . 0.0 111.22 -171.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -70.31 -42.18 72.32 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 116.559 -2.056 . . . . 0.0 113.804 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mp -90.0 -15.42 31.93 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 127.629 2.371 . . . . 0.0 112.427 -172.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 60.93 -105.47 0.86 Allowed Glycine 0 N--CA 1.448 -0.535 0 CA-C-O 116.711 -2.161 . . . . 0.0 116.753 168.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.24 -17.44 2.68 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 129.887 3.275 . . . . 0.0 112.839 -169.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.54 -13.82 71.62 Favored Glycine 0 N--CA 1.45 -0.399 0 O-C-N 118.177 -2.827 . . . . 0.0 114.236 172.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 3.9 tt -56.48 -39.86 64.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 CA-C-N 114.765 -0.718 . . . . 0.0 109.949 174.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -81.1 -12.77 59.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 126.916 3.246 . . . . 0.0 112.585 -170.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 11.0 m -69.69 -46.45 66.0 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 116.927 -3.608 . . . . 0.0 107.191 166.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 46.4 mm -66.96 -40.18 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 N-CA-C 116.781 2.141 . . . . 0.0 116.781 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 40.5 p -100.69 -17.77 16.83 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -167.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 60.4 mtp85 -103.62 161.51 13.84 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 114.819 -2.515 . . . . 0.0 115.288 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 85.33 158.51 30.0 Favored Glycine 0 CA--C 1.524 0.618 0 O-C-N 126.053 2.095 . . . . 0.0 117.838 -177.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 88.9 p -63.85 4.83 0.26 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 118.135 2.642 . . . . 0.0 118.135 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 71.4 m-80 -115.78 -5.25 12.09 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 116.685 2.106 . . . . 0.0 116.685 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 3.2 p -68.21 177.12 2.4 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 126.287 1.835 . . . . 0.0 113.233 -154.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 15.3 tp -58.05 -26.49 62.55 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 116.272 -1.823 . . . . 0.0 111.703 -167.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -106.14 7.63 31.75 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 113.933 -2.937 . . . . 0.0 111.73 176.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -111.91 -5.74 14.32 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 129.976 3.31 . . . . 0.0 113.353 167.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.79 151.09 89.78 Favored Pre-proline 0 N--CA 1.452 -0.334 0 C-N-CA 127.076 2.15 . . . . 0.0 115.449 171.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -55.69 139.02 82.82 Favored 'Trans proline' 0 N--CA 1.448 -1.193 0 CA-C-N 120.324 1.151 . . . . 0.0 112.238 174.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 99.0 t -72.22 -30.94 37.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 C-N-CA 124.714 1.206 . . . . 0.0 108.266 -166.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -60.75 -19.7 59.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 118.956 2.947 . . . . 0.0 118.956 161.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 43.8 tp -84.02 -47.25 11.15 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.322 -0.861 . . . . 0.0 109.53 168.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 76.8 mtp180 -56.85 -49.9 74.06 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 115.894 -2.003 . . . . 0.0 109.812 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -53.09 -50.61 64.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.026 1.73 . . . . 0.0 109.294 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 61.0 t90 -75.1 -33.21 61.6 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.817 1.247 . . . . 0.0 112.271 -165.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 82.3 mt -63.49 -26.07 68.55 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 116.635 -3.791 . . . . 0.0 114.657 166.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -72.97 -27.39 61.79 Favored 'General case' 0 N--CA 1.45 -0.436 1 O-C-N 114.549 -5.094 . . . . 0.0 108.041 169.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -80.3 -24.17 40.18 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . 0.317 99.5 t -97.95 -28.18 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 124.73 3.423 . . . . 0.0 116.382 177.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 18.6 mt -110.52 -29.05 8.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.268 1.827 . . . . 0.0 112.973 -172.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 71.3 mt -121.0 30.54 6.81 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -75.49 147.52 39.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 126.578 1.951 . . . . 0.0 113.168 162.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 14.7 m -101.39 53.22 0.83 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 129.219 3.008 . . . . 0.0 110.306 177.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 21.8 t70 . . . . . 0 C--O 1.252 1.198 0 O-C-N 118.164 -2.835 . . . . 0.0 113.293 -171.814 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 28.2 ttp . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.11 145.93 40.53 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.606 1.963 . . . . 0.0 116.237 -177.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -142.97 146.61 34.09 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.088 1.355 . . . . 0.0 112.39 176.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -151.48 155.77 39.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.244 1.417 . . . . 0.0 111.397 -178.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . 0.448 ' HB2' ' HD2' ' D' ' 6' ' ' PRO . 90.9 p -77.85 171.26 12.93 Favored Pre-proline 0 N--CA 1.45 -0.439 0 C-N-CA 126.028 1.731 . . . . 0.0 110.17 164.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . 0.448 ' HD2' ' HB2' ' D' ' 5' ' ' SER . 37.5 Cg_endo -79.92 -44.03 0.12 Allowed 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 124.652 3.568 . . . . 0.0 112.112 155.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -152.66 140.24 19.79 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 155.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 36.0 t -67.13 121.22 15.14 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 109.805 -3.361 . . . . 0.0 110.849 -173.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . 0.263 . . -56.97 -21.26 28.98 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 117.711 -1.138 . . . . 0.0 110.659 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.5 -29.18 17.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.889 2.476 . . . . 0.0 113.556 -172.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.3 21.7 mmt -64.95 -37.48 87.79 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.888 -0.577 . . . . 0.0 112.189 158.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.81 -35.14 80.15 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 117.147 2.277 . . . . 0.0 117.147 173.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -60.73 -58.25 9.25 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.957 -2.965 . . . . 0.0 108.233 159.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -47.3 -38.38 12.52 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 117.907 -2.995 . . . . 0.0 118.815 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.39 5.8 49.23 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 131.408 3.883 . . . . 0.0 115.074 -173.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -104.93 -22.62 13.11 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 117.046 -1.454 . . . . 0.0 107.949 146.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -77.29 -34.08 55.61 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 123.23 2.741 . . . . 0.0 112.294 -176.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -66.5 -15.3 63.27 Favored 'General case' 0 N--CA 1.444 -0.748 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 171.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . 0.401 ' CZ2' ' HD2' ' C' ' 48' ' ' ARG . 28.6 t-105 -82.96 -37.18 24.45 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 167.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.17 -15.34 62.93 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 114.501 -2.666 . . . . 0.0 111.095 170.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -65.15 -49.58 69.32 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 114.012 -2.899 . . . . 0.0 105.714 164.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . 0.493 ' CE1' HD13 ' C' ' 51' ' ' LEU . 74.4 t80 -70.05 -38.76 75.89 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 122.177 2.262 . . . . 0.0 111.207 -172.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 20.7 t -66.19 -34.84 72.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 C-N-CA 128.317 2.647 . . . . 0.0 111.032 171.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -75.31 -37.83 60.6 Favored 'General case' 0 N--CA 1.448 -0.539 1 O-C-N 115.302 -4.624 . . . . 0.0 115.46 167.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 tp -69.09 -33.07 72.94 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 24.8 tp -73.85 -46.07 47.24 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 121.426 -0.796 . . . . 0.0 110.066 -177.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -58.03 -46.05 85.94 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 126.222 1.809 . . . . 0.0 112.097 172.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 -52.35 -30.44 28.63 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 166.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 -29.24 30.87 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 124.436 1.094 . . . . 0.0 113.369 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 6.3 m-30 -50.54 -40.57 52.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 125.264 2.459 . . . . 0.0 111.246 167.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -75.44 -30.18 59.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 118.834 -2.416 . . . . 0.0 113.744 -158.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 53.3 p-10 -111.18 14.17 21.79 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 128.922 3.889 . . . . 0.0 118.448 168.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 52.89 54.82 9.88 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 177.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 14.9 mt -121.33 5.42 10.22 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 129.305 3.042 . . . . 0.0 110.749 171.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -61.89 2.26 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 116.428 -1.748 . . . . 0.0 112.071 174.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 4.2 mt -52.15 -45.74 93.8 Favored Pre-proline 0 N--CA 1.45 -0.445 0 CA-C-O 115.183 -2.342 . . . . 0.0 115.22 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.24 -20.55 14.39 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 114.714 -3.057 . . . . 0.0 114.159 172.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 12.0 tp -68.01 -35.73 78.78 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 124.126 3.148 . . . . 0.0 113.18 169.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 24.3 mt -71.05 -36.37 72.29 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 123.227 1.489 . . . . 0.0 107.15 -175.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 35.3 m-20 -78.58 -26.99 45.6 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.863 1.792 . . . . 0.0 112.688 -175.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -68.02 -48.45 65.65 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.143 166.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 65.1 mmm -65.47 -34.63 78.74 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 114.892 -2.48 . . . . 0.0 114.858 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -115.16 144.76 43.18 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 122.231 2.287 . . . . 0.0 116.798 -172.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 70.1 p -67.62 148.78 98.54 Favored Pre-proline 0 N--CA 1.452 -0.37 0 O-C-N 117.161 -3.462 . . . . 0.0 110.035 167.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -35.79 -54.15 0.81 Allowed 'Trans proline' 0 N--CA 1.451 -1.009 1 C-N-CA 127.072 5.181 . . . . 0.0 113.438 171.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -71.37 -9.63 58.47 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 116.681 2.104 . . . . 0.0 116.681 -178.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . 0.251 38.8 mt-10 -86.43 -41.63 14.28 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 120.398 -1.439 . . . . 0.0 112.321 163.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 -59.88 -36.5 77.05 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 125.216 2.436 . . . . 0.0 114.455 172.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 87.1 tt0 -74.43 -40.19 62.12 Favored 'General case' 0 N--CA 1.451 -0.412 1 C-N-CA 134.76 5.224 . . . . 0.0 108.404 -175.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.28 -41.4 63.65 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 116.605 -3.809 . . . . 0.0 112.736 171.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 50.8 mt -59.65 -44.87 93.38 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 119.833 -1.792 . . . . 0.0 107.904 178.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.22 -33.38 85.77 Favored Glycine 0 CA--C 1.523 0.576 0 C-N-CA 118.563 -1.78 . . . . 0.0 114.884 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 97.6 m -78.96 -24.03 44.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 119.577 -2.131 . . . . 0.0 111.156 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 27.0 mtt180 -75.26 -20.67 59.05 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 117.579 -1.649 . . . . 0.0 113.105 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 99.3 t -49.56 -61.02 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 114.731 -2.556 . . . . 0.0 115.763 159.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -65.27 -26.07 67.92 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 126.187 2.179 . . . . 0.0 113.515 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . 0.404 HG12 ' HB3' ' D' ' 75' ' ' LEU . 36.5 mt -67.51 -52.09 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 129.711 3.204 . . . . 0.0 107.831 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 55.0 t -54.49 -39.62 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 125.984 1.714 . . . . 0.0 115.618 165.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -58.1 -60.73 3.28 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 122.98 1.371 . . . . 0.0 114.005 176.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -57.24 -37.86 72.93 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 128.725 2.81 . . . . 0.0 110.525 176.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 7.2 mt -61.06 -41.34 96.44 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 115.857 -2.337 . . . . 0.0 114.262 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 31.5 mt -67.84 -40.62 83.68 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.521 2.328 . . . . 0.0 110.91 170.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 ttm180 -63.9 -42.6 97.39 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 115.214 1.561 . . . . 0.0 115.214 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 52.0 61.2 6.73 Favored Glycine 0 CA--C 1.521 0.443 0 O-C-N 116.841 -3.662 . . . . 0.0 116.019 -173.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -139.31 -37.63 0.5 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 121.005 2.402 . . . . 0.0 106.972 -174.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 49.1 mtt -93.08 52.68 1.84 Allowed 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 118.9 -2.375 . . . . 0.0 113.724 159.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 31.1 p -95.01 -174.85 3.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 121.405 3.854 . . . . 0.0 121.405 -172.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.25 4.4 tp-100 56.3 -76.24 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 129.101 2.96 . . . . 0.0 115.431 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 49.8 ttt85 -88.25 -34.95 17.56 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 121.565 1.984 . . . . 0.0 114.137 169.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -74.67 -51.84 13.27 Favored 'General case' 0 N--CA 1.446 -0.674 0 O-C-N 118.829 -2.419 . . . . 0.0 116.504 -157.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -35.66 -47.97 0.5 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.517 1.127 . . . . 0.0 112.757 161.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -68.91 -27.24 65.59 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 116.948 2.203 . . . . 0.0 116.948 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -105.32 -31.73 8.93 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 124.796 2.236 . . . . 0.0 112.823 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -87.67 -36.45 17.43 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 116.537 2.051 . . . . 0.0 116.537 -172.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . 0.404 ' HB3' HG12 ' D' ' 57' ' ' ILE . 0.8 OUTLIER -110.19 -36.31 5.86 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.714 2.006 . . . . 0.0 108.638 175.977 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 59.61 -113.01 4.81 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 118.885 2.314 . . . . 0.0 118.885 167.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -54.57 2.91 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 120.94 3.681 . . . . 0.0 120.94 -159.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -110.94 -7.2 25.56 Favored Glycine 0 CA--C 1.526 0.774 0 O-C-N 119.736 -1.852 . . . . 0.0 111.512 170.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 4.9 tt -73.91 -19.43 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 118.839 -2.566 . . . . 0.0 114.3 -166.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -97.34 -11.85 23.53 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 119.589 1.086 . . . . 0.0 109.466 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.2 m -79.54 -55.43 5.05 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 106.376 -1.712 . . . . 0.0 106.376 161.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.327 20.4 mm -58.18 -26.98 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 118.141 -2.849 . . . . 0.0 114.599 176.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 30.9 p -111.08 8.55 21.85 Favored 'General case' 0 N--CA 1.451 -0.401 1 N-CA-C 123.34 4.57 . . . . 0.0 123.34 177.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -112.03 -144.58 0.39 Allowed 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 114.915 -2.469 . . . . 0.0 106.519 164.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 75.77 155.3 5.38 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-N 122.959 2.618 . . . . 0.0 109.757 -175.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 94.1 p -71.66 -30.8 66.12 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 176.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -138.9 43.16 2.09 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 -167.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 96.6 p -84.14 -179.32 7.2 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 124.074 1.892 . . . . 0.0 112.053 173.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.267 1.6 mp -69.46 -9.0 51.81 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 112.665 -2.061 . . . . 0.0 114.676 175.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 22.6 tttt -71.81 -16.44 62.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 115.618 1.711 . . . . 0.0 115.618 155.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -101.08 -41.88 6.59 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 120.057 -1.652 . . . . 0.0 109.515 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . 0.493 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 59.62 91.66 0.07 OUTLIER Pre-proline 0 N--CA 1.452 -0.345 0 CA-C-N 120.695 1.589 . . . . 0.0 109.997 -174.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . 0.493 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.285 97.9 Cg_exo 37.4 35.72 0.0 OUTLIER 'Cis proline' 0 N--CA 1.448 -1.161 0 N-CA-C 116.756 1.791 . . . . 0.0 116.756 29.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . 0.481 HG22 ' HB1' ' D' ' 92' ' ' ALA . 61.1 t -66.76 -18.22 23.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 C-N-CA 128.327 2.651 . . . . 0.0 111.324 -172.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.55 -28.11 9.06 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -166.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 36.9 tp -57.69 -46.06 84.81 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 120.531 -1.356 . . . . 0.0 110.884 151.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -67.5 -49.24 64.34 Favored 'General case' 0 N--CA 1.451 -0.408 1 O-C-N 116.135 -4.103 . . . . 0.0 112.184 -175.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -61.0 -2.61 0.61 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 114.383 -2.722 . . . . 0.0 111.811 172.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 49.1 t90 -103.87 -54.18 2.61 Favored 'General case' 0 N--CA 1.45 -0.438 1 CA-C-N 127.74 4.791 . . . . 0.0 110.888 171.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 92.1 mt -48.81 -42.56 36.46 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.8 1.24 . . . . 0.0 107.657 174.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -66.99 -35.54 80.17 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.574 -0.704 . . . . 0.0 112.372 -173.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -80.51 -24.35 39.46 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 120.612 1.551 . . . . 0.0 109.136 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 78.1 t -100.88 -15.2 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 123.908 3.049 . . . . 0.0 107.626 -168.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 83.9 mt -112.9 -16.22 12.74 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 121.487 1.949 . . . . 0.0 112.463 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.353 25.1 mt -98.4 16.34 21.96 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 171.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 15.6 pttp -77.77 161.52 27.62 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.741 2.016 . . . . 0.0 114.131 178.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 5.4 m -80.74 -9.66 59.79 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 117.893 -3.005 . . . . 0.0 117.797 -164.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-N 121.851 2.114 . . . . 0.0 112.913 -176.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.468 0.443 0 N-CA-C 111.536 0.198 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.63 -11.6 59.88 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 118.503 2.779 . . . . 0.0 118.503 -168.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -84.2 -31.13 25.25 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 118.804 -2.435 . . . . 0.0 116.435 166.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -79.46 -17.48 54.13 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 126.75 2.531 . . . . 0.0 113.177 178.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 59.0 p -73.75 139.75 77.51 Favored Pre-proline 0 N--CA 1.446 -0.634 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -175.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -53.18 -26.57 34.07 Favored 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 122.162 1.908 . . . . 0.0 114.558 175.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -143.78 152.42 41.21 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.587 0.708 . . . . 0.0 111.059 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.25 8.6 t -119.31 93.95 4.26 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.307 3.043 . . . . 0.0 110.831 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.51 -20.82 64.6 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 116.834 -1.555 . . . . 0.0 110.379 168.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.29 -44.47 87.87 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 129.199 3.0 . . . . 0.0 112.18 167.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 56.6 ttp -76.55 -29.84 56.85 Favored 'General case' 0 N--CA 1.448 -0.549 1 O-C-N 114.317 -5.239 . . . . 0.0 109.863 174.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.97 -49.81 76.46 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 117.08 -3.513 . . . . 0.0 114.959 168.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -54.31 -43.13 70.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 122.711 1.243 . . . . 0.0 112.452 173.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -55.42 -53.11 60.33 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 122.78 1.276 . . . . 0.0 112.313 174.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -69.94 -40.57 75.42 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 116.576 -1.678 . . . . 0.0 109.372 -175.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -47.8 -33.35 7.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 125.768 2.699 . . . . 0.0 116.067 171.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . 0.309 2.6 mp0 -73.55 -31.7 63.79 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 117.772 -3.08 . . . . 0.0 113.008 173.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 62.4 mt-10 -76.08 -19.8 58.26 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 119.401 -2.062 . . . . 0.0 110.014 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.47 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG 0.34 38.7 t-105 -71.18 -50.06 37.22 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 129.184 2.994 . . . . 0.0 114.981 166.304 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.54 -27.38 68.58 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.027 1.731 . . . . 0.0 114.514 173.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -75.05 -35.06 61.91 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 116.566 2.061 . . . . 0.0 116.566 165.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.38 -50.27 70.15 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 119.883 1.219 . . . . 0.0 112.806 161.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.4 t -76.96 -25.58 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 CA-C-O 115.414 -2.232 . . . . 0.0 113.811 -173.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -61.02 -55.74 29.21 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 115.405 -2.236 . . . . 0.0 114.893 155.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 48.9 tp -56.18 -37.43 69.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 121.011 1.732 . . . . 0.0 113.154 -173.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 23.4 tp -68.23 -46.84 69.43 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 110.082 -3.235 . . . . 0.0 114.411 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -60.88 -42.47 97.99 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 118.569 -2.582 . . . . 0.0 112.023 174.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.89 -32.23 71.73 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 126.221 2.201 . . . . 0.0 111.996 173.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.505 ' HB2' HD22 ' A' ' 38' ' ' LEU . . . -66.88 -36.68 82.84 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 111.883 -3.913 . . . . 0.0 108.971 171.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -62.64 -34.05 76.26 Favored 'General case' 0 N--CA 1.448 -0.547 1 CA-C-N 130.116 5.871 . . . . 0.0 115.328 168.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.328 77.1 mt-30 -64.6 -21.2 66.65 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 116.972 2.212 . . . . 0.0 116.972 170.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 43.2 m-80 -109.02 10.57 26.17 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 124.701 1.25 . . . . 0.0 108.623 173.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 52.66 27.21 5.0 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 116.737 -3.727 . . . . 0.0 118.265 -168.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 36.2 mt -102.54 6.69 40.03 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 117.491 -3.255 . . . . 0.0 112.004 -172.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -72.22 -30.59 65.07 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 125.561 1.544 . . . . 0.0 110.755 -158.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 56.4 mt -63.6 -59.23 12.28 Favored Pre-proline 0 N--CA 1.451 -0.396 0 N-CA-C 116.651 2.093 . . . . 0.0 116.651 167.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -49.96 -33.91 35.67 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 CA-C-N 124.994 2.819 . . . . 0.0 113.454 170.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.505 HD22 ' HB2' ' A' ' 29' ' ' ALA . 13.3 tp -64.44 -52.08 59.87 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 122.281 2.31 . . . . 0.0 116.097 174.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.3 mt -60.68 -35.09 75.41 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.13 1.772 . . . . 0.0 114.78 168.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 -73.87 -30.75 62.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 121.801 2.091 . . . . 0.0 108.02 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.275 19.6 tp -78.36 -36.93 45.41 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 116.78 -3.7 . . . . 0.0 111.272 176.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 62.1 mmm -70.68 -20.28 62.7 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 118.279 2.696 . . . . 0.0 118.279 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.426 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 10.5 mt -137.32 125.15 22.54 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 130.342 3.457 . . . . 0.0 114.278 178.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 66.8 p -67.16 152.19 96.35 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-O 114.715 -2.564 . . . . 0.0 108.855 175.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -59.32 -26.83 83.24 Favored 'Trans proline' 0 N--CA 1.451 -1.022 0 N-CA-C 119.163 2.717 . . . . 0.0 119.163 -159.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -63.59 -44.55 93.67 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 125.645 1.84 . . . . 0.0 108.143 178.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HB2' ' HB3' ' A' ' 43' ' ' LEU . 21.9 mt-10 -59.13 -44.9 92.06 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 131.673 3.989 . . . . 0.0 114.353 177.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.6 mtm180 -65.48 -54.67 25.02 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.889 3.276 . . . . 0.0 113.266 172.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -47.42 -36.32 9.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 165.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.12 -38.74 79.05 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 118.595 -2.565 . . . . 0.0 114.057 169.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.9 mt -66.7 -32.49 73.84 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 116.672 -1.632 . . . . 0.0 107.076 178.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.93 -50.74 62.67 Favored Glycine 0 CA--C 1.523 0.57 0 CA-C-N 120.287 1.403 . . . . 0.0 110.986 166.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.5 m -60.74 -33.85 73.53 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 120.723 2.261 . . . . 0.0 110.804 -175.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -73.18 -25.95 60.99 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 120.926 1.694 . . . . 0.0 109.092 -170.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 85.8 t -58.49 -43.4 86.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 C-N-CA 124.695 1.198 . . . . 0.0 112.44 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 -67.16 -43.21 82.83 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 129.271 3.028 . . . . 0.0 112.227 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 81.8 mt -54.11 -54.64 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 125.114 1.509 . . . . 0.0 111.09 165.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.7 t -66.1 -26.2 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 120.729 1.604 . . . . 0.0 112.263 176.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . 0.25 11.0 tt0 -63.67 -53.39 52.07 Favored 'General case' 0 N--CA 1.446 -0.652 1 O-C-N 116.066 -4.146 . . . . 0.0 111.396 170.095 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -75.63 -23.05 56.33 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 117.17 -3.456 . . . . 0.0 113.02 -175.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 80.3 mt -76.31 -34.88 59.04 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 119.011 -2.306 . . . . 0.0 112.224 165.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 63.2 mt -73.55 -50.12 22.95 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 116.792 -3.693 . . . . 0.0 113.105 173.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.7 ttm180 -43.05 -41.54 3.54 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 116.532 -3.855 . . . . 0.0 115.424 161.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 59.11 29.71 65.91 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 120.278 2.871 . . . . 0.0 120.278 172.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -95.75 -43.13 8.02 Favored 'General case' 0 N--CA 1.444 -0.725 1 C-N-CA 131.746 4.019 . . . . 0.0 114.505 175.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 40.8 mtt -69.48 130.54 42.78 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 168.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.7 p -78.73 172.19 14.08 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 126.933 2.093 . . . . 0.0 113.074 158.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -50.54 -44.4 56.44 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 128.106 2.562 . . . . 0.0 113.995 171.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -61.9 -27.1 68.57 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 118.935 -2.353 . . . . 0.0 115.517 177.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -84.26 -54.64 4.66 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 126.994 2.118 . . . . 0.0 111.788 -178.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.5 mt -46.74 -29.71 2.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 119.127 3.01 . . . . 0.0 119.127 164.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -72.86 -18.4 61.44 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.795 2.038 . . . . 0.0 114.53 173.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -91.99 -74.27 0.52 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.106 2.162 . . . . 0.0 110.628 160.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -66.22 -21.78 66.32 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 127.105 2.753 . . . . 0.0 112.238 -151.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 13.0 mt -120.07 -26.79 5.46 Favored 'General case' 0 N--CA 1.446 -0.628 0 O-C-N 120.254 -1.529 . . . . 0.0 108.425 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.51 15.47 27.24 Favored Glycine 0 CA--C 1.526 0.774 0 C-N-CA 126.137 1.827 . . . . 0.0 115.993 170.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.52 126.79 35.12 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 126.248 1.793 . . . . 0.0 113.784 -164.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.21 157.16 49.63 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-O 122.079 0.821 . . . . 0.0 113.927 175.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 43.4 mt -57.09 -48.79 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.52 -33.42 66.04 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 117.561 -1.209 . . . . 0.0 113.562 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.6 p -67.64 -44.35 78.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 122.005 0.907 . . . . 0.0 111.091 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 11.3 mm -70.94 -33.79 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.748 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.276 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 15.0 m -56.14 -61.79 2.15 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 118.487 -2.633 . . . . 0.0 113.661 165.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -58.02 -36.49 72.78 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 130.673 3.589 . . . . 0.0 114.013 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.59 -36.76 32.56 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-O 115.008 -3.107 . . . . 0.0 108.172 -177.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 68.8 m -63.56 -52.97 58.76 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 119.368 1.584 . . . . 0.0 113.373 168.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -57.11 -31.52 65.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.754 -1.593 . . . . 0.0 110.285 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.7 m -77.06 -25.8 52.83 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 124.865 3.484 . . . . 0.0 113.479 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 29.3 tp -82.62 -42.43 18.24 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 119.222 3.045 . . . . 0.0 119.222 174.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -59.38 -39.88 84.73 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 125.179 1.391 . . . . 0.0 111.335 162.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.11 -35.77 78.67 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 117.283 -1.767 . . . . 0.0 113.762 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -50.47 142.59 15.04 Favored Pre-proline 0 N--CA 1.448 -0.532 0 CA-C-O 116.597 -1.668 . . . . 0.0 113.573 175.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.7 145.32 36.7 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 CA-C-N 121.472 1.561 . . . . 0.0 111.624 -168.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 m -57.26 -32.25 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -168.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 pm0 -55.42 -36.03 66.03 Favored 'General case' 0 N--CA 1.445 -0.723 1 O-C-N 113.409 -5.807 . . . . 0.0 114.79 174.059 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 33.5 tp -67.31 -39.31 85.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 114.268 -2.777 . . . . 0.0 115.373 169.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 87.1 mtm-85 -66.82 -43.12 84.62 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 125.375 1.672 . . . . 0.0 110.467 168.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -61.63 -28.3 69.27 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 125.171 1.544 . . . . 0.0 108.7 -176.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 22.1 t90 -75.14 -61.74 1.79 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 170.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 92.1 mt -51.35 -38.47 53.35 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -58.25 -31.0 66.99 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 120.94 -1.1 . . . . 0.0 112.764 172.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -83.54 -19.28 35.95 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 120.144 -1.597 . . . . 0.0 114.743 -175.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 21.2 t -95.81 -55.39 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 1 C-N-CA 133.105 4.562 . . . . 0.0 111.1 -176.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.6 mt -89.32 -15.56 33.15 Favored 'General case' 0 N--CA 1.448 -0.533 1 O-C-N 115.35 -4.594 . . . . 0.0 110.433 -171.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 59.4 mt -116.5 4.58 13.29 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 122.829 2.559 . . . . 0.0 113.634 -172.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.1 mttp -115.74 11.04 15.56 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 123.874 0.734 . . . . 0.0 112.886 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.0 m -87.0 -40.55 14.64 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 127.524 2.33 . . . . 0.0 113.267 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 116.15 -1.881 . . . . 0.0 115.532 -171.138 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.2 ttt . . . . . 0 N--CA 1.47 0.528 0 CA-C-O 117.079 -1.439 . . . . 0.0 114.208 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 0.292 . . -65.0 -39.2 93.11 Favored 'General case' 0 N--CA 1.448 -0.543 1 N-CA-C 122.632 4.308 . . . . 0.0 122.632 -171.8 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -62.63 -33.85 75.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 121.315 1.871 . . . . 0.0 112.375 -177.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -85.83 -23.06 27.3 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 118.13 -2.856 . . . . 0.0 116.205 171.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 39.5 m -58.77 139.75 86.22 Favored Pre-proline 0 N--CA 1.449 -0.49 0 C-N-CA 130.686 3.594 . . . . 0.0 113.14 174.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -71.75 -27.38 18.21 Favored 'Trans proline' 0 N--CA 1.448 -1.186 0 C-N-CA 123.112 2.541 . . . . 0.0 110.138 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -124.78 150.46 46.27 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.62 2.768 . . . . 0.0 112.997 171.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 39.2 t -145.7 114.25 6.77 Favored 'General case' 0 N--CA 1.45 -0.472 1 O-C-N 114.203 -5.311 . . . . 0.0 116.271 166.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.2 -17.07 60.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 117.331 -1.319 . . . . 0.0 112.176 172.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.22 -40.63 74.4 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 125.548 1.78 . . . . 0.0 114.505 174.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 51.7 mtt -69.39 -38.52 78.02 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 116.319 -1.801 . . . . 0.0 108.776 168.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.11 -41.38 98.17 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 124.126 3.148 . . . . 0.0 109.787 -173.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -71.98 -26.18 62.15 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 119.867 -1.771 . . . . 0.0 113.96 173.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -73.94 -36.27 64.62 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 117.974 -2.954 . . . . 0.0 112.135 169.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.8 mmt180 -72.43 -34.33 67.73 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 116.433 -1.746 . . . . 0.0 112.775 177.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 69.1 t60 -62.15 -46.14 90.33 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 127.862 3.226 . . . . 0.0 109.512 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -64.58 -35.19 80.2 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 117.374 -3.329 . . . . 0.0 115.805 168.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -70.06 -22.54 63.06 Favored 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 119.706 -1.872 . . . . 0.0 111.887 176.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -85.16 -47.69 9.88 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 128.361 2.664 . . . . 0.0 106.936 174.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . 0.253 45.5 mt -49.98 -24.57 2.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 118.12 2.637 . . . . 0.0 118.12 174.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 50.9 ttt180 -68.19 -33.63 74.8 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.938 -2.351 . . . . 0.0 112.196 173.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -66.28 -43.47 86.3 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 127.142 2.177 . . . . 0.0 110.971 176.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 38.6 t -58.97 -38.69 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 129.988 3.315 . . . . 0.0 115.545 173.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -71.44 -41.9 68.89 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 113.249 -1.796 . . . . 0.0 113.696 166.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 48.5 tp -60.38 -36.31 77.78 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 173.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.328 55.2 tp -80.77 -37.15 30.86 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 115.537 -2.173 . . . . 0.0 111.229 178.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -56.91 -44.41 82.37 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 116.491 -2.084 . . . . 0.0 114.398 167.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 50.6 m-20 -73.45 -26.49 60.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 120.19 1.359 . . . . 0.0 111.929 -172.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.86 -36.21 62.34 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.494 1.918 . . . . 0.0 114.939 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -60.79 -33.75 73.46 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 116.21 -1.853 . . . . 0.0 114.813 159.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -67.55 -29.22 68.54 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 122.529 2.422 . . . . 0.0 112.221 171.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -96.8 -0.1 48.53 Favored 'General case' 0 N--CA 1.447 -0.599 1 CA-C-O 111.465 -4.112 . . . . 0.0 110.174 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.46 0.4 OUTLIER 57.92 14.09 2.43 Favored 'General case' 0 N--CA 1.445 -0.683 1 C-N-CA 131.94 4.096 . . . . 0.0 117.163 -178.438 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' B' ' 34' ' ' LEU . 20.5 mt -88.96 22.08 2.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 129.115 2.966 . . . . 0.0 109.722 -177.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -88.39 -20.61 25.04 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 117.456 2.391 . . . . 0.0 117.456 -157.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 23.5 mt -73.2 -56.62 3.2 Favored Pre-proline 0 N--CA 1.449 -0.497 0 CA-C-N 112.089 -2.323 . . . . 0.0 111.747 170.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -62.62 -27.96 76.68 Favored 'Trans proline' 0 N--CA 1.448 -1.15 1 C-N-CA 125.698 4.265 . . . . 0.0 112.814 178.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 41.9 tp -73.35 -37.66 65.99 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.849 1.968 . . . . 0.0 106.903 -178.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 80.7 mt -70.84 -38.69 73.2 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 125.522 2.582 . . . . 0.0 112.189 175.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 -57.39 -29.31 63.97 Favored 'General case' 0 N--CA 1.449 -0.5 1 O-C-N 114.531 -5.105 . . . . 0.0 113.578 165.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 45.0 tp -78.5 -48.02 16.16 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 117.283 -3.386 . . . . 0.0 111.904 174.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 11.4 mmt -82.89 -11.23 58.37 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -167.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 1.1 mp -140.61 128.32 21.65 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.287 1.835 . . . . 0.0 112.354 -169.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 66.8 p -80.19 160.63 67.72 Favored Pre-proline 0 N--CA 1.449 -0.48 0 CA-C-O 115.385 -2.245 . . . . 0.0 110.334 -178.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -55.16 -36.36 92.96 Favored 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 124.895 3.73 . . . . 0.0 113.784 -169.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.32 -26.28 38.87 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 124.468 1.105 . . . . 0.0 110.155 -172.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -67.49 -47.27 70.52 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 119.084 -2.26 . . . . 0.0 110.91 167.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . 0.47 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 62.7 mtm-85 -63.58 -41.35 98.38 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 125.163 1.539 . . . . 0.0 115.064 178.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.57 -39.31 93.51 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 118.891 -2.38 . . . . 0.0 114.876 169.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.62 -46.96 65.03 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 18.8 mt -53.09 -34.93 58.83 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 117.04 -3.537 . . . . 0.0 116.492 169.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.96 -24.17 71.47 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 110.688 -2.96 . . . . 0.0 115.967 172.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.5 m -101.88 -22.35 14.35 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 114.926 -2.464 . . . . 0.0 110.969 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -63.32 -21.62 66.37 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 121.311 1.869 . . . . 0.0 112.643 166.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 10.5 t -54.16 -49.37 62.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 O-C-N 116.599 -3.813 . . . . 0.0 114.424 163.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 -74.07 -31.84 63.02 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 96.3 mt -70.73 -46.97 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 N-CA-C 106.333 -1.729 . . . . 0.0 106.333 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 3.3 t -63.23 -36.2 75.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 O-C-N 116.975 -3.578 . . . . 0.0 111.634 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.16 -41.94 76.24 Favored 'General case' 0 N--CA 1.452 -0.35 1 O-C-N 115.861 -4.274 . . . . 0.0 116.396 169.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -80.08 -17.33 52.95 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 129.951 3.3 . . . . 0.0 112.468 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 54.6 mt -82.73 -9.78 59.2 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 117.183 -3.448 . . . . 0.0 111.027 168.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 89.3 mt -107.38 -31.33 8.22 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 128.413 2.685 . . . . 0.0 112.079 169.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 16.5 ttm105 -70.66 -54.46 11.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.692 1.738 . . . . 0.0 115.692 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 63.68 54.61 30.22 Favored Glycine 0 C--N 1.337 0.622 0 CA-C-O 115.301 -2.944 . . . . 0.0 117.111 -170.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -126.95 -17.01 4.99 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 117.152 2.278 . . . . 0.0 117.152 175.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 81.4 mtp -102.93 146.44 28.32 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.208 -2.183 . . . . 0.0 111.731 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 59.5 p -93.54 172.55 8.2 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 118.471 -2.643 . . . . 0.0 107.845 172.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -58.4 -37.41 75.25 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 175.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 46.8 ttt180 -55.25 -36.51 66.14 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 126.298 2.951 . . . . 0.0 118.208 172.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -85.08 -38.92 18.57 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 128.284 2.634 . . . . 0.0 106.681 -174.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 73.3 mt -58.56 -42.49 88.06 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 117.056 -3.527 . . . . 0.0 111.491 170.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 tptt -59.26 -65.92 0.59 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 127.757 2.423 . . . . 0.0 111.02 173.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -74.16 -29.75 61.93 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 114.687 -2.805 . . . . 0.0 114.147 -168.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . 0.31 39.6 mt-10 -115.91 -23.62 8.5 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 114.867 -2.492 . . . . 0.0 114.422 -162.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mt -104.85 -6.1 20.53 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 126.092 2.12 . . . . 0.0 114.389 162.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.94 16.8 70.91 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 119.672 -1.251 . . . . 0.0 113.496 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.55 134.72 34.18 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 122.833 3.316 . . . . 0.0 117.808 -179.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.17 -173.24 7.43 Favored Glycine 0 C--N 1.334 0.456 0 CA-C-O 124.527 2.181 . . . . 0.0 111.848 158.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 97.3 mt -83.13 -44.98 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 O-C-N 117.255 -3.497 . . . . 0.0 113.146 -177.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.97 -23.26 52.34 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 106.745 -1.576 . . . . 0.0 106.745 -169.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 17.2 m -66.04 -44.31 85.0 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.315 1.446 . . . . 0.0 113.841 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 21.1 mm -76.74 -30.14 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 C-N-CA 125.916 1.686 . . . . 0.0 107.663 173.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 6.7 m -59.4 -50.72 72.86 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 120.245 -1.534 . . . . 0.0 111.003 169.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -61.72 -42.18 98.61 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 -178.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -48.55 -44.54 29.31 Favored Glycine 0 N--CA 1.446 -0.657 1 C-N-CA 131.038 4.161 . . . . 0.0 109.7 176.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 3.6 p -74.02 -35.83 64.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.361 1.465 . . . . 0.0 114.055 -178.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -69.59 -41.19 76.11 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 127.514 2.326 . . . . 0.0 107.702 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 6.0 m -72.51 -31.99 65.79 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 119.33 -2.107 . . . . 0.0 115.057 -176.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.09 -25.86 20.53 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 115.913 -1.994 . . . . 0.0 106.682 -177.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 58.1 tttm -64.4 -48.67 74.51 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 121.993 2.179 . . . . 0.0 105.234 172.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -82.18 3.94 25.29 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 117.368 -3.332 . . . . 0.0 116.671 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.7 141.71 64.91 Favored Pre-proline 0 N--CA 1.45 -0.425 0 O-C-N 117.49 -3.256 . . . . 0.0 113.157 178.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -49.03 124.99 12.35 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 123.192 2.595 . . . . 0.0 116.891 172.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.31 -23.56 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 1 O-C-N 115.887 -4.258 . . . . 0.0 115.571 -172.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 pm0 -60.36 -30.25 69.43 Favored 'General case' 0 N--CA 1.453 -0.308 1 O-C-N 114.865 -4.897 . . . . 0.0 111.877 171.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 14.7 tp -79.35 -36.79 38.86 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 117.39 -1.291 . . . . 0.0 110.655 171.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 32.0 mtm-85 -65.78 -39.77 91.33 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.832 2.16 . . . . 0.0 116.832 171.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -58.23 -39.37 78.92 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 130.296 3.438 . . . . 0.0 112.013 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -61.44 -59.2 5.61 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 128.188 2.595 . . . . 0.0 114.347 163.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 50.5 mt -75.11 -25.4 58.45 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 122.036 2.198 . . . . 0.0 114.529 -165.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -52.53 -35.79 54.18 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 129.71 3.204 . . . . 0.0 110.814 170.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -95.47 -47.71 6.15 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.156 2.183 . . . . 0.0 114.021 175.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.9 t -68.16 -20.78 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 O-C-N 119.749 -1.844 . . . . 0.0 112.928 -170.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 50.9 mt -107.14 -42.99 4.72 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -176.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 11.5 mt -77.35 -5.76 50.8 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.007 -1.451 . . . . 0.0 114.066 -174.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -104.29 -2.56 25.41 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 117.268 2.322 . . . . 0.0 117.268 169.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 31.6 m -79.68 -1.13 36.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 114.338 -2.744 . . . . 0.0 114.051 164.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 . . . . . 0 C--O 1.25 1.107 0 CA-C-N 124.905 3.502 . . . . 0.0 109.523 -178.689 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 11.5 ttt . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 116.941 -1.504 . . . . 0.0 111.581 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.263 . . -57.39 141.96 45.39 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 129.049 2.94 . . . . 0.0 104.646 178.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -120.11 149.66 41.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 123.921 0.763 . . . . 0.0 111.301 -176.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -141.2 148.37 39.83 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 174.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 60.4 p -159.67 158.47 27.38 Favored Pre-proline 0 N--CA 1.446 -0.646 1 C-N-CA 132.77 4.428 . . . . 0.0 111.025 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -52.91 -47.82 25.45 Favored 'Trans proline' 0 N--CA 1.45 -1.076 0 C-N-CA 122.376 2.051 . . . . 0.0 113.58 176.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -139.88 141.52 36.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 O-C-N 117.308 -3.37 . . . . 0.0 110.951 -171.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 11.9 t -141.95 137.38 31.22 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 112.684 -2.053 . . . . 0.0 106.341 168.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.89 -42.76 94.51 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 117.546 2.424 . . . . 0.0 117.546 174.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -50.85 -33.38 23.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 168.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 47.6 mtt -83.44 -37.83 22.69 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 115.189 -2.338 . . . . 0.0 113.43 175.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.85 -37.31 71.11 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 123.224 2.738 . . . . 0.0 112.802 166.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -67.52 -38.36 84.12 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 119.389 -2.069 . . . . 0.0 114.661 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -72.22 -25.97 61.85 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.074 -1.641 . . . . 0.0 111.626 176.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -39.59 86.21 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 125.888 2.756 . . . . 0.0 113.237 169.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 38.2 t60 -69.54 -48.83 59.1 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 119.439 -2.038 . . . . 0.0 108.856 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -70.34 -24.85 63.06 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 115.265 -2.302 . . . . 0.0 110.552 -175.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -56.8 -48.9 76.89 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 127.482 2.313 . . . . 0.0 113.138 161.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 16.3 t-105 -56.29 -64.74 0.76 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 170.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . 0.477 HD13 ' HA ' ' C' ' 20' ' ' LEU . 4.4 mm? -57.7 -33.08 68.01 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.901 2.08 . . . . 0.0 106.342 -175.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -66.74 -36.12 81.71 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 112.721 -3.514 . . . . 0.0 115.995 167.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -64.78 -37.57 88.05 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 122.747 2.521 . . . . 0.0 107.329 169.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 47.7 t -79.57 -23.38 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 O-C-N 116.647 -3.783 . . . . 0.0 111.521 176.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -83.6 -40.94 18.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 172.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 32.0 tp -56.13 -41.77 75.85 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 119.268 0.94 . . . . 0.0 111.674 171.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 37.3 tp -72.67 -31.58 65.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 123.962 1.839 . . . . 0.0 113.101 -177.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -83.81 -18.71 36.73 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 119.265 -2.147 . . . . 0.0 114.285 176.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -74.27 -38.87 63.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 116.665 -1.636 . . . . 0.0 112.714 160.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.3 -21.68 62.91 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.13 -5.76 37.81 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 120.34 1.427 . . . . 0.0 108.435 173.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -80.1 -38.55 31.42 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 121.936 2.153 . . . . 0.0 111.473 -176.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . 0.277 25.2 p-10 -120.5 33.11 5.71 Favored 'General case' 0 N--CA 1.451 -0.406 1 O-C-N 115.528 -4.483 . . . . 0.0 116.034 169.89 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 61.48 33.6 18.46 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 131.097 3.759 . . . . 0.0 117.499 171.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 42.0 mt -103.32 10.22 37.61 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.759 1.623 . . . . 0.0 109.593 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -74.04 -32.62 63.41 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 118.384 -2.698 . . . . 0.0 114.601 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 11.3 mt -78.04 -42.57 2.18 Favored Pre-proline 0 N--CA 1.45 -0.427 0 CA-C-O 116.278 -1.82 . . . . 0.0 108.839 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -59.45 -34.64 97.23 Favored 'Trans proline' 0 N--CA 1.448 -1.163 0 CA-C-O 115.306 -2.039 . . . . 0.0 113.578 166.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 14.3 tp -61.66 -43.77 98.23 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.768 1.918 . . . . 0.0 113.654 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 51.0 mt -67.01 -25.51 66.33 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 173.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -75.14 -19.08 60.07 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 169.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 38.2 tp -84.2 -55.17 4.33 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 126.027 2.079 . . . . 0.0 113.672 168.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 9.1 mmt -73.93 -24.41 59.66 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 119.13 -2.232 . . . . 0.0 110.973 -162.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 11.1 mp -127.25 132.6 50.33 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 129.743 3.217 . . . . 0.0 111.623 -171.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 1.4 p -73.06 157.23 88.81 Favored Pre-proline 0 N--CA 1.448 -0.532 0 C-N-CA 125.787 1.635 . . . . 0.0 108.622 172.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -45.94 -32.44 9.54 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 121.393 1.396 . . . . 0.0 113.451 168.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.96 -39.88 87.35 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 122.097 0.951 . . . . 0.0 113.368 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -72.76 -47.12 49.47 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 129.797 3.239 . . . . 0.0 109.919 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . 0.465 ' HD2' ' CZ2' ' D' ' 19' ' ' TRP . 58.0 mtm-85 -56.95 -41.54 78.47 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 175.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -70.69 -33.08 70.52 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 172.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.16 -39.58 82.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 171.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 20.9 mt -61.84 -33.2 73.74 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 122.238 2.29 . . . . 0.0 113.612 167.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.42 -27.32 73.84 Favored Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.834 171.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 93.8 m -82.18 -43.61 17.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.034 -2.45 . . . . 0.0 112.131 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -57.25 -36.61 71.18 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 114.214 -2.803 . . . . 0.0 115.298 169.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 22.1 t -51.05 -44.53 28.29 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-O 113.585 -3.102 . . . . 0.0 113.926 162.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 16.0 mtp180 -62.14 -28.51 69.69 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 124.698 3.408 . . . . 0.0 112.846 171.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 67.7 mt -80.93 -32.88 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 C-N-CA 119.297 -0.961 . . . . 0.0 111.577 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 92.4 t -66.98 -48.97 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 117.593 -1.194 . . . . 0.0 110.801 165.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -58.47 -50.77 72.55 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -177.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -66.81 -37.01 83.69 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 115.385 -2.245 . . . . 0.0 111.107 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 94.1 mt -70.0 -21.46 63.21 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 116.844 2.164 . . . . 0.0 116.844 173.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 19.7 mt -78.49 -23.69 46.27 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 115.503 1.668 . . . . 0.0 115.503 169.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -71.48 -44.6 64.42 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.874 -2.391 . . . . 0.0 110.868 168.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 65.76 22.78 70.35 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-O 125.235 2.575 . . . . 0.0 116.87 174.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -99.03 -21.52 16.17 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 117.964 -3.08 . . . . 0.0 111.077 -176.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 12.0 mtt -71.89 127.19 31.76 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 120.529 -1.357 . . . . 0.0 112.223 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 60.4 p -74.64 163.01 28.2 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 126.146 2.154 . . . . 0.0 111.382 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -37.89 -41.9 0.57 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 116.191 1.923 . . . . 0.0 116.191 171.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 31.8 ttp-105 -60.75 -48.41 81.9 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 121.912 0.863 . . . . 0.0 111.687 176.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -67.47 -34.17 76.63 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.97 2.108 . . . . 0.0 106.565 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 68.5 mt -68.72 -30.94 69.68 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 119.069 -2.269 . . . . 0.0 111.82 172.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 39.7 tttp -73.99 -42.34 60.57 Favored 'General case' 0 N--CA 1.453 -0.283 1 O-C-N 115.093 -4.754 . . . . 0.0 116.341 170.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -76.13 -21.6 56.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.84 1.256 . . . . 0.0 109.535 -170.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -124.69 -39.71 2.27 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 117.422 -1.275 . . . . 0.0 114.238 -170.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.326 5.6 mp -102.01 -15.56 16.75 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 115.869 -2.015 . . . . 0.0 109.588 -168.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . 0.425 ' O ' HG22 ' C' ' 79' ' ' ILE . . . 48.2 -131.11 19.58 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 128.433 2.921 . . . . 0.0 117.328 158.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.25 -22.28 33.1 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 119.575 -2.133 . . . . 0.0 111.926 -174.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -77.23 -15.13 81.85 Favored Glycine 0 CA--C 1.523 0.588 0 C-N-CA 127.065 2.269 . . . . 0.0 112.032 -169.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . 0.425 HG22 ' O ' ' C' ' 76' ' ' GLY . 17.5 tt -58.64 -33.84 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 125.535 1.534 . . . . 0.0 110.155 -178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.6 -32.7 74.19 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 120.897 -1.127 . . . . 0.0 113.505 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 2.9 m -62.79 -44.03 97.23 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 117.462 -3.274 . . . . 0.0 109.454 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 39.0 mm -88.36 -18.26 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 129.385 3.074 . . . . 0.0 112.054 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 71.7 p -110.93 -11.05 14.37 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 120.701 3.593 . . . . 0.0 120.701 174.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 43.3 mtp85 -115.29 156.1 26.07 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.426 -3.296 . . . . 0.0 113.335 174.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.86 172.22 45.61 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 128.034 2.73 . . . . 0.0 112.783 -177.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 97.2 p -89.86 10.08 25.09 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 116.976 -3.661 . . . . 0.0 117.776 -176.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -104.55 0.85 29.13 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 118.002 -2.936 . . . . 0.0 114.215 161.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 99.9 p -59.23 172.83 0.55 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 126.459 3.028 . . . . 0.0 115.753 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 26.5 tp -70.72 -12.44 61.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 111.015 -2.811 . . . . 0.0 111.3 -170.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -124.02 0.98 8.58 Favored 'General case' 0 N--CA 1.451 -0.376 1 O-C-N 116.262 -4.024 . . . . 0.0 110.328 177.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -113.36 -21.33 10.96 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 121.535 3.902 . . . . 0.0 121.535 173.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.42 157.78 4.62 Favored Pre-proline 0 N--CA 1.452 -0.352 0 C-N-CA 129.499 3.12 . . . . 0.0 112.994 170.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -56.98 129.05 32.47 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 N-CA-C 114.389 0.88 . . . . 0.0 114.389 173.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 61.8 t -59.78 -30.84 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 C-N-CA 128.907 2.883 . . . . 0.0 112.0 -162.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -62.59 -24.42 67.55 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 176.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 4.6 tp -68.35 -55.77 10.87 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 115.594 -2.146 . . . . 0.0 110.136 168.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 59.6 mtp180 -48.49 -40.79 27.83 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 128.593 2.757 . . . . 0.0 108.589 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -70.89 -52.84 17.71 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.613 1.965 . . . . 0.0 112.46 -179.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 32.8 t90 -46.7 -40.71 13.79 Favored 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 116.833 -3.667 . . . . 0.0 117.829 168.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 27.9 mt -75.46 -22.02 57.64 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.237 -175.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -78.64 -34.34 46.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 117.696 -1.145 . . . . 0.0 108.658 172.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -68.94 -18.57 64.11 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 125.245 1.418 . . . . 0.0 110.869 -178.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 96.9 t -105.58 -40.77 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 C-N-CA 127.819 2.448 . . . . 0.0 115.808 -177.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -103.51 -16.37 15.58 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 128.743 2.817 . . . . 0.0 111.728 -167.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 23.9 mt -120.44 -3.47 9.91 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 121.317 1.871 . . . . 0.0 112.427 -177.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -60.6 153.59 23.31 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 118.242 -2.786 . . . . 0.0 117.754 -171.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 72.4 m -121.7 76.15 1.25 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 124.565 2.126 . . . . 0.0 106.796 178.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 27.8 t70 . . . . . 0 C--O 1.247 0.959 0 C-N-CA 129.228 3.011 . . . . 0.0 109.734 -177.506 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 64.6 ttp . . . . . 0 N--CA 1.467 0.383 0 N-CA-C 112.953 0.724 . . . . 0.0 112.953 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.62 156.97 38.76 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 119.056 2.984 . . . . 0.0 119.056 -166.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -138.08 142.24 40.25 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 130.366 3.466 . . . . 0.0 110.968 -172.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -133.0 121.13 22.3 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 123.86 1.79 . . . . 0.0 107.999 -168.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 66.9 p -72.14 150.4 92.25 Favored Pre-proline 0 N--CA 1.446 -0.625 0 CA-C-O 114.699 -2.572 . . . . 0.0 115.084 172.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -61.96 -19.55 66.39 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 CA-C-N 122.709 2.003 . . . . 0.0 117.239 172.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . 0.354 49.5 t80 -173.78 148.1 1.43 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.386 2.274 . . . . 0.0 106.804 171.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 11.9 t -62.19 128.64 37.07 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 103.236 -2.875 . . . . 0.0 103.236 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.42 -25.26 61.41 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 112.826 -1.988 . . . . 0.0 111.205 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.93 -36.4 83.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 119.072 -2.267 . . . . 0.0 114.457 165.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -66.63 -33.91 76.71 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 177.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . 0.28 . . -60.86 -35.41 76.51 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 118.257 -2.777 . . . . 0.0 109.602 175.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -70.85 -50.88 30.49 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.292 -2.13 . . . . 0.0 106.726 179.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -54.77 -46.23 74.37 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.28 2.232 . . . . 0.0 108.15 -170.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -31.36 71.32 Favored 'General case' 0 N--CA 1.45 -0.459 1 O-C-N 115.872 -4.268 . . . . 0.0 110.647 -168.594 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.6 t60 -76.56 -27.67 55.98 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 164.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -67.67 -33.21 74.47 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 118.017 -2.927 . . . . 0.0 116.139 169.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -74.99 -26.55 59.65 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 128.833 2.853 . . . . 0.0 115.196 167.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . 0.465 ' CZ2' ' HD2' ' C' ' 48' ' ' ARG . 5.1 t-105 -70.58 -48.26 56.13 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 116.939 -3.6 . . . . 0.0 110.371 165.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 93.6 mt -68.56 -25.22 64.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 120.52 -1.363 . . . . 0.0 110.14 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 17.4 ttt180 -62.37 -33.97 75.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 118.047 -0.978 . . . . 0.0 112.039 168.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . 0.451 88.1 t80 -70.68 -36.56 73.38 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 171.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.99 -45.47 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 O-C-N 119.144 -2.223 . . . . 0.0 110.396 172.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -74.91 -33.48 62.02 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 118.033 2.605 . . . . 0.0 118.033 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 17.3 tp -60.62 -43.05 97.92 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 124.353 2.025 . . . . 0.0 111.099 167.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 42.3 tp -60.91 -44.0 97.77 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 118.272 -2.767 . . . . 0.0 109.546 175.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -59.36 -55.62 32.46 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 120.092 1.315 . . . . 0.0 107.89 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -58.14 -30.56 66.43 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 126.483 2.364 . . . . 0.0 115.858 174.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.34 -24.95 62.2 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.899 0.88 . . . . 0.0 112.048 175.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -76.81 -26.16 54.1 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 119.516 1.053 . . . . 0.0 110.428 168.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -84.54 -19.06 33.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 118.185 -2.822 . . . . 0.0 113.421 -176.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 53.7 p30 -114.97 10.38 16.27 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 114.889 1.441 . . . . 0.0 114.889 172.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 49.63 42.42 23.19 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.601 1.188 . . . . 0.0 112.024 -176.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 47.1 mt -102.03 11.99 37.56 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 121.476 1.944 . . . . 0.0 112.824 167.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . 0.366 0.0 OUTLIER -49.71 -67.16 0.28 Allowed 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 119.876 3.287 . . . . 0.0 119.876 177.296 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 6.2 mt -58.2 -48.63 96.69 Favored Pre-proline 0 N--CA 1.449 -0.505 0 CA-C-O 114.745 -2.55 . . . . 0.0 110.554 -177.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.33 -25.49 71.45 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 CA-C-N 125.36 2.95 . . . . 0.0 112.912 175.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 14.8 tp -79.48 -40.23 30.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 125.535 3.789 . . . . 0.0 116.575 177.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 89.0 mt -68.34 -42.56 79.11 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 105.965 -1.865 . . . . 0.0 105.965 175.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 11.8 m-20 -71.5 -28.21 63.75 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 113.844 -2.979 . . . . 0.0 117.009 177.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 28.1 tp -57.6 -52.1 66.8 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 114.063 -2.875 . . . . 0.0 114.149 156.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 19.4 mmt -75.88 -25.66 56.32 Favored 'General case' 0 N--CA 1.448 -0.529 1 C-N-CA 131.823 4.049 . . . . 0.0 117.704 -173.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 14.6 mt -132.95 129.63 38.52 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 126.012 2.07 . . . . 0.0 110.476 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 71.6 p -77.25 167.23 38.21 Favored Pre-proline 0 N--CA 1.451 -0.412 0 CA-C-O 114.927 -2.463 . . . . 0.0 109.369 -167.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -45.23 -42.18 16.88 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 O-C-N 125.938 2.546 . . . . 0.0 116.15 -173.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -92.01 -7.65 48.28 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.765 1.626 . . . . 0.0 111.387 -169.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -88.5 -36.17 16.58 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 168.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -66.48 -38.64 87.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 127.199 2.2 . . . . 0.0 111.864 169.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -79.35 -37.39 37.55 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 119.747 -1.846 . . . . 0.0 108.955 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -49.44 -58.71 4.65 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 121.812 2.097 . . . . 0.0 108.93 163.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 49.0 mt -64.13 -44.09 93.25 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 117.786 -3.071 . . . . 0.0 111.406 -165.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -33.64 -50.3 0.57 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-O 114.48 -3.4 . . . . 0.0 121.551 149.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 28.7 m -73.57 -29.71 62.58 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 120.944 2.372 . . . . 0.0 109.262 177.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . 0.555 ' HA ' HD12 ' D' ' 57' ' ' ILE 0.262 96.9 mtt180 -64.42 -28.66 69.83 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 120.509 -1.369 . . . . 0.0 113.573 -176.676 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 10.8 t -56.62 -51.86 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 120.6 1.545 . . . . 0.0 112.037 162.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -77.08 -11.06 59.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 117.227 -1.789 . . . . 0.0 113.905 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . 0.555 HD12 ' HA ' ' D' ' 54' ' ' ARG . 36.9 mt -74.91 -47.73 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 122.223 2.283 . . . . 0.0 105.804 175.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . 0.408 HG22 HG23 ' D' ' 82' ' ' ILE . 91.3 t -65.03 -41.61 92.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 173.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -56.26 -31.18 63.34 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.684 -2.51 . . . . 0.0 115.204 173.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -84.56 -29.69 25.67 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 120.34 1.427 . . . . 0.0 114.543 -176.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 25.0 mt -67.06 -20.46 65.83 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.999 1.719 . . . . 0.0 113.628 161.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 27.6 mt -94.64 -21.22 18.94 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 120.118 -1.614 . . . . 0.0 111.559 171.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . 0.256 32.0 ttm180 -79.95 -40.46 28.03 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.898 0.856 . . . . 0.0 111.295 176.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 73.24 6.63 69.84 Favored Glycine 0 C--N 1.335 0.484 0 C-N-CA 127.652 2.548 . . . . 0.0 117.98 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -93.48 -32.8 14.05 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 124.872 0.983 . . . . 0.0 113.304 -170.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 39.0 mtt -80.28 42.54 0.58 Allowed 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 127.383 3.468 . . . . 0.0 114.03 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 89.0 p -67.86 163.0 22.89 Favored 'General case' 0 N--CA 1.446 -0.669 1 O-C-N 115.664 -4.398 . . . . 0.0 113.966 -176.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 67.83 -55.21 0.49 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 114.564 -2.636 . . . . 0.0 115.917 163.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 ttt85 -125.05 -29.27 3.34 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 122.327 2.33 . . . . 0.0 116.49 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -77.16 -37.32 54.09 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 118.346 -2.721 . . . . 0.0 111.081 -173.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 11.7 mt -53.71 -30.34 43.43 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.0 1.857 . . . . 0.0 115.405 168.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -91.73 -7.24 50.3 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -136.18 -17.43 1.59 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 114.926 -2.464 . . . . 0.0 117.65 -175.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . 0.436 ' HB3' HD22 ' D' ' 75' ' ' LEU . 5.4 tp10 -90.59 -35.43 15.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 126.549 2.405 . . . . 0.0 112.015 163.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . 0.51 HD22 ' N ' ' D' ' 75' ' ' LEU 0.307 1.4 mm? -94.61 -57.2 2.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 127.352 2.261 . . . . 0.0 116.215 172.382 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.65 -162.83 44.43 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-O 116.249 -2.417 . . . . 0.0 114.612 174.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -33.3 -32.93 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 130.159 4.094 . . . . 0.0 118.084 -157.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.01 -19.43 56.7 Favored Glycine 0 C--N 1.337 0.632 1 C-N-CA 131.316 4.294 . . . . 0.0 110.491 174.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . 0.256 0.9 OUTLIER -58.65 -29.94 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 121.655 2.728 . . . . 0.0 114.778 175.508 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.62 -12.86 60.04 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 116.591 -1.671 . . . . 0.0 111.731 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 14.4 m -71.76 -37.16 70.54 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 118.322 2.712 . . . . 0.0 118.322 158.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . 0.408 HG23 HG22 ' D' ' 58' ' ' VAL . 25.8 mm -82.93 -27.06 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 CA-C-N 113.645 -1.616 . . . . 0.0 111.573 -173.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 71.5 p -102.31 -19.03 15.17 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 127.261 2.224 . . . . 0.0 110.625 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.322 16.3 mtp180 -119.79 154.25 34.5 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.297 -2.752 . . . . 0.0 113.531 178.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 109.38 146.41 11.49 Favored Glycine 0 C--N 1.338 0.692 0 C-N-CA 119.922 -1.132 . . . . 0.0 111.355 -159.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 84.5 p -72.68 -21.62 61.04 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 129.606 3.163 . . . . 0.0 112.907 -160.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -130.09 38.78 3.75 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 128.344 3.527 . . . . 0.0 113.397 175.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 29.1 p -57.46 169.59 0.63 Allowed 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 127.365 2.916 . . . . 0.0 117.374 173.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.373 0.7 OUTLIER -65.77 -3.48 5.0 Favored 'General case' 0 C--O 1.223 -0.297 1 O-C-N 115.59 -4.444 . . . . 0.0 119.443 159.122 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 66.2 tttt -76.68 -22.83 53.45 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 126.957 2.661 . . . . 0.0 114.625 162.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -105.21 -39.89 6.04 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 131.638 3.975 . . . . 0.0 115.448 -152.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . 0.628 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 55.33 85.49 0.19 Allowed Pre-proline 0 N--CA 1.448 -0.569 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 167.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . 0.628 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.357 0.0 OUTLIER 33.95 33.11 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.21 0 C-N-CA 119.468 -3.138 . . . . 0.0 118.857 40.047 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 91.8 t -65.32 -28.81 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 O-C-N 125.837 1.961 . . . . 0.0 107.215 -170.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . 0.519 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.263 0.1 OUTLIER -81.82 -42.78 19.18 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 130.066 3.346 . . . . 0.0 109.979 -170.131 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 9.0 tp -63.26 -40.99 98.97 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 118.501 0.591 . . . . 0.0 111.95 165.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 -55.53 -53.59 54.46 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 116.823 -1.56 . . . . 0.0 115.193 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -57.65 -34.63 69.56 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 126.192 2.183 . . . . 0.0 114.41 177.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 59.5 t90 -75.74 -45.51 36.09 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 117.932 -2.98 . . . . 0.0 111.74 175.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 94.1 mt -55.99 -37.13 68.7 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 118.597 -2.564 . . . . 0.0 114.541 174.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -70.8 -21.24 62.5 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 115.506 1.669 . . . . 0.0 115.506 -174.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -89.37 -48.99 6.97 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 123.674 1.702 . . . . 0.0 111.398 171.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 89.7 t -63.17 -38.78 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 O-C-N 118.261 -2.774 . . . . 0.0 113.136 178.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 75.6 mt -84.94 -20.74 30.19 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 115.716 -2.394 . . . . 0.0 114.561 -174.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 55.0 mt -93.86 5.38 51.84 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 124.943 2.306 . . . . 0.0 116.078 177.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 19.1 pttp -60.93 147.28 43.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.657 1.983 . . . . 0.0 107.481 -172.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 34.3 m -65.88 -29.0 69.37 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 119.505 3.15 . . . . 0.0 119.505 -171.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 . . . . . 0 C--O 1.252 1.226 0 O-C-N 118.701 -2.5 . . . . 0.0 113.838 166.541 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.24 -14.32 60.91 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -172.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -84.52 4.35 32.31 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 172.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -125.63 -39.26 2.17 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 124.877 1.271 . . . . 0.0 111.872 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.425 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 54.2 p -46.96 140.54 6.22 Favored Pre-proline 0 N--CA 1.455 -0.214 0 C-N-CA 127.939 2.496 . . . . 0.0 112.143 175.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 5' ' ' SER . 57.4 Cg_endo -73.93 -15.77 23.44 Favored 'Trans proline' 0 N--CA 1.448 -1.163 1 C-N-CA 125.438 4.092 . . . . 0.0 106.738 175.085 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -121.81 151.39 40.66 Favored 'General case' 0 N--CA 1.446 -0.655 1 O-C-N 115.777 -4.327 . . . . 0.0 107.857 176.272 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.6 t -117.51 118.45 32.21 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 115.912 1.819 . . . . 0.0 115.912 166.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.19 -36.33 81.58 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 125.445 1.716 . . . . 0.0 111.887 178.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.3 -41.1 96.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 111.574 -2.557 . . . . 0.0 110.488 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.8 ttp -78.74 -36.79 42.71 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 117.31 2.337 . . . . 0.0 117.31 176.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.04 -40.52 73.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 173.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -77.67 -39.8 43.73 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 177.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -42.23 -40.72 2.5 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 128.313 2.645 . . . . 0.0 113.048 168.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 67.0 mmt-85 -79.87 -25.71 40.58 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 125.401 1.688 . . . . 0.0 114.716 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 29.8 t60 -70.58 -39.16 74.04 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 121.63 2.014 . . . . 0.0 111.295 171.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -55.41 -43.13 74.99 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.108 1.363 . . . . 0.0 110.119 172.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -65.1 -37.47 87.59 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 118.362 2.727 . . . . 0.0 118.362 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 41.9 t-105 -65.94 -47.88 73.21 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.606 169.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 69.6 mt -57.68 -38.33 74.96 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 120.56 1.527 . . . . 0.0 109.693 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 43.5 ttt180 -62.75 -36.46 83.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 121.221 1.828 . . . . 0.0 114.658 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -61.76 -41.79 98.14 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 121.195 1.816 . . . . 0.0 108.8 173.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 61.5 t -67.42 -49.77 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 CA-C-N 121.477 1.944 . . . . 0.0 105.912 -173.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -71.15 -32.27 68.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 118.997 -2.314 . . . . 0.0 113.899 -177.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 19.4 tp -55.68 -49.49 72.81 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.524 -2.61 . . . . 0.0 109.169 167.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.09 -31.3 72.44 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 118.649 -2.532 . . . . 0.0 114.331 176.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -57.96 -51.82 68.06 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.801 1.778 . . . . 0.0 115.801 169.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -60.8 -39.43 88.91 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 126.156 1.782 . . . . 0.0 112.93 173.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.72 -48.85 76.84 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 115.054 -2.403 . . . . 0.0 114.845 163.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -55.89 -43.42 77.23 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 124.338 3.244 . . . . 0.0 113.85 172.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -70.55 -21.23 62.73 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 125.071 1.482 . . . . 0.0 114.613 -177.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -95.7 5.87 50.32 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 118.95 2.945 . . . . 0.0 118.95 165.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.398 6.0 m-20 71.59 35.59 1.42 Allowed 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 118.467 -2.646 . . . . 0.0 113.769 -172.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.268 49.1 mt -125.61 14.26 8.13 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 119.975 -1.703 . . . . 0.0 112.86 -167.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -73.97 -41.73 61.53 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 118.715 -2.49 . . . . 0.0 114.81 -172.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 89.5 mt -64.58 -52.77 49.82 Favored Pre-proline 0 N--CA 1.448 -0.554 0 O-C-N 125.571 1.794 . . . . 0.0 110.386 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -71.67 -20.28 26.81 Favored 'Trans proline' 0 N--CA 1.448 -1.19 0 CA-C-N 121.132 1.44 . . . . 0.0 111.287 -170.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 59.6 tp -71.22 -56.62 5.68 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 129.132 2.973 . . . . 0.0 109.278 173.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.3 mt -61.3 -30.68 70.63 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 120.074 -1.641 . . . . 0.0 110.04 176.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -67.32 -10.87 55.19 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 117.055 -3.528 . . . . 0.0 113.977 176.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.4 tt -102.96 -36.94 8.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.448 1.499 . . . . 0.0 113.442 173.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 79.9 mmm -78.87 -33.16 46.04 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 127.733 2.413 . . . . 0.0 117.293 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.8 mt -119.03 143.05 47.3 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.948 2.899 . . . . 0.0 112.148 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.7 p -82.91 167.13 31.63 Favored Pre-proline 0 N--CA 1.45 -0.444 0 CA-C-O 115.748 -2.073 . . . . 0.0 114.44 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . 0.443 65.4 Cg_exo -47.24 -60.58 0.83 Allowed 'Trans proline' 0 N--CA 1.45 -1.083 0 N-CA-C 119.935 3.014 . . . . 0.0 119.935 -172.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -67.55 -6.15 18.63 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 119.585 3.18 . . . . 0.0 119.585 168.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -84.21 -49.28 8.96 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.061 2.209 . . . . 0.0 108.017 170.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.4 mtm-85 -46.34 -45.86 17.85 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.022 2.129 . . . . 0.0 112.861 163.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -66.24 -46.18 78.04 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 124.953 1.408 . . . . 0.0 112.279 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.88 -41.43 87.1 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 130.321 3.448 . . . . 0.0 109.071 170.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 17.1 mt -54.76 -34.42 62.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 124.552 3.342 . . . . 0.0 112.88 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.05 -49.26 76.85 Favored Glycine 0 N--CA 1.446 -0.66 1 C-N-CA 131.72 4.486 . . . . 0.0 113.282 168.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.9 m -70.87 -34.37 71.55 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.692 1.197 . . . . 0.0 109.551 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -61.38 -37.18 82.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 117.178 2.288 . . . . 0.0 117.178 177.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.5 t -59.29 -38.9 77.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 125.33 1.452 . . . . 0.0 109.188 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.2 mtp180 -66.34 -31.91 72.98 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 128.389 2.675 . . . . 0.0 111.921 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 85.8 mt -77.29 -35.67 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 125.865 1.666 . . . . 0.0 110.49 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.48 HG21 ' CE ' ' B' ' 42' ' ' MET . 71.8 t -67.02 -46.16 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-O 117.144 -1.408 . . . . 0.0 107.768 170.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -64.9 -36.53 84.68 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 121.219 1.827 . . . . 0.0 108.422 -170.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -84.59 -29.82 25.51 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.862 -2.399 . . . . 0.0 111.843 -175.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.277 50.0 mt -69.56 -31.53 69.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 118.432 -2.667 . . . . 0.0 113.046 164.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tt -77.54 -37.27 51.19 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 117.033 -1.867 . . . . 0.0 112.152 172.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -69.06 -31.16 69.72 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 128.261 2.624 . . . . 0.0 115.733 176.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.63 -23.73 8.42 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 121.203 3.241 . . . . 0.0 121.203 164.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -64.89 -51.29 62.77 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 176.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 37.8 ttm -90.94 135.9 33.43 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 -155.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 83.8 p -107.94 170.53 7.94 Favored 'General case' 0 CA--C 1.52 -0.191 0 O-C-N 119.499 -2.001 . . . . 0.0 113.627 -166.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -35.17 -61.55 0.42 Allowed 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 124.879 2.276 . . . . 0.0 110.582 -176.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.0 tpt85 -67.14 -14.98 63.43 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.57 3.148 . . . . 0.0 115.455 -174.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -97.93 -46.89 5.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 128.003 3.314 . . . . 0.0 109.608 175.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.2 mt -50.25 -40.17 47.05 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.3 tptp -46.68 -50.61 17.55 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 111.901 -2.409 . . . . 0.0 114.686 164.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 25.1 m120 -78.95 -24.89 43.64 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 126.839 2.056 . . . . 0.0 111.646 -177.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -103.01 -26.71 12.98 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 -171.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 37.1 mt -130.35 0.21 4.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.305 -2.747 . . . . 0.0 113.859 -173.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.57 4.2 17.6 Favored Glycine 0 C--N 1.335 0.477 0 CA-C-N 111.936 -2.393 . . . . 0.0 113.868 -164.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.13 123.16 26.55 Favored 'General case' 0 N--CA 1.449 -0.517 1 O-C-N 115.895 -4.297 . . . . 0.0 110.487 -168.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.78 166.79 45.41 Favored Glycine 0 CA--C 1.524 0.595 1 CA-C-O 128.388 4.327 . . . . 0.0 113.392 173.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 60.3 mt -65.48 -27.44 41.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 110.73 -2.735 . . . . 0.0 109.805 -172.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.73 -37.59 73.5 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 120.414 1.461 . . . . 0.0 111.744 -175.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.6 p -86.94 -16.56 35.52 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.267 40.8 mm -71.07 -56.5 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 C-N-CA 129.939 3.296 . . . . 0.0 108.978 162.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.4 m -53.71 -44.47 69.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 121.573 1.988 . . . . 0.0 116.219 175.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 21.5 ttt180 -70.85 -54.59 10.98 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 123.142 1.449 . . . . 0.0 108.928 174.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -51.75 -25.74 15.87 Favored Glycine 0 C--N 1.337 0.608 0 O-C-N 118.647 -2.533 . . . . 0.0 116.797 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.3 m -75.59 -48.28 22.96 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 128.805 2.842 . . . . 0.0 110.717 171.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -76.73 -25.04 53.08 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 124.142 0.901 . . . . 0.0 112.079 -176.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 74.8 m -70.19 -35.76 74.16 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 126.22 1.808 . . . . 0.0 115.201 163.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 tp -68.49 -33.38 74.04 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 116.277 -4.014 . . . . 0.0 113.839 167.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -70.37 -43.01 71.03 Favored 'General case' 0 N--CA 1.45 -0.463 1 O-C-N 115.944 -4.223 . . . . 0.0 111.388 175.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.01 -11.22 27.03 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 174.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.421 ' HB1' HD23 ' A' ' 96' ' ' LEU . . . -60.86 157.12 42.16 Favored Pre-proline 0 N--CA 1.448 -0.536 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -61.2 153.23 66.43 Favored 'Trans proline' 0 N--CA 1.449 -1.09 1 C-N-CA 128.6 6.2 . . . . 0.0 115.27 160.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 31.2 m -78.7 -29.92 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 117.399 -1.72 . . . . 0.0 115.63 -165.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -61.38 -28.02 68.94 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.975 3.31 . . . . 0.0 112.651 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.421 HD23 ' HB1' ' A' ' 92' ' ' ALA . 30.0 tp -65.61 -48.72 71.31 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.921 2.088 . . . . 0.0 111.106 178.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 80.0 mtm-85 -74.98 -35.98 62.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.117 -2.864 . . . . 0.0 113.946 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -70.04 -17.8 63.27 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 119.079 -2.263 . . . . 0.0 110.519 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 43.8 t90 -91.09 -44.86 9.02 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 85.2 mt -57.88 -38.16 75.27 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -41.55 -41.46 2.14 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 119.297 3.073 . . . . 0.0 119.297 159.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -96.84 -26.71 15.01 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 123.018 1.39 . . . . 0.0 109.85 -162.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.5 t -86.35 -44.07 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 128.902 2.881 . . . . 0.0 111.531 174.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 30.6 mt -89.37 -45.1 9.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.766 -1.834 . . . . 0.0 114.611 -171.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.1 mt -103.2 -26.4 13.0 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -167.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -73.78 -6.31 46.19 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.688 -1.883 . . . . 0.0 111.911 177.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 38.9 m -69.32 -39.94 77.93 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 118.494 -2.629 . . . . 0.0 112.745 164.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 C--O 1.254 1.303 0 O-C-N 118.674 -2.516 . . . . 0.0 115.102 -171.771 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.433 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -51.17 -43.22 61.25 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 119.823 3.268 . . . . 0.0 119.823 -157.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -53.88 -24.82 17.22 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 119.644 3.202 . . . . 0.0 119.644 167.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 23.8 tp60 -85.56 -33.84 21.62 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 124.429 1.091 . . . . 0.0 109.497 -172.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . 0.282 65.9 m -76.74 146.72 76.85 Favored Pre-proline 0 N--CA 1.45 -0.46 1 O-C-N 114.899 -4.876 . . . . 0.0 109.367 -178.038 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -60.54 -45.21 22.73 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 125.206 3.938 . . . . 0.0 110.681 169.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . 0.417 ' CG ' ' N ' ' B' ' 8' ' ' SER . 63.5 t80 -110.51 154.75 23.24 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 122.147 2.249 . . . . 0.0 112.663 176.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . 0.417 ' N ' ' CG ' ' B' ' 7' ' ' TYR . 43.6 t -153.91 128.91 9.56 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 118.78 0.718 . . . . 0.0 112.752 166.288 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.47 -34.86 47.31 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 127.191 2.196 . . . . 0.0 111.545 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.05 -38.45 90.86 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 115.068 -2.396 . . . . 0.0 113.649 174.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 19.4 mtt -69.07 -35.24 76.31 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 126.983 2.677 . . . . 0.0 111.79 168.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.9 -32.25 69.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 122.565 2.438 . . . . 0.0 109.174 -175.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -73.51 -30.84 63.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 116.056 -1.926 . . . . 0.0 108.09 174.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -76.92 -31.47 56.69 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.794 1.179 . . . . 0.0 109.007 -175.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -71.0 -31.05 67.47 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 127.71 2.404 . . . . 0.0 113.517 173.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 45.3 t60 -66.61 -36.09 81.76 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.933 1.693 . . . . 0.0 112.186 164.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -83.63 -10.54 58.15 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 118.8 -2.437 . . . . 0.0 113.678 174.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -90.36 -23.31 21.13 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 118.3 -2.75 . . . . 0.0 110.12 171.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 1.8 t-105 -76.52 -34.96 58.55 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 120.097 1.317 . . . . 0.0 112.378 167.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 19.5 mt -70.11 -9.98 57.28 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 119.06 -1.056 . . . . 0.0 112.631 175.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -79.38 -32.28 43.07 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 129.024 2.93 . . . . 0.0 115.944 162.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -68.16 -29.84 68.81 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 115.066 -2.654 . . . . 0.0 112.939 163.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 98.1 t -73.37 -43.75 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 120.897 -1.127 . . . . 0.0 113.812 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -60.31 -52.72 64.05 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 171.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 14.4 tp -58.24 -34.87 70.92 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 114.737 -2.554 . . . . 0.0 110.994 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 55.5 tp -64.2 -57.07 10.57 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 128.762 2.825 . . . . 0.0 108.396 176.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.417 ' HE3' HE22 ' B' ' 31' ' ' GLN . 33.7 ttpt -47.04 -53.24 13.04 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 119.102 -2.249 . . . . 0.0 115.396 167.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -56.09 -40.82 74.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 117.7 -1.6 . . . . 0.0 110.507 177.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.28 -35.05 76.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.368 1.08 . . . . 0.0 113.471 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -60.61 -47.27 86.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 127.249 2.219 . . . . 0.0 111.963 173.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.417 HE22 ' HE3' ' B' ' 27' ' ' LYS . 40.8 mt-30 -56.87 -24.5 52.14 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 170.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -108.73 -3.45 17.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 131.264 3.825 . . . . 0.0 112.933 -171.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 61.17 35.67 18.4 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 126.463 2.352 . . . . 0.0 117.29 -174.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 18.8 mt -123.35 12.82 9.48 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 127.645 2.378 . . . . 0.0 116.219 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -59.9 -38.2 81.59 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 119.39 3.107 . . . . 0.0 119.39 175.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 2.0 mt -71.96 -48.15 11.11 Favored Pre-proline 0 N--CA 1.451 -0.414 0 O-C-N 124.728 1.268 . . . . 0.0 114.421 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -63.21 -27.83 72.73 Favored 'Trans proline' 0 N--CA 1.447 -1.218 0 C-N-CA 123.971 3.114 . . . . 0.0 112.528 172.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 31.6 tp -67.26 -47.26 71.25 Favored 'General case' 0 N--CA 1.449 -0.522 1 O-C-N 115.007 -4.808 . . . . 0.0 112.883 167.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 89.2 mt -65.43 -16.9 64.11 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.505 1.522 . . . . 0.0 115.066 170.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -81.92 -28.97 32.53 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 130.458 3.503 . . . . 0.0 110.332 166.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 60.5 tp -89.52 -26.24 20.99 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 118.776 -1.17 . . . . 0.0 112.956 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . 0.48 ' CE ' HG21 ' A' ' 58' ' ' VAL 0.259 15.4 mmt -95.97 -16.37 21.74 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 119.408 3.114 . . . . 0.0 119.408 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 31.9 mt -123.68 143.94 49.95 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.232 2.613 . . . . 0.0 109.797 174.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . 0.602 ' HB ' ' CD ' ' B' ' 45' ' ' PRO . 40.0 p -93.95 174.88 3.39 Favored Pre-proline 0 N--CA 1.452 -0.353 0 O-C-N 126.754 2.534 . . . . 0.0 112.134 177.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . 0.602 ' CD ' ' HB ' ' B' ' 44' ' ' THR . 37.4 Cg_exo -62.61 -46.42 11.6 Favored 'Trans proline' 0 N--CA 1.449 -1.1 0 CA-C-O 123.9 1.542 . . . . 0.0 112.714 -170.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -53.46 -40.6 65.4 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 116.108 -1.901 . . . . 0.0 115.329 172.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -75.36 -35.37 61.13 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 127.503 3.002 . . . . 0.0 117.305 -176.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 43.9 mtm-85 -65.73 -47.93 73.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.245 2.218 . . . . 0.0 109.444 173.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -63.95 -35.86 82.08 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 176.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.98 -50.9 71.94 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.011 1.724 . . . . 0.0 113.629 160.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 30.6 mt -56.62 -45.59 81.43 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 116.396 -1.764 . . . . 0.0 107.531 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.51 -39.8 75.49 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-O 126.104 3.058 . . . . 0.0 119.717 174.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.5 m -74.61 -35.48 62.94 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 110.565 -2.817 . . . . 0.0 111.749 173.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . 0.305 96.6 mtt180 -56.58 -32.08 64.87 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 123.611 2.914 . . . . 0.0 112.971 170.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . 0.415 13.6 t -51.2 -51.46 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 120.619 1.554 . . . . 0.0 109.712 166.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -76.1 -33.09 59.49 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 117.308 2.336 . . . . 0.0 117.308 -174.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.43 ' HA ' HD13 ' B' ' 75' ' ' LEU . 42.1 mt -68.26 -39.62 81.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 CA-C-O 114.376 -2.726 . . . . 0.0 104.82 173.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.279 53.4 t -77.5 -35.44 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 1 CA-C-N 127.647 4.748 . . . . 0.0 112.08 -179.66 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -60.44 -34.0 73.35 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 125.736 2.684 . . . . 0.0 117.946 165.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -83.73 -33.73 25.02 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 114.185 -2.816 . . . . 0.0 107.84 -176.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 27.2 mt -43.15 -46.44 5.91 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 124.424 3.283 . . . . 0.0 114.43 157.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 17.1 mt -83.01 -21.09 33.97 Favored 'General case' 0 N--CA 1.451 -0.424 1 N-CA-C 122.756 4.354 . . . . 0.0 122.756 172.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 32.2 ttm105 -69.23 -49.22 58.4 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 175.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.83 47.36 8.68 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 118.417 2.127 . . . . 0.0 118.417 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . 0.284 66.4 mm-40 -117.66 -37.1 3.52 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 116.937 -1.506 . . . . 0.0 108.485 -171.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 90.8 mtp -100.12 123.3 44.2 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 123.623 2.92 . . . . 0.0 113.736 -162.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 97.4 p -64.18 162.66 14.07 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 125.077 1.486 . . . . 0.0 113.669 173.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -45.08 -33.66 2.25 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 126.659 1.984 . . . . 0.0 115.147 165.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 56.3 ttt180 -67.73 -52.01 42.55 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 127.062 3.315 . . . . 0.0 108.884 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -53.5 -48.12 69.25 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 118.073 -2.892 . . . . 0.0 116.237 173.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 59.8 mt -57.18 -39.22 74.91 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 123.316 1.532 . . . . 0.0 111.548 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 32.3 tptt -77.25 -51.79 10.32 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 112.036 -2.347 . . . . 0.0 109.724 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -82.54 -4.03 56.92 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 117.002 2.223 . . . . 0.0 117.002 -169.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -137.03 -12.02 1.69 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 113.241 -1.8 . . . . 0.0 111.442 -169.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' B' ' 57' ' ' ILE . 26.8 mt -134.53 7.73 3.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 113.388 -3.196 . . . . 0.0 111.74 177.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 60.65 16.66 46.07 Favored Glycine 0 CA--C 1.522 0.488 0 C-N-CA 129.742 3.544 . . . . 0.0 112.013 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.07 108.92 18.38 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 121.731 3.975 . . . . 0.0 121.731 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.0 175.54 53.07 Favored Glycine 0 CA--C 1.523 0.577 0 O-C-N 119.317 -2.114 . . . . 0.0 113.857 -174.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 6.4 mt -50.34 -43.16 21.81 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 O-C-N 120.061 -1.847 . . . . 0.0 115.361 176.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.76 -38.87 90.24 Favored 'General case' 0 N--CA 1.446 -0.63 0 O-C-N 118.467 -2.645 . . . . 0.0 111.955 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 37.8 m -67.69 -52.04 42.56 Favored 'General case' 0 N--CA 1.444 -0.744 0 O-C-N 126.268 2.23 . . . . 0.0 109.223 -176.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 37.5 mm -65.91 -41.52 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-O 115.472 -2.204 . . . . 0.0 110.51 176.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 98.3 m -54.71 -65.63 0.54 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 124.034 3.107 . . . . 0.0 109.344 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -49.85 -42.03 46.57 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 117.215 2.302 . . . . 0.0 117.215 167.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -39.09 -60.86 1.51 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 118.634 2.214 . . . . 0.0 118.634 162.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 91.6 p -75.46 -21.06 58.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 128.902 2.881 . . . . 0.0 110.806 -175.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -71.54 -33.86 69.51 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 117.206 2.298 . . . . 0.0 117.206 163.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 2.4 m -72.7 -30.82 64.53 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 116.519 -1.705 . . . . 0.0 109.998 176.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 11.6 mt -59.59 -52.64 64.69 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 124.391 3.269 . . . . 0.0 116.473 166.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 50.5 tttm -63.81 -19.81 65.3 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -176.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.46 -22.1 32.68 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 114.842 -2.504 . . . . 0.0 116.892 167.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.99 151.01 97.58 Favored Pre-proline 0 N--CA 1.451 -0.394 0 CA-C-N 121.868 2.122 . . . . 0.0 114.629 -169.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . 0.274 52.4 Cg_exo -49.85 133.98 34.33 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 124.844 3.696 . . . . 0.0 114.154 163.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.418 HG12 ' NH1' ' B' ' 97' ' ' ARG . 22.4 m -73.41 -25.61 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -158.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 12.9 pm0 -62.09 -31.48 71.93 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 118.018 -0.992 . . . . 0.0 109.55 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 33.7 tp -74.27 -46.31 42.14 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 120.09 1.314 . . . . 0.0 107.472 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . 0.418 ' NH1' HG12 ' B' ' 94' ' ' VAL . 19.3 mtm-85 -59.26 -34.06 71.8 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -71.41 -27.28 63.19 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 116.554 2.057 . . . . 0.0 116.554 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 30.3 t90 -81.78 -50.1 9.63 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 131.454 3.902 . . . . 0.0 111.978 173.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 40.0 mt -69.29 -19.71 63.9 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 116.518 -1.706 . . . . 0.0 115.55 -170.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -60.29 -36.6 78.25 Favored 'General case' 0 N--CA 1.452 -0.355 1 CA-C-O 111.663 -4.018 . . . . 0.0 114.91 174.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -86.17 -36.88 19.24 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 123.574 2.897 . . . . 0.0 112.422 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 37.5 t -49.97 -61.74 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 126.292 1.837 . . . . 0.0 108.566 169.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 80.4 mt -78.16 -48.62 15.52 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 118.168 -1.413 . . . . 0.0 111.13 -165.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 57.4 mt -88.86 27.86 1.26 Allowed 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.886 -2.384 . . . . 0.0 110.642 -164.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -130.01 7.42 5.1 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 128.244 2.618 . . . . 0.0 111.983 171.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 71.2 m -87.73 -9.4 54.14 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.347 2.659 . . . . 0.0 115.098 163.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.683 2.793 . . . . 0.0 109.596 168.636 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 44.4 ttm . . . . . 0 N--CA 1.474 0.732 0 CA-C-O 117.787 -1.102 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.38 136.77 57.44 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.421 1.488 . . . . 0.0 110.296 175.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -104.27 163.15 12.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.969 2.508 . . . . 0.0 112.951 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -158.72 146.08 17.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 116.914 -3.616 . . . . 0.0 108.896 -169.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 59.0 p -154.66 173.81 4.44 Favored Pre-proline 0 N--CA 1.452 -0.326 0 C-N-CA 127.796 2.439 . . . . 0.0 117.512 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -69.62 -29.6 24.27 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 120.926 1.084 . . . . 0.0 113.412 171.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -150.1 145.99 26.66 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.696 2.398 . . . . 0.0 111.763 -171.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t -153.44 129.25 10.16 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 170.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.41 -24.98 67.7 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 114.783 -2.532 . . . . 0.0 112.138 176.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.27 -21.72 66.29 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 116.521 -1.704 . . . . 0.0 114.867 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 58.9 mtt -85.77 -34.35 21.18 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 127.179 2.799 . . . . 0.0 109.386 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.09 -33.06 75.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 123.347 1.546 . . . . 0.0 110.565 173.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -78.22 -23.75 47.32 Favored 'General case' 0 N--CA 1.449 -0.495 1 O-C-N 115.375 -4.578 . . . . 0.0 114.294 178.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -84.2 -38.11 20.99 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.685 -1.15 . . . . 0.0 111.797 175.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -37.78 82.42 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 118.603 0.638 . . . . 0.0 112.174 169.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -59.58 -35.68 74.76 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 116.637 -2.025 . . . . 0.0 113.762 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -75.04 -35.93 61.88 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 130.002 3.321 . . . . 0.0 110.056 -176.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -67.9 -50.53 55.68 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.559 1.144 . . . . 0.0 111.796 173.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 17.5 t-105 -58.39 -46.09 87.05 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 117.673 2.471 . . . . 0.0 117.673 167.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -66.11 -21.94 66.38 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 113.607 -3.092 . . . . 0.0 114.279 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -60.67 -44.76 96.1 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 122.148 2.249 . . . . 0.0 112.947 165.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -57.0 -44.03 82.33 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 128.108 2.563 . . . . 0.0 105.321 -176.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 34.2 t -67.2 -34.24 68.06 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 116.828 -1.558 . . . . 0.0 113.682 -177.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -84.19 -43.53 14.85 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 125.859 1.974 . . . . 0.0 109.139 -172.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 21.1 tp -56.97 -37.47 71.62 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 117.159 -1.4 . . . . 0.0 109.779 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 17.1 tp -76.83 -31.84 57.16 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 120.014 1.279 . . . . 0.0 109.529 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -59.2 -46.14 89.2 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 126.725 2.01 . . . . 0.0 114.989 169.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -60.96 -36.86 80.51 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 129.768 3.227 . . . . 0.0 113.644 176.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.28 -25.42 62.44 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 128.253 2.621 . . . . 0.0 114.271 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -61.52 -25.65 67.42 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.896 2.078 . . . . 0.0 112.754 169.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -93.44 -0.92 56.28 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 118.44 -2.663 . . . . 0.0 113.097 -174.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -134.97 18.42 3.47 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 120.759 1.618 . . . . 0.0 114.139 165.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 67.02 20.12 10.46 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.865 1.266 . . . . 0.0 113.885 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 94.2 mt -85.35 10.5 12.49 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 174.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -74.68 -40.11 61.59 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 118.243 -2.785 . . . . 0.0 112.872 -171.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.285 26.0 mt -62.61 -52.94 61.35 Favored Pre-proline 0 N--CA 1.446 -0.644 0 C-N-CA 129.405 3.082 . . . . 0.0 113.692 167.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -55.28 -41.93 73.51 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 N-CA-C 117.563 2.101 . . . . 0.0 117.563 170.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 64.0 tp -56.48 -37.85 70.93 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.132 1.373 . . . . 0.0 112.935 171.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 32.7 mt -92.08 -5.87 51.99 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -84.03 -21.51 31.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 126.463 1.905 . . . . 0.0 110.017 163.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 27.4 tp -83.26 -45.02 14.31 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 126.696 3.141 . . . . 0.0 116.524 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . 0.412 ' C ' HD12 ' C' ' 43' ' ' LEU . 3.9 mmt -87.2 -7.52 57.85 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 111.616 -2.538 . . . . 0.0 114.899 -162.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . 0.412 HD12 ' C ' ' C' ' 42' ' ' MET . 10.0 mp -137.28 161.09 37.18 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 127.247 2.219 . . . . 0.0 109.28 -175.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . 0.441 ' HB ' ' HD2' ' C' ' 45' ' ' PRO . 23.3 p -100.38 164.97 15.29 Favored Pre-proline 0 N--CA 1.449 -0.495 0 O-C-N 119.231 -2.168 . . . . 0.0 110.465 172.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . 0.441 ' HD2' ' HB ' ' C' ' 44' ' ' THR . 4.6 Cg_exo -41.28 -46.55 5.57 Favored 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 123.352 2.701 . . . . 0.0 115.036 171.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.75 -13.54 58.89 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 127.162 2.789 . . . . 0.0 115.286 -174.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -87.78 -30.22 20.42 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 131.229 3.812 . . . . 0.0 112.132 174.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 87.5 mtm-85 -71.33 -43.03 67.79 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 116.762 -1.589 . . . . 0.0 113.738 163.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -64.21 -23.69 67.4 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 125.083 1.489 . . . . 0.0 111.759 172.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.45 -50.36 70.07 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 127.652 2.381 . . . . 0.0 109.838 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 17.0 mt -77.57 -32.44 53.78 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 118.174 -2.828 . . . . 0.0 114.364 176.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.58 -44.73 85.93 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 118.677 -1.725 . . . . 0.0 115.157 164.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 26.9 m -73.15 -30.73 63.79 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 113.932 -2.937 . . . . 0.0 114.421 169.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 23.0 mtt180 -68.71 -36.14 78.06 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 125.891 3.95 . . . . 0.0 115.288 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 14.3 t -57.24 -36.54 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 129.253 3.021 . . . . 0.0 108.786 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 24.1 mtp180 -78.7 -24.07 45.22 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 121.49 0.662 . . . . 0.0 110.545 -176.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 61.8 mt -65.95 -49.4 77.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 O-C-N 117.691 -3.13 . . . . 0.0 108.174 174.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 96.6 t -53.57 -53.25 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 C-N-CA 128.512 2.725 . . . . 0.0 112.637 173.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -58.56 -39.3 79.9 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 125.433 1.493 . . . . 0.0 112.333 174.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -80.11 -37.33 33.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 120.927 1.694 . . . . 0.0 111.918 -177.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 80.8 mt -59.43 -36.8 76.58 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 169.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 70.8 mt -84.47 -36.2 22.46 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 125.05 1.469 . . . . 0.0 111.378 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' C' ' 63' ' ' ARG . 34.1 ttm180 -52.69 -60.76 2.87 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 117.579 -3.201 . . . . 0.0 110.357 173.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.7 49.29 6.19 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 130.65 3.976 . . . . 0.0 114.594 174.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -123.95 18.85 9.3 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 126.132 2.873 . . . . 0.0 113.372 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 14.5 mtt -116.45 131.91 56.82 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 117.07 -3.519 . . . . 0.0 110.015 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 54.2 p -95.37 162.78 13.52 Favored 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 132.424 4.29 . . . . 0.0 110.935 175.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -50.03 -33.28 17.63 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 116.65 2.093 . . . . 0.0 116.65 -169.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 36.4 ttp-105 -72.59 -40.03 66.89 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.032 0.933 . . . . 0.0 111.336 177.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -68.08 -36.95 80.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 172.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 48.3 mt -55.67 -37.73 68.68 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.072 1.749 . . . . 0.0 112.066 164.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . 0.363 83.7 tttt -66.75 -63.33 1.09 Allowed 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.114 0.566 . . . . 0.0 112.45 170.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -70.14 -42.56 72.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 115.284 -2.293 . . . . 0.0 111.154 -169.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -86.41 -48.81 8.11 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 122.391 2.359 . . . . 0.0 116.025 176.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.413 5.3 mp -74.28 -46.4 41.53 Favored 'General case' 0 N--CA 1.451 -0.377 1 CA-C-N 126.611 4.278 . . . . 0.0 113.62 -173.09 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.23 -160.74 52.55 Favored Glycine 0 C--N 1.338 0.639 0 C-N-CA 129.574 3.464 . . . . 0.0 113.12 -175.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -52.77 -27.77 19.42 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 116.352 1.982 . . . . 0.0 116.352 171.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.58 -19.19 26.21 Favored Glycine 0 C--N 1.338 0.661 1 CA-C-O 110.691 -5.505 . . . . 0.0 115.127 175.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 6.3 tt -55.36 -33.66 32.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 1 O-C-N 130.606 4.357 . . . . 0.0 110.683 176.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.54 -40.62 61.59 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.901 -2.999 . . . . 0.0 113.195 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 22.0 m -47.52 -30.53 3.58 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 116.907 2.188 . . . . 0.0 116.907 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 30.8 mm -109.32 -6.63 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 C-N-CA 128.318 2.647 . . . . 0.0 115.481 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.9 p -118.94 -17.58 9.03 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 118.483 2.771 . . . . 0.0 118.483 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -105.4 134.51 48.4 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.441 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 108.08 171.55 21.63 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 125.895 1.712 . . . . 0.0 114.584 168.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 89.3 p -65.94 -21.76 66.45 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 121.163 2.481 . . . . 0.0 116.868 -171.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 57.1 m-80 -95.45 13.44 25.92 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 127.136 2.772 . . . . 0.0 115.754 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 48.7 p -77.73 172.22 13.75 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 128.459 3.981 . . . . 0.0 113.607 -173.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 40.9 tp -59.91 -28.94 68.02 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 117.621 -3.174 . . . . 0.0 113.737 -165.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -108.2 13.04 26.15 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.214 -2.179 . . . . 0.0 111.4 -177.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -132.09 -33.86 1.3 Allowed 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -27.92 149.14 0.03 OUTLIER Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 127.514 2.326 . . . . 0.0 115.199 147.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -62.27 153.81 67.58 Favored 'Trans proline' 0 N--CA 1.45 -1.077 0 CA-C-O 125.577 2.241 . . . . 0.0 110.722 -175.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 47.8 t -69.08 -50.53 52.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 C-N-CA 129.91 3.284 . . . . 0.0 106.762 -172.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -46.19 -36.96 6.49 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 123.301 1.524 . . . . 0.0 113.277 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 23.1 tp -76.07 -43.26 44.49 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 117.443 -3.286 . . . . 0.0 108.474 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -66.1 -37.85 86.79 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 115.042 -2.409 . . . . 0.0 106.428 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -66.05 -55.81 14.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 128.707 2.803 . . . . 0.0 110.003 178.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -52.64 -47.36 67.11 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 128.193 3.433 . . . . 0.0 112.362 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 45.3 mt -61.31 -35.76 78.23 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 129.212 3.005 . . . . 0.0 111.913 173.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -72.21 -42.52 65.67 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 116.781 -3.699 . . . . 0.0 112.64 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -56.48 -47.23 79.69 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 129.52 3.128 . . . . 0.0 106.368 176.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 96.4 t -82.2 -62.12 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 124.631 2.158 . . . . 0.0 113.602 -173.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 69.0 mt -71.42 -14.64 62.22 Favored 'General case' 0 N--CA 1.443 -0.775 0 O-C-N 117.318 -3.364 . . . . 0.0 118.214 -172.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 70.6 mt -129.73 39.83 3.66 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 115.375 1.621 . . . . 0.0 115.375 -177.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 46.6 pttt -84.85 170.14 13.44 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 120.966 -1.084 . . . . 0.0 113.766 -173.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 59.4 m -134.3 62.83 1.64 Allowed 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 129.164 2.986 . . . . 0.0 112.682 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 57.6 t0 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 113.483 -3.151 . . . . 0.0 109.371 -176.981 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 48.0 ttp . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 101.184 -3.636 . . . . 0.0 101.184 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.4 159.05 44.62 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 123.691 0.796 . . . . 0.0 112.225 -143.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -142.08 132.81 25.57 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 125.355 1.659 . . . . 0.0 110.269 -176.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.97 132.96 35.65 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 111.532 -2.576 . . . . 0.0 113.085 175.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 61.2 p -77.8 128.99 77.77 Favored Pre-proline 0 N--CA 1.447 -0.624 0 CA-C-O 114.026 -2.892 . . . . 0.0 110.019 169.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -74.67 -54.97 0.08 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.039 0 CA-C-N 124.473 2.633 . . . . 0.0 108.127 -172.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -125.33 146.56 49.52 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-O 116.674 -1.632 . . . . 0.0 111.403 147.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 38.4 t -76.49 133.45 39.79 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 115.778 -2.058 . . . . 0.0 109.778 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.24 -15.3 0.89 Allowed 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 117.904 2.557 . . . . 0.0 117.904 162.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . 0.262 . . -81.95 -35.81 28.65 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 128.257 3.885 . . . . 0.0 113.727 177.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 2.0 mmm -79.59 -31.07 41.74 Favored 'General case' 0 N--CA 1.452 -0.34 1 O-C-N 116.177 -4.077 . . . . 0.0 113.182 167.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.45 94.94 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 118.205 -2.809 . . . . 0.0 112.793 173.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -46.3 -54.66 8.51 Favored 'General case' 0 N--CA 1.45 -0.425 1 CA-C-O 130.069 4.747 . . . . 0.0 115.953 165.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -64.67 -39.94 94.56 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 109.563 -3.471 . . . . 0.0 113.362 -169.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -16.23 63.08 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 176.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -85.0 -35.86 21.68 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -94.43 -29.36 15.01 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 126.603 1.961 . . . . 0.0 113.517 -166.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -69.02 -10.15 56.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 113.91 -2.948 . . . . 0.0 110.442 156.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . 0.35 2.7 t-105 -82.8 -38.04 23.67 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 124.4 3.273 . . . . 0.0 110.501 173.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' D' ' 20' ' ' LEU . 41.7 mt -71.14 -20.01 62.36 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 113.306 -1.77 . . . . 0.0 111.379 174.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 36.2 ttt180 -64.11 -35.34 80.45 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 121.356 1.889 . . . . 0.0 112.855 167.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -72.85 -47.2 48.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.591 1.957 . . . . 0.0 111.455 168.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . 0.439 18.4 t -58.25 -41.48 81.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 O-C-N 117.447 -3.283 . . . . 0.0 107.782 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -71.7 -31.66 66.99 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 176.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 22.6 tp -70.94 -36.59 72.66 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 123.587 1.661 . . . . 0.0 113.553 171.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 25.1 tp -68.51 -38.72 81.18 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 119.535 -1.978 . . . . 0.0 112.302 172.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 14.4 ttpp -58.75 -50.89 72.23 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.749 -3.095 . . . . 0.0 111.009 174.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -60.17 -21.08 61.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 O-C-N 119.181 -2.199 . . . . 0.0 115.677 175.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . 0.609 ' HB1' ' HA ' ' D' ' 35' ' ' HIS . . . -79.64 -46.47 17.13 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 127.004 2.122 . . . . 0.0 110.012 174.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -58.29 -21.8 50.29 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 121.706 2.048 . . . . 0.0 112.943 173.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -85.46 -14.68 45.35 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.156 1.382 . . . . 0.0 114.587 -171.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -128.3 10.12 6.23 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 120.163 -1.585 . . . . 0.0 113.915 173.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 52.45 38.14 24.59 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 -172.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 21.1 mt -99.2 16.9 21.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 119.175 3.028 . . . . 0.0 119.175 159.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . 0.609 ' HA ' ' HB1' ' D' ' 29' ' ' ALA . 18.1 p-80 -67.58 -60.88 2.2 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 130.319 3.448 . . . . 0.0 108.839 -171.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.98 -29.6 3.17 Favored Pre-proline 0 N--CA 1.449 -0.511 0 CA-C-O 116.372 -1.775 . . . . 0.0 114.104 -174.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.286 53.9 Cg_exo -68.13 -29.89 32.48 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 N-CA-C 116.044 1.517 . . . . 0.0 116.044 164.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 18.7 tp -71.77 -46.87 57.0 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 115.445 -2.217 . . . . 0.0 112.49 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 20.4 mt -55.28 -44.03 75.28 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 126.144 2.153 . . . . 0.0 116.577 170.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -77.32 -27.65 52.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.833 3.208 . . . . 0.0 112.153 -176.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 23.9 tp -54.39 -50.3 67.86 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 117.209 -3.432 . . . . 0.0 111.76 162.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 16.9 mmt -73.19 -39.42 65.61 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 119.604 3.187 . . . . 0.0 119.604 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 21.5 mt -114.52 129.73 56.69 Favored 'General case' 0 N--CA 1.447 -0.587 1 O-C-N 116.056 -4.153 . . . . 0.0 109.695 -167.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . 0.414 ' HB ' ' HD2' ' D' ' 45' ' ' PRO . 70.8 p -77.38 159.44 77.5 Favored Pre-proline 0 N--CA 1.449 -0.518 0 C-N-CA 126.526 1.93 . . . . 0.0 109.545 176.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . 0.414 ' HD2' ' HB ' ' D' ' 44' ' ' THR . 72.2 Cg_exo -46.37 -38.38 20.56 Favored 'Trans proline' 0 N--CA 1.449 -1.11 1 C-N-CA 125.982 4.455 . . . . 0.0 116.557 179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -76.2 -29.09 57.49 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 117.58 -3.2 . . . . 0.0 110.953 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -70.94 -43.85 67.32 Favored 'General case' 0 N--CA 1.446 -0.665 1 O-C-N 116.091 -4.13 . . . . 0.0 104.376 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 13.4 mtm-85 -61.69 -37.64 84.86 Favored 'General case' 0 N--CA 1.448 -0.54 1 O-C-N 114.985 -4.822 . . . . 0.0 114.012 169.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -69.88 -38.35 76.35 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 117.155 2.28 . . . . 0.0 117.155 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.11 -28.32 66.37 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 116.604 -1.665 . . . . 0.0 111.019 165.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . 0.271 21.3 mt -74.26 -39.46 62.99 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 123.921 3.055 . . . . 0.0 113.699 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -56.0 -39.51 79.51 Favored Glycine 0 C--N 1.333 0.385 0 CA-C-O 122.445 1.025 . . . . 0.0 113.885 167.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 73.7 m -80.17 -28.02 38.86 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 114.574 -0.813 . . . . 0.0 110.813 -174.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -71.04 -20.87 62.33 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 116.99 -3.569 . . . . 0.0 112.074 175.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 79.3 t -64.95 -45.52 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 166.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.579 2.7 ptm180 -68.74 -37.34 79.35 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 128.05 2.54 . . . . 0.0 115.698 173.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 27.8 mt -60.1 -46.21 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 119.945 -1.722 . . . . 0.0 108.3 172.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 47.0 t -66.0 -38.54 82.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 CA-C-N 122.669 2.486 . . . . 0.0 113.387 178.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -62.65 -40.9 98.49 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 117.343 -1.313 . . . . 0.0 109.179 -177.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -82.31 -22.92 35.41 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 115.189 -2.339 . . . . 0.0 108.32 -176.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 25.9 mt -62.65 -37.6 87.03 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 120.774 1.624 . . . . 0.0 111.219 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 32.1 mt -70.3 -43.63 69.99 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 125.653 1.846 . . . . 0.0 114.3 172.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . 0.37 32.0 ttm180 -74.1 -37.9 64.01 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 128.437 2.695 . . . . 0.0 111.744 -172.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 48.31 46.04 28.32 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 122.593 3.797 . . . . 0.0 122.593 170.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -126.94 -35.99 2.23 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 127.485 2.314 . . . . 0.0 110.032 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 20.5 mtt -74.7 51.1 0.46 Allowed 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 147.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 49.6 p -76.13 -172.88 2.18 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -173.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.333 35.5 tp60 68.23 -78.33 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 115.545 -2.169 . . . . 0.0 114.73 159.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 20.1 ttt85 -106.09 -35.76 7.14 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 128.918 2.887 . . . . 0.0 111.668 176.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -76.64 -18.4 58.61 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -168.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -38.61 65.34 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 124.591 1.182 . . . . 0.0 109.217 176.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mtmt -78.25 -21.79 49.35 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 118.181 -2.824 . . . . 0.0 115.941 172.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -121.8 -7.31 9.03 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 126.905 2.628 . . . . 0.0 113.503 -156.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -119.0 -41.02 2.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 128.489 2.716 . . . . 0.0 109.607 168.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -84.08 -29.1 27.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 119.246 0.93 . . . . 0.0 109.344 177.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 76.76 179.53 48.04 Favored Glycine 0 CA--C 1.523 0.545 0 O-C-N 118.899 -2.376 . . . . 0.0 114.296 157.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.06 -8.49 30.78 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.546 -2.738 . . . . 0.0 116.229 -148.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.75 -19.19 73.02 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-O 117.22 -1.878 . . . . 0.0 108.793 173.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 11.5 tt -47.95 -18.44 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 121.15 2.475 . . . . 0.0 114.715 167.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -105.2 -25.19 12.56 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 118.777 -2.452 . . . . 0.0 109.061 -168.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 7.6 m -64.6 -35.9 82.49 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 116.995 -3.566 . . . . 0.0 113.767 150.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 19.0 mm -82.64 -14.63 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 O-C-N 118.266 -2.771 . . . . 0.0 112.867 -171.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 77.6 p -120.68 -16.86 8.16 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.621 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -99.46 173.53 6.71 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 123.241 2.746 . . . . 0.0 106.811 169.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.01 151.67 26.9 Favored Glycine 0 C--N 1.337 0.612 0 O-C-N 119.979 -1.701 . . . . 0.0 113.566 178.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 5.7 p -69.46 -11.37 60.77 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 118.976 -2.485 . . . . 0.0 115.437 -151.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -150.27 42.46 0.84 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 127.164 3.364 . . . . 0.0 112.427 -176.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 1.4 p -64.2 168.82 5.07 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 127.42 2.288 . . . . 0.0 115.057 166.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.316 7.0 tt -64.16 -30.51 71.57 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 120.11 -1.619 . . . . 0.0 112.933 171.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 62.5 tttt -62.32 -38.46 89.54 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 127.581 2.352 . . . . 0.0 108.977 169.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -85.28 -27.27 26.09 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 120.477 -1.389 . . . . 0.0 111.383 -163.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . 0.738 ' HB1' HG22 ' D' ' 94' ' ' VAL 0.285 . . 62.67 77.79 0.32 Allowed Pre-proline 0 N--CA 1.447 -0.602 0 C-N-CA 127.075 2.15 . . . . 0.0 108.453 163.078 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . 0.471 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 95.8 Cg_exo 21.62 29.29 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.18 0 N-CA-C 122.223 3.893 . . . . 0.0 122.223 46.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . 0.738 HG22 ' HB1' ' D' ' 92' ' ' ALA . 2.9 t -57.09 -36.42 51.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 C-N-CA 130.717 3.607 . . . . 0.0 110.546 -171.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.61 -40.28 49.87 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 113.217 -1.81 . . . . 0.0 114.225 -176.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 48.3 tp -52.19 -53.15 46.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 130.667 3.587 . . . . 0.0 106.857 165.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -50.42 -45.63 55.86 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 116.103 1.89 . . . . 0.0 116.103 174.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -63.35 -32.31 73.7 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 128.373 2.669 . . . . 0.0 114.126 -176.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 77.2 t90 -80.85 -44.08 18.97 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 125.69 2.662 . . . . 0.0 114.47 -178.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 70.1 mt -61.94 -32.19 72.58 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 117.236 -3.415 . . . . 0.0 111.324 165.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -69.59 -19.58 63.66 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 118.902 2.927 . . . . 0.0 118.902 178.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -90.02 -44.93 9.51 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 119.164 -2.21 . . . . 0.0 108.856 171.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 37.6 t -84.42 -34.33 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 O-C-N 119.517 -1.99 . . . . 0.0 110.682 -168.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 64.2 mt -90.34 -34.41 15.7 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 117.848 -3.033 . . . . 0.0 110.225 -172.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 22.5 mt -91.2 15.58 11.57 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 128.494 2.717 . . . . 0.0 111.328 177.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 7.4 pttp -55.32 158.88 2.92 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 130.6 3.56 . . . . 0.0 108.294 154.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 75.1 m -116.4 23.26 12.22 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 116.854 -1.546 . . . . 0.0 109.812 -164.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 C--O 1.25 1.097 0 C-N-CA 129.409 3.084 . . . . 0.0 115.232 153.98 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 tmm? . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 116.194 1.924 . . . . 0.0 116.194 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -56.19 -32.11 64.05 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 116.845 2.165 . . . . 0.0 116.845 -171.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -62.46 -28.7 70.0 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 170.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -91.15 -5.53 54.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.599 -2.563 . . . . 0.0 116.27 175.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.5 p -88.36 166.0 25.6 Favored Pre-proline 0 N--CA 1.448 -0.573 0 CA-C-N 113.881 -1.509 . . . . 0.0 108.881 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -81.36 7.74 4.8 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 CA-C-N 121.502 1.572 . . . . 0.0 114.552 -175.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -142.72 164.1 31.01 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 113.853 -2.975 . . . . 0.0 110.569 -170.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.1 t -153.02 124.22 7.54 Favored 'General case' 0 N--CA 1.453 -0.324 1 O-C-N 129.162 4.039 . . . . 0.0 110.008 169.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.41 -20.05 59.15 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 116.709 2.114 . . . . 0.0 116.709 177.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.03 -54.67 22.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 129.882 3.273 . . . . 0.0 107.287 168.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 41.2 ttp -71.89 -40.2 69.06 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 113.949 -2.929 . . . . 0.0 111.915 -176.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -50.56 -48.36 57.44 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 121.731 2.06 . . . . 0.0 112.554 169.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.6 tp10 -67.86 -39.41 83.79 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 126.157 2.884 . . . . 0.0 113.471 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -62.72 -42.96 99.91 Favored 'General case' 0 N--CA 1.449 -0.491 1 O-C-N 116.196 -4.065 . . . . 0.0 112.239 -178.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . 0.3 22.6 mmt180 -74.38 -38.14 63.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 125.597 1.811 . . . . 0.0 111.723 -171.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -53.76 -40.52 66.27 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 161.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -40.98 96.47 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 117.422 -3.299 . . . . 0.0 111.998 177.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -60.73 -27.37 67.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 125.835 1.654 . . . . 0.0 112.395 177.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 8.6 t-105 -83.84 -49.52 8.97 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.777 1.631 . . . . 0.0 111.77 171.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.9 mt -58.17 -24.73 60.0 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.946 -1.721 . . . . 0.0 113.447 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -63.74 -45.16 91.12 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 114.527 -1.215 . . . . 0.0 112.013 173.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -61.26 -45.04 96.18 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 124.649 1.218 . . . . 0.0 109.52 172.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.5 t -60.55 -32.0 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 125.23 1.581 . . . . 0.0 111.58 -176.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.91 -38.01 69.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 118.841 2.904 . . . . 0.0 118.841 160.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 28.1 tp -57.54 -49.69 75.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.359 1.063 . . . . 0.0 110.263 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 54.0 tp -70.22 -31.45 68.88 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 113.645 -3.074 . . . . 0.0 113.998 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -61.58 -44.43 97.03 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 128.165 3.416 . . . . 0.0 111.527 168.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -71.33 -26.82 62.99 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 114.022 -1.444 . . . . 0.0 113.05 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.1 -40.56 78.31 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 118.887 -2.383 . . . . 0.0 112.215 167.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.429 ' CE1' ' CD2' ' A' ' 35' ' ' HIS . 53.8 m-85 -55.58 -40.53 72.1 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 116.454 -3.904 . . . . 0.0 113.999 159.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -64.0 -32.97 74.7 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.71 2.05 . . . . 0.0 112.359 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -109.09 10.68 25.99 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 128.376 2.671 . . . . 0.0 114.64 -172.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 63.65 25.26 14.22 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 124.191 1.948 . . . . 0.0 114.911 174.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.9 mt -107.14 20.98 18.24 Favored 'General case' 0 N--CA 1.449 -0.488 1 O-C-N 116.13 -4.106 . . . . 0.0 115.866 164.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.429 ' CD2' ' CE1' ' A' ' 30' ' ' TYR . 46.7 p-80 -67.62 -32.63 73.47 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.824 -3.048 . . . . 0.0 113.483 175.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.286 14.4 mt -73.0 -43.63 7.87 Favored Pre-proline 0 N--CA 1.448 -0.553 0 CA-C-O 114.636 -2.602 . . . . 0.0 110.588 176.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -59.19 -37.84 89.46 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 CA-C-N 123.195 2.177 . . . . 0.0 111.993 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.0 tp -64.34 -40.54 96.09 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 116.241 -1.837 . . . . 0.0 112.631 175.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.8 mt -77.5 -17.09 58.31 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 121.573 1.988 . . . . 0.0 114.661 -171.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -74.96 -29.89 61.05 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 169.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tt -88.44 -42.87 11.87 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.933 -2.461 . . . . 0.0 106.747 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.4 mmm -67.55 -25.01 65.6 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 113.474 -3.155 . . . . 0.0 118.433 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.2 mt -129.25 140.62 51.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 126.279 2.237 . . . . 0.0 109.435 177.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.2 p -72.44 157.35 89.24 Favored Pre-proline 0 N--CA 1.452 -0.369 0 C-N-CA 127.103 2.161 . . . . 0.0 111.608 175.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -51.18 -42.85 51.87 Favored 'Trans proline' 0 N--CA 1.447 -1.253 1 C-N-CA 127.51 5.473 . . . . 0.0 117.746 172.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -70.73 -39.81 73.15 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 116.49 -1.719 . . . . 0.0 115.543 169.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . 0.299 71.9 mt-10 -50.52 -54.26 23.72 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 168.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.7 mtm-85 -61.67 -41.91 98.2 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 117.584 -3.197 . . . . 0.0 112.352 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -73.3 -10.12 59.42 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 120.473 1.488 . . . . 0.0 108.607 -176.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -94.43 -35.15 12.46 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 119.469 -2.02 . . . . 0.0 113.425 170.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.8 mt -71.14 -24.63 62.3 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 178.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.03 -40.62 99.16 Favored Glycine 0 CA--C 1.526 0.767 0 C-N-CA 118.133 -1.984 . . . . 0.0 115.862 157.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 74.8 m -74.18 -29.55 61.81 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 118.634 1.217 . . . . 0.0 111.421 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -59.75 -29.18 67.98 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 116.513 -3.867 . . . . 0.0 112.213 171.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.8 t -75.74 -36.93 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-N 119.87 1.214 . . . . 0.0 109.512 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.2 mtp180 -59.1 -40.94 86.88 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 118.886 -2.384 . . . . 0.0 109.752 168.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.271 74.9 mt -65.18 -50.07 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 C-N-CA 126.163 1.785 . . . . 0.0 110.485 -177.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.3 t -65.1 -39.64 86.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 O-C-N 120.399 -1.438 . . . . 0.0 109.747 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -52.93 -55.37 23.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 121.51 1.959 . . . . 0.0 111.209 173.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -67.95 -22.72 65.03 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 117.159 -3.463 . . . . 0.0 110.638 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.8 mt -87.75 -24.4 23.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 177.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.311 29.3 tp -81.25 -22.94 38.35 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.999 2.12 . . . . 0.0 115.062 163.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . 0.292 45.7 ttm180 -77.57 -55.16 5.6 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.687 -2.508 . . . . 0.0 112.615 175.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.92 10.17 84.39 Favored Glycine 0 CA--C 1.521 0.432 1 N-CA-C 123.72 4.248 . . . . 0.0 123.72 -175.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.306 74.6 mm-40 -106.48 -24.4 12.22 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 116.602 2.075 . . . . 0.0 116.602 -172.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 38.7 ttm -78.27 126.43 30.78 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 126.418 2.324 . . . . 0.0 111.158 155.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.3 p -81.01 162.66 23.72 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 119.389 -2.069 . . . . 0.0 115.667 177.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -55.21 -35.29 64.71 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 120.67 1.577 . . . . 0.0 111.078 172.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.7 tpt85 -72.99 -21.75 60.79 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 119.122 -2.236 . . . . 0.0 110.318 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -86.79 -33.11 20.01 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 122.028 2.194 . . . . 0.0 110.428 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.3 mt -63.27 -30.88 71.94 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 118.62 -2.55 . . . . 0.0 109.45 -177.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -62.65 -31.15 71.97 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 128.594 2.758 . . . . 0.0 111.133 176.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -101.22 -37.58 8.47 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 121.72 2.054 . . . . 0.0 112.563 175.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -98.03 -20.53 17.33 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 119.149 -2.219 . . . . 0.0 110.412 -157.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.6 mt -114.27 -8.92 12.88 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 127.72 2.408 . . . . 0.0 110.018 162.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 86.73 10.56 72.57 Favored Glycine 0 CA--C 1.523 0.539 1 O-C-N 114.822 -4.924 . . . . 0.0 115.676 170.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -96.17 121.32 37.82 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 130.401 3.48 . . . . 0.0 115.894 -162.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.16 153.33 51.87 Favored Glycine 0 C--N 1.339 0.713 0 N-CA-C 118.79 2.276 . . . . 0.0 118.79 -176.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 14.5 mt -58.5 -34.92 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.425 0 O-C-N 117.036 -3.626 . . . . 0.0 114.202 -164.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.04 -34.06 50.73 Favored 'General case' 0 N--CA 1.452 -0.363 1 O-C-N 115.944 -4.223 . . . . 0.0 116.085 -168.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 48.3 p -78.14 -30.69 49.43 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 119.713 -1.867 . . . . 0.0 108.548 173.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . 0.286 14.5 mm -65.18 -48.17 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 O-C-N 126.04 2.088 . . . . 0.0 110.224 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 45.7 m -58.51 -43.73 89.21 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.047 -0.977 . . . . 0.0 112.824 170.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -61.14 -50.47 73.05 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 -176.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -59.96 -35.94 88.65 Favored Glycine 0 CA--C 1.524 0.64 0 CA-C-N 122.336 2.335 . . . . 0.0 113.097 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 71.0 m -60.93 -45.67 93.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -58.22 -43.4 87.68 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 117.139 -3.475 . . . . 0.0 114.784 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.0 m -63.85 -26.44 68.61 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 125.888 1.675 . . . . 0.0 111.421 176.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.3 tp -83.28 -35.33 25.38 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 113.114 -3.327 . . . . 0.0 109.015 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -70.34 -29.26 65.91 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 127.894 3.247 . . . . 0.0 112.662 170.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.74 3.01 56.41 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.667 1.187 . . . . 0.0 110.71 173.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.99 145.4 77.39 Favored Pre-proline 0 N--CA 1.447 -0.578 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.65 152.37 78.09 Favored 'Trans proline' 0 N--CA 1.451 -0.99 0 C-N-CA 117.17 -1.42 . . . . 0.0 114.628 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -57.76 -42.04 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-O 115.665 -2.112 . . . . 0.0 114.212 -174.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -48.11 -40.98 25.16 Favored 'General case' 0 N--CA 1.453 -0.289 1 O-C-N 130.585 4.928 . . . . 0.0 115.794 173.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 39.3 tp -75.71 -50.01 16.62 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.974 1.368 . . . . 0.0 111.248 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.8 mtm180 -57.02 -46.76 82.1 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 117.971 -2.956 . . . . 0.0 111.317 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -66.09 -34.51 78.22 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 120.467 -1.395 . . . . 0.0 111.128 -174.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 60.2 t90 -77.34 -34.69 55.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.425 -2.672 . . . . 0.0 109.336 -178.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 38.7 mt -78.66 -22.98 46.0 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 117.951 -2.968 . . . . 0.0 104.856 -174.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -63.59 -32.61 74.13 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 128.74 2.816 . . . . 0.0 111.733 170.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -87.78 -19.21 27.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 129.098 2.959 . . . . 0.0 112.431 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.8 t -101.37 -61.83 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 80.3 mt -87.4 -19.93 27.39 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 118.006 -2.934 . . . . 0.0 115.331 -162.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.2 mt -106.67 0.51 24.38 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 118.707 -2.496 . . . . 0.0 114.809 178.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.0 tttp -89.16 -3.27 58.66 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 117.669 2.47 . . . . 0.0 117.669 -176.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 4.8 m -111.33 -19.29 12.68 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 116.956 -3.59 . . . . 0.0 115.873 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 128.096 2.559 . . . . 0.0 112.537 -167.082 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? . . . . . 0 N--CA 1.472 0.656 0 CA-C-O 115.772 -2.061 . . . . 0.0 112.332 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.69 -4.77 50.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 125.6 3.818 . . . . 0.0 117.398 -160.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -81.59 -15.25 55.31 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 118.77 -2.456 . . . . 0.0 113.158 174.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 9.2 tp60 -93.75 -30.43 14.88 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 113.838 -1.528 . . . . 0.0 113.528 174.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.37 146.98 48.83 Favored Pre-proline 0 N--CA 1.447 -0.578 0 C-N-CA 117.933 -1.507 . . . . 0.0 112.617 -169.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.78 -12.51 26.5 Favored 'Trans proline' 0 N--CA 1.448 -1.179 1 C-N-CA 125.375 4.05 . . . . 0.0 113.06 -173.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -140.16 152.93 46.44 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 119.265 -2.147 . . . . 0.0 111.718 160.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 29.8 t -147.86 105.54 3.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 124.535 2.112 . . . . 0.0 111.319 177.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.44 -28.2 68.1 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 125.272 2.463 . . . . 0.0 114.577 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.87 -35.96 72.59 Favored 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 118.483 -2.636 . . . . 0.0 113.913 172.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 38.6 mtt -69.06 -35.32 76.43 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 121.681 2.037 . . . . 0.0 110.245 168.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.22 -35.87 80.23 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.048 0.928 . . . . 0.0 111.681 178.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -64.6 -52.99 54.64 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-O 115.715 -2.088 . . . . 0.0 112.632 164.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 42.6 tp60 -60.53 -28.09 68.14 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 123.598 2.908 . . . . 0.0 117.192 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -77.22 -38.3 51.59 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 126.333 2.968 . . . . 0.0 117.096 172.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -52.24 -51.72 56.71 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.007 -2.933 . . . . 0.0 107.812 169.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -53.79 -36.14 62.11 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 126.468 2.355 . . . . 0.0 115.301 166.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -76.92 -35.25 57.46 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 117.191 -3.443 . . . . 0.0 114.534 -175.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . 0.253 47.9 t-105 -57.68 -50.74 72.19 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.334 -1.479 . . . . 0.0 113.375 158.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 70.8 mt -68.41 -12.16 60.73 Favored 'General case' 0 N--CA 1.452 -0.375 0 O-C-N 116.841 -3.662 . . . . 0.0 110.219 -176.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -83.12 -26.42 31.03 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 122.477 2.399 . . . . 0.0 111.53 169.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -71.25 -42.17 69.18 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.021 160.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 53.6 t -69.02 -43.24 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 1 O-C-N 115.917 -4.239 . . . . 0.0 113.582 -178.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -63.87 -47.51 80.4 Favored 'General case' 0 N--CA 1.454 -0.265 1 C-N-CA 131.997 4.119 . . . . 0.0 111.643 169.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 52.6 tp -58.76 -40.86 85.16 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 120.606 1.548 . . . . 0.0 111.211 176.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 67.8 tp -72.27 -36.69 69.06 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 119.316 -2.115 . . . . 0.0 105.5 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpt -58.83 -47.8 83.56 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 116.27 -1.824 . . . . 0.0 108.176 175.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -76.97 -30.35 55.95 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 122.707 2.503 . . . . 0.0 114.314 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.8 -45.86 88.93 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 170.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . 0.264 41.0 m-85 -47.8 -39.39 18.07 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 119.73 3.233 . . . . 0.0 119.73 166.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -66.93 -35.59 80.33 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.724 1.21 . . . . 0.0 109.211 177.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -94.35 -0.7 54.74 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 123.24 1.495 . . . . 0.0 113.127 -173.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.334 8.3 m-20 56.6 36.52 27.75 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 127.726 2.411 . . . . 0.0 116.482 -166.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 61.8 mt -100.26 4.86 44.47 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 29.1 p-80 -61.48 -38.74 88.39 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 128.714 2.806 . . . . 0.0 116.232 -173.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 14.7 mt -70.04 -49.37 19.05 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-O 114.492 -2.671 . . . . 0.0 110.477 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -58.01 -33.32 97.09 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 O-C-N 125.758 2.452 . . . . 0.0 117.228 174.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 37.8 tp -74.62 -45.82 42.44 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 113.433 -3.175 . . . . 0.0 114.814 173.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 56.8 mt -54.24 -42.3 69.73 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 126.387 2.304 . . . . 0.0 115.927 168.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -62.45 -41.25 98.61 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 31.5 tp -72.47 -36.19 68.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-O 115.392 -2.242 . . . . 0.0 111.928 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 22.3 mmt -88.78 -19.46 25.99 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 115.656 -2.116 . . . . 0.0 112.52 -170.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 17.1 mt -134.99 146.11 48.75 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 126.761 2.538 . . . . 0.0 111.236 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . 0.641 ' HB ' ' HD2' ' B' ' 45' ' ' PRO . 30.0 p -88.18 158.1 49.95 Favored Pre-proline 0 N--CA 1.449 -0.482 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 -176.056 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . 0.641 ' HD2' ' HB ' ' B' ' 44' ' ' THR . 74.6 Cg_exo -36.58 -47.46 1.31 Allowed 'Trans proline' 0 N--CA 1.447 -1.207 1 C-N-CA 127.046 5.164 . . . . 0.0 115.823 173.317 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.89 -29.74 63.4 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 173.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -70.13 -42.49 72.52 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 126.903 3.24 . . . . 0.0 110.911 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -66.13 -51.37 58.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 118.452 -2.655 . . . . 0.0 112.967 178.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -55.45 -41.2 72.55 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.796 2.438 . . . . 0.0 114.457 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.0 -28.88 60.71 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 16.5 mt -67.11 -44.14 80.7 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 116.162 1.912 . . . . 0.0 116.162 169.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.86 -46.01 69.12 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.584 166.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 17.9 m -63.6 -51.96 62.98 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 113.834 -2.984 . . . . 0.0 107.627 -175.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -40.9 -33.82 0.34 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.585 2.754 . . . . 0.0 112.424 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 40.7 t -65.1 -42.17 93.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 CA-C-O 116.27 -1.824 . . . . 0.0 107.302 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 38.4 mtp180 -72.31 -33.06 67.09 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 120.172 1.351 . . . . 0.0 111.334 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 59.5 mt -54.17 -62.62 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 123.449 2.84 . . . . 0.0 112.007 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.338 77.1 t -66.7 -33.07 61.0 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 C-N-CA 126.212 1.805 . . . . 0.0 110.77 -170.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.93 -28.49 68.97 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 115.223 -2.322 . . . . 0.0 116.928 165.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . 0.291 20.7 tp10 -90.07 -27.36 19.73 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 127.929 3.268 . . . . 0.0 113.157 -179.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 56.9 mt -65.87 -30.41 71.01 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 114.989 -1.005 . . . . 0.0 112.153 166.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 24.0 mt -77.85 -41.74 35.92 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.126 1.371 . . . . 0.0 113.66 170.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 28.5 ttm105 -77.13 -64.07 1.22 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 115.144 -2.36 . . . . 0.0 113.612 -174.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.66 93.25 0.04 OUTLIER Glycine 0 CA--C 1.521 0.45 0 C-N-CA 129.847 3.594 . . . . 0.0 114.172 -165.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -134.48 -60.04 0.8 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 130.762 3.625 . . . . 0.0 114.505 168.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 38.6 mtt -64.08 139.27 58.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 115.875 1.805 . . . . 0.0 115.875 -164.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 82.9 p -72.45 161.5 30.73 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 118.124 2.639 . . . . 0.0 118.124 156.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -54.16 -32.5 55.53 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 117.677 2.473 . . . . 0.0 117.677 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 59.7 ttt180 -65.39 -46.77 78.75 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 114.614 -2.612 . . . . 0.0 111.046 173.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -62.48 -43.92 97.65 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 127.063 2.727 . . . . 0.0 116.795 172.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 70.3 mt -56.27 -39.67 73.01 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 117.765 -1.112 . . . . 0.0 112.092 174.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 42.8 tptt -83.84 -20.91 32.33 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 121.417 1.917 . . . . 0.0 112.648 -171.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -111.67 -34.98 5.89 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 115.57 -2.157 . . . . 0.0 109.113 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -91.29 -24.63 19.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 18.6 mt -112.35 -7.84 13.95 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 130.616 3.566 . . . . 0.0 111.375 169.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.59 18.67 72.19 Favored Glycine 0 C--N 1.336 0.564 0 CA-C-N 121.815 2.098 . . . . 0.0 114.556 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.03 130.1 46.99 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -165.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -82.85 165.91 44.34 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 128.265 2.84 . . . . 0.0 115.276 169.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 43.1 mt -61.43 -50.7 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-O 118.483 -0.77 . . . . 0.0 112.459 -170.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.13 73.65 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.004 1.483 . . . . 0.0 115.004 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 16.1 m -62.41 -44.37 96.59 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 116.244 -1.836 . . . . 0.0 111.03 174.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 36.2 mm -73.15 -38.97 56.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 CA-C-N 121.911 2.141 . . . . 0.0 112.449 -178.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 30.2 m -62.38 -45.52 92.76 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 125.199 1.4 . . . . 0.0 111.878 178.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -53.77 -26.05 21.79 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 130.502 3.521 . . . . 0.0 109.751 171.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.14 -43.96 62.13 Favored Glycine 0 C--N 1.337 0.617 0 CA-C-O 124.817 2.343 . . . . 0.0 116.392 177.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . 0.381 7.1 p -61.26 -39.88 91.99 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 117.81 2.522 . . . . 0.0 117.81 175.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -67.79 -25.89 65.82 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.191 2.182 . . . . 0.0 112.899 168.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 44.9 m -78.64 -41.34 31.68 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 103.792 -2.67 . . . . 0.0 103.792 -174.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 mt -68.84 -27.2 65.62 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 117.123 -3.486 . . . . 0.0 108.901 178.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -65.1 -46.22 81.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 124.334 3.243 . . . . 0.0 115.976 174.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.33 -4.28 50.15 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 108.678 -3.874 . . . . 0.0 114.85 174.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.23 156.39 81.42 Favored Pre-proline 0 N--CA 1.449 -0.479 0 CA-C-N 122.66 2.482 . . . . 0.0 114.512 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -59.99 129.88 32.25 Favored 'Trans proline' 0 N--CA 1.45 -1.045 1 C-N-CA 126.345 4.697 . . . . 0.0 110.353 164.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.253 2.7 m -72.29 -17.09 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 116.174 -1.869 . . . . 0.0 114.314 -171.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 13.8 pm0 -74.15 -21.86 59.68 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 125.445 1.715 . . . . 0.0 113.583 171.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.6 tp -70.32 -42.0 72.52 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 118.276 -1.37 . . . . 0.0 112.624 173.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 mtm180 -52.47 -51.64 58.32 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 128.113 2.565 . . . . 0.0 109.371 177.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -56.27 -41.93 76.62 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 114.056 -1.429 . . . . 0.0 112.385 172.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 17.1 t90 -70.59 -42.66 70.73 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 118.32 -2.738 . . . . 0.0 112.933 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' B' ' 100' ' ' LEU . 17.4 mt -78.03 -25.42 47.86 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 -168.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -49.6 -34.93 19.22 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.674 1.99 . . . . 0.0 113.296 158.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -100.4 -32.11 10.98 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 118.853 0.751 . . . . 0.0 112.643 -175.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 56.7 t -91.87 -8.91 10.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -177.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 40.4 mt -103.58 -43.39 5.39 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 120.293 -1.504 . . . . 0.0 114.302 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 57.5 mt -90.07 -24.7 21.08 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.848 -154.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.46 -11.79 60.58 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 113.574 -3.107 . . . . 0.0 111.356 168.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 51.2 m -76.08 5.58 6.52 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 123.533 2.879 . . . . 0.0 115.027 169.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 . . . . . 0 C--O 1.249 1.05 0 N-CA-C 121.58 3.919 . . . . 0.0 121.58 174.992 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 53.2 ttm . . . . . 0 N--CA 1.47 0.535 0 CA-C-O 125.853 2.74 . . . . 0.0 108.229 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -53.87 139.8 32.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 -159.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -100.95 126.17 47.58 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 116.955 -3.59 . . . . 0.0 116.413 -158.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -130.24 122.27 27.74 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 129.574 3.15 . . . . 0.0 111.589 -168.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 80.7 p -151.5 146.2 18.66 Favored Pre-proline 0 N--CA 1.45 -0.429 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -171.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -63.45 -30.58 72.11 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 122.751 2.3 . . . . 0.0 112.987 175.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -139.49 156.56 46.85 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 117.797 -3.064 . . . . 0.0 111.316 171.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 10.7 t -148.11 132.19 17.28 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.23 -1.804 . . . . 0.0 110.674 171.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.26 -28.06 59.68 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 116.846 -1.549 . . . . 0.0 112.164 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.23 -38.86 88.92 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.437 1.926 . . . . 0.0 112.757 172.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 57.3 mtt -70.27 -40.07 74.56 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.158 0.983 . . . . 0.0 108.796 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.45 -24.1 60.18 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 119.998 3.333 . . . . 0.0 119.998 174.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -71.56 -45.79 61.27 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.131 0.972 . . . . 0.0 110.605 163.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -59.16 -32.68 70.11 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 123.888 1.804 . . . . 0.0 111.817 174.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -38.94 65.55 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 117.466 -3.271 . . . . 0.0 113.782 169.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -54.16 -43.15 70.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 118.44 2.755 . . . . 0.0 118.44 164.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -69.21 -39.12 78.78 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 116.102 -1.904 . . . . 0.0 112.444 172.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -60.39 -43.03 97.02 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 116.172 -1.871 . . . . 0.0 110.152 174.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . 0.498 ' CZ2' ' HD2' ' D' ' 48' ' ' ARG . 19.9 t-105 -69.3 -40.89 77.4 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 122.179 2.263 . . . . 0.0 111.661 176.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.62 -17.01 64.03 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 119.255 -2.153 . . . . 0.0 114.728 173.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -65.7 -34.68 78.76 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 118.552 2.797 . . . . 0.0 118.552 159.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -59.24 -43.72 92.38 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 121.762 2.074 . . . . 0.0 115.583 176.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 11.7 t -56.9 -53.59 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 O-C-N 124.41 1.069 . . . . 0.0 112.606 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -75.1 -30.93 61.04 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 126.894 2.621 . . . . 0.0 110.747 -171.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 43.3 tp -67.94 -36.09 79.52 Favored 'General case' 0 N--CA 1.453 -0.321 1 O-C-N 116.061 -4.149 . . . . 0.0 112.531 170.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . 0.284 53.4 tp -74.62 -28.57 60.94 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 130.573 3.549 . . . . 0.0 108.339 174.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 16.1 ttpp -60.58 -34.33 74.03 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 124.858 3.481 . . . . 0.0 110.844 168.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -73.24 -36.88 66.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 125.787 2.708 . . . . 0.0 112.434 176.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.68 -24.4 58.78 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 112.852 -1.976 . . . . 0.0 113.331 -169.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -65.09 -21.42 66.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 119.442 -2.036 . . . . 0.0 111.797 171.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -71.78 -33.74 68.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 119.955 1.252 . . . . 0.0 113.065 -178.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -123.98 33.45 5.29 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 124.557 2.123 . . . . 0.0 115.379 178.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.34 0.5 OUTLIER 59.76 13.38 3.47 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 118.704 2.853 . . . . 0.0 118.704 178.01 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' C' ' 34' ' ' LEU . 18.0 mt -87.59 6.58 33.78 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 123.804 0.69 . . . . 0.0 110.399 -177.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 -67.71 -32.17 72.63 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.081 0.952 . . . . 0.0 110.239 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 5.8 mt -80.18 -50.44 1.16 Allowed Pre-proline 0 N--CA 1.453 -0.298 0 O-C-N 117.346 -3.346 . . . . 0.0 111.627 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -50.23 -44.32 39.01 Favored 'Trans proline' 0 N--CA 1.446 -1.273 1 C-N-CA 126.6 4.867 . . . . 0.0 112.629 171.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 33.2 tp -63.72 -51.31 65.53 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 121.562 -0.711 . . . . 0.0 112.448 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 75.7 mt -49.05 -34.76 14.2 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 121.377 3.843 . . . . 0.0 121.377 160.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -71.22 -25.52 62.53 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 121.036 1.744 . . . . 0.0 114.704 167.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 33.3 tp -76.19 -55.5 5.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 21.1 mmt -68.86 -35.17 76.6 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 123.752 1.739 . . . . 0.0 114.696 -165.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 3.8 mp -113.33 130.53 56.25 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 119.411 -2.055 . . . . 0.0 107.113 177.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 49.8 p -54.83 155.9 7.42 Favored Pre-proline 0 N--CA 1.448 -0.538 0 O-C-N 128.551 3.657 . . . . 0.0 111.931 164.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . 0.305 2.1 Cg_endo -54.86 -26.92 50.68 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 124.347 3.365 . . . . 0.0 116.466 168.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -61.65 -57.06 13.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 124.321 1.013 . . . . 0.0 111.148 166.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -65.39 -27.44 68.56 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 -178.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 69.8 mtm-85 -77.08 -47.3 20.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 123.133 1.444 . . . . 0.0 107.188 174.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -55.55 -36.72 67.1 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.586 -3.196 . . . . 0.0 113.61 171.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.16 -45.09 86.35 Favored 'General case' 0 N--CA 1.445 -0.678 0 O-C-N 119.852 -1.78 . . . . 0.0 112.679 176.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . 0.521 HD13 ' CE1' ' D' ' 22' ' ' PHE . 32.5 mt -65.12 -31.05 72.06 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 121.995 2.179 . . . . 0.0 111.918 175.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.71 -17.31 66.92 Favored Glycine 0 N--CA 1.444 -0.809 0 O-C-N 117.77 -3.081 . . . . 0.0 119.459 163.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 6.6 m -89.54 -43.53 10.74 Favored 'General case' 0 N--CA 1.45 -0.425 0 O-C-N 127.147 2.322 . . . . 0.0 109.069 178.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -67.44 -26.96 66.66 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 115.578 1.695 . . . . 0.0 115.578 175.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 4.6 t -62.75 -24.39 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 120.415 1.461 . . . . 0.0 111.066 168.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -97.81 -27.83 14.13 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 117.657 -3.152 . . . . 0.0 109.148 -175.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . 0.294 9.9 mt -49.23 -51.04 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 C-N-CA 127.045 2.138 . . . . 0.0 114.419 159.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 82.6 t -59.79 -64.12 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-N 113.482 -1.69 . . . . 0.0 109.839 170.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -43.87 -50.21 8.05 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 114.907 -2.473 . . . . 0.0 117.07 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -73.8 -19.24 60.81 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 112.798 -3.477 . . . . 0.0 115.712 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 16.4 mt -73.88 -36.15 64.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 128.333 2.653 . . . . 0.0 114.269 162.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 94.8 mt -73.02 -39.36 66.06 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.897 2.079 . . . . 0.0 111.318 169.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 38.0 ttm105 -70.31 -44.21 68.76 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 116.082 -1.913 . . . . 0.0 112.477 171.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.44 15.73 68.55 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 126.101 1.81 . . . . 0.0 116.425 171.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -85.26 42.45 0.95 Allowed 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 116.716 -3.814 . . . . 0.0 113.016 -177.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 46.6 mtt -125.36 143.69 50.85 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 117.509 2.411 . . . . 0.0 117.509 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 7.3 p -72.89 175.54 6.48 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 119.716 -1.865 . . . . 0.0 108.828 171.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -65.3 -34.9 79.44 Favored 'General case' 0 N--CA 1.45 -0.449 1 O-C-N 116.177 -4.077 . . . . 0.0 111.116 172.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 20.6 ttp-105 -55.98 -60.63 3.2 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 130.704 3.602 . . . . 0.0 110.525 172.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -60.25 -35.54 75.72 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 125.726 1.61 . . . . 0.0 115.291 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 48.5 mt -56.09 -51.84 66.46 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 125.705 1.878 . . . . 0.0 112.579 167.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 58.7 tttt -67.11 -33.12 74.78 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 118.132 -2.855 . . . . 0.0 113.356 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -95.61 14.34 23.26 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.973 -171.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -150.6 -40.06 0.13 Allowed 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 116.39 -3.944 . . . . 0.0 111.688 -165.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mp -84.29 -33.23 24.02 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.909 -1.12 . . . . 0.0 113.105 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 52.97 -159.29 3.54 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 115.34 -2.922 . . . . 0.0 117.832 -173.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.57 -18.61 62.45 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 120.483 3.512 . . . . 0.0 120.483 -174.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.7 -20.84 62.25 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 129.542 3.448 . . . . 0.0 114.039 172.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 19.3 tt -46.73 -29.88 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 126.656 2.033 . . . . 0.0 116.4 171.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -85.24 -8.47 58.53 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 129.563 3.145 . . . . 0.0 108.339 -173.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 70.0 m -76.46 -43.64 39.08 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.564 -3.21 . . . . 0.0 112.469 172.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 31.4 mm -81.99 -39.61 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 112.508 -2.133 . . . . 0.0 115.11 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . 0.292 13.9 p -95.72 -11.8 26.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 120.774 3.62 . . . . 0.0 120.774 -175.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 56.1 mtp85 -114.09 146.26 40.49 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 117.526 -3.234 . . . . 0.0 109.988 175.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 99.48 -175.91 28.42 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 129.724 3.535 . . . . 0.0 117.276 169.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 3.6 m -68.78 -21.21 64.36 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 126.57 1.948 . . . . 0.0 116.243 -168.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -101.81 -3.0 28.76 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 25.5 p -67.39 162.19 23.54 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 124.04 1.876 . . . . 0.0 112.167 -163.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 7.8 tp -52.82 -39.38 62.38 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 120.365 3.468 . . . . 0.0 120.365 -164.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.353 90.5 mttt -69.97 -28.9 65.92 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 118.693 -2.505 . . . . 0.0 116.551 168.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.49 -24.94 17.08 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -166.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.23 163.2 19.12 Favored Pre-proline 0 N--CA 1.447 -0.594 0 C-N-CA 128.148 2.579 . . . . 0.0 113.44 -159.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.62 134.46 46.73 Favored 'Trans proline' 0 N--CA 1.445 -1.377 0 CA-C-N 126.066 3.202 . . . . 0.0 112.069 176.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 18.1 t -53.17 -37.9 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 130.495 3.518 . . . . 0.0 109.384 -177.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 13.4 pm0 -79.01 -14.09 59.4 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 128.809 2.844 . . . . 0.0 113.353 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 37.2 tp -86.99 -47.51 8.89 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 118.971 -2.33 . . . . 0.0 111.76 166.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 34.4 mtp-105 -56.93 -43.41 81.46 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 113.03 -1.896 . . . . 0.0 114.2 171.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . 0.28 90.4 mt-30 -59.1 -26.56 64.77 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 117.135 -3.478 . . . . 0.0 117.543 168.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -86.17 -47.89 9.07 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 116.3 -4.0 . . . . 0.0 110.936 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 32.4 mt -53.07 -31.93 44.32 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 116.818 -3.676 . . . . 0.0 114.235 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -75.64 -31.25 59.75 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 122.47 2.396 . . . . 0.0 112.349 172.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -75.42 -22.18 57.6 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 125.178 2.418 . . . . 0.0 115.165 178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 39.2 t -98.34 -49.95 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 O-C-N 117.295 -3.378 . . . . 0.0 114.927 172.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 60.6 mt -82.42 -19.29 39.32 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 116.075 -1.917 . . . . 0.0 113.97 -171.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 88.0 mt -127.97 18.32 6.65 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 125.639 1.837 . . . . 0.0 109.456 -174.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . 0.401 ' HE3' ' OXT' ' C' ' 108' ' ' ASP . 47.5 pttt -47.23 155.4 0.31 Allowed 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 119.712 3.227 . . . . 0.0 119.712 178.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 15.0 m -109.46 22.91 15.17 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 119.661 1.118 . . . . 0.0 111.1 161.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . 0.401 ' OXT' ' HE3' ' C' ' 106' ' ' LYS . 3.3 t0 . . . . . 0 C--O 1.248 1.003 0 O-C-N 117.192 -3.442 . . . . 0.0 109.84 174.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ttt . . . . . 0 N--CA 1.47 0.538 0 CA-C-O 118.315 -0.85 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -132.23 146.07 51.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 118.397 0.544 . . . . 0.0 112.158 -173.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -100.97 148.27 25.21 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.518 1.527 . . . . 0.0 110.191 170.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 41.7 tt0 -109.28 156.44 19.94 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.088 -177.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 54.0 p -148.12 168.91 10.14 Favored Pre-proline 0 N--CA 1.453 -0.283 0 CA-C-O 115.213 -2.327 . . . . 0.0 113.602 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -82.07 -37.74 0.23 Allowed 'Trans proline' 0 N--CA 1.448 -1.185 0 C-N-CA 124.326 3.351 . . . . 0.0 114.42 -177.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -143.68 139.37 29.51 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 114.656 -2.592 . . . . 0.0 114.192 -172.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 14.5 t -59.24 123.95 18.38 Favored 'General case' 0 N--CA 1.451 -0.396 1 CA-C-N 126.513 4.233 . . . . 0.0 114.359 171.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.32 -28.85 69.6 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 128.313 2.645 . . . . 0.0 109.749 173.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.8 -50.33 51.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 130.889 3.676 . . . . 0.0 105.587 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 11.1 mmt -61.45 -37.4 83.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.7 -42.43 83.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 117.999 -1.0 . . . . 0.0 113.468 174.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -65.24 -62.47 1.52 Allowed 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 168.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -44.71 -30.83 1.01 Allowed 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 120.511 1.505 . . . . 0.0 114.841 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.385 0.0 OUTLIER -83.72 -14.74 50.93 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 118.789 -2.444 . . . . 0.0 116.569 -174.401 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -82.76 -32.8 27.63 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 127.249 2.22 . . . . 0.0 111.869 157.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -74.82 -40.46 61.07 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 126.044 2.09 . . . . 0.0 111.023 -175.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -69.9 -6.99 36.65 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 125.92 2.013 . . . . 0.0 115.678 169.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -85.27 -52.7 5.72 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 128.735 2.814 . . . . 0.0 110.715 170.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 65.6 mt -57.07 -18.5 14.65 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 118.996 2.962 . . . . 0.0 118.996 168.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 59.5 ttt180 -66.94 -31.2 71.63 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 127.531 2.332 . . . . 0.0 109.197 169.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . 0.521 ' CE1' HD13 ' C' ' 51' ' ' LEU . 86.5 t80 -87.59 -30.03 20.8 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 126.715 2.51 . . . . 0.0 108.89 179.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 81.5 t -65.78 -33.72 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 O-C-N 118.144 -2.848 . . . . 0.0 110.948 169.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -73.16 -46.07 52.95 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 127.918 2.487 . . . . 0.0 112.343 169.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 15.5 tp -56.74 -40.77 76.35 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 120.653 1.57 . . . . 0.0 113.626 175.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 tp -77.95 -39.54 42.29 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 115.744 -2.074 . . . . 0.0 114.849 175.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp -53.12 -57.24 11.12 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 122.362 2.346 . . . . 0.0 117.249 165.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -57.95 -32.81 68.19 Favored 'General case' 0 N--CA 1.446 -0.634 1 O-C-N 129.913 4.508 . . . . 0.0 111.456 173.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.48 -23.8 50.3 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 121.285 1.857 . . . . 0.0 113.525 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -64.34 -34.15 77.49 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 124.08 3.127 . . . . 0.0 110.72 162.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -89.23 3.5 51.79 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 129.677 3.191 . . . . 0.0 114.279 -173.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 57.3 p30 -135.28 13.68 3.53 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 119.331 0.968 . . . . 0.0 112.945 155.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.262 0.6 OUTLIER 54.24 38.6 29.62 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 117.114 -1.422 . . . . 0.0 111.471 -178.704 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 92.6 mt -86.0 13.68 7.27 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.404 2.366 . . . . 0.0 116.778 155.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.21 -47.7 55.86 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 125.395 1.478 . . . . 0.0 112.086 -164.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 3.6 mt -64.14 -52.32 56.12 Favored Pre-proline 0 N--CA 1.448 -0.53 0 CA-C-O 114.733 -2.556 . . . . 0.0 111.283 177.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.61 -34.21 14.74 Favored 'Trans proline' 0 N--CA 1.447 -1.233 0 C-N-CA 124.487 3.458 . . . . 0.0 116.642 166.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 51.9 tp -85.8 -34.04 21.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 116.863 2.172 . . . . 0.0 116.863 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 19.9 mt -71.34 -34.31 70.41 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 126.436 3.017 . . . . 0.0 111.676 169.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 19.5 m-20 -72.68 -35.31 67.64 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 117.626 -3.171 . . . . 0.0 111.913 174.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 14.6 tp -68.2 -38.72 82.27 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 123.746 1.736 . . . . 0.0 109.584 169.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.2 mmt -79.03 -38.15 37.26 Favored 'General case' 0 N--CA 1.452 -0.371 1 O-C-N 116.171 -4.081 . . . . 0.0 115.198 -176.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 17.2 mt -109.94 140.22 44.17 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.251 1.42 . . . . 0.0 112.839 -179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 64.0 p -68.51 168.12 15.73 Favored Pre-proline 0 N--CA 1.453 -0.282 0 C-N-CA 128.1 2.56 . . . . 0.0 112.451 167.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -57.8 -42.24 61.33 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.552 3.501 . . . . 0.0 115.831 177.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -81.99 -18.27 43.98 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 126.2 2.187 . . . . 0.0 114.791 -175.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -71.12 -44.21 66.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 170.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . 0.498 ' HD2' ' CZ2' ' C' ' 19' ' ' TRP . 41.1 mtm-85 -68.36 -40.42 81.47 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 171.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -59.06 -38.28 79.04 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 116.377 1.991 . . . . 0.0 116.377 167.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.329 . . -61.51 -43.23 99.24 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.956 -1.715 . . . . 0.0 113.135 168.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.27 -45.77 92.15 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.773 -1.829 . . . . 0.0 115.282 175.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.26 -40.12 91.28 Favored Glycine 0 CA--C 1.525 0.658 0 O-C-N 126.762 2.539 . . . . 0.0 114.279 169.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 8.1 m -61.7 -43.53 98.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.286 1.835 . . . . 0.0 114.661 166.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.274 96.7 mtt180 -59.69 -41.98 91.93 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 175.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . 0.426 ' H ' HG23 ' D' ' 55' ' ' VAL . 9.1 t -41.28 -59.87 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 O-C-N 120.316 -1.49 . . . . 0.0 113.851 164.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -72.32 -24.11 61.26 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -178.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 55.9 mt -71.0 -46.22 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 C-N-CA 127.338 2.255 . . . . 0.0 107.545 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . 0.322 18.7 t -62.68 -39.19 83.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 174.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -66.91 -52.1 47.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 119.666 -1.896 . . . . 0.0 111.57 170.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -62.38 -31.18 71.8 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 33.1 mt -61.28 -40.45 94.18 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 118.126 2.639 . . . . 0.0 118.126 167.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 42.1 mt -69.84 -34.47 73.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 116.953 -3.592 . . . . 0.0 111.241 167.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' D' ' 63' ' ' ARG . 30.5 ttm180 -64.96 -47.56 77.18 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 117.351 -3.343 . . . . 0.0 114.945 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 44.93 62.57 2.93 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-O 124.512 2.173 . . . . 0.0 116.884 -174.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -124.63 -35.37 2.74 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 118.0 -3.059 . . . . 0.0 112.888 170.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 28.6 mtt -75.97 58.75 1.21 Allowed 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 124.284 3.22 . . . . 0.0 106.797 155.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 88.5 p -82.3 168.1 17.92 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 119.542 -1.974 . . . . 0.0 113.785 -175.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.298 8.0 tp60 69.54 -53.62 0.6 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 120.842 3.645 . . . . 0.0 120.842 167.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . 0.285 74.1 ttt180 -120.92 -33.12 3.82 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.396 2.279 . . . . 0.0 112.567 171.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -79.77 -26.73 40.58 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 122.675 2.489 . . . . 0.0 112.557 -167.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mt -63.23 -52.78 60.82 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 123.949 0.9 . . . . 0.0 111.39 174.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -68.19 -26.55 65.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 116.604 -3.81 . . . . 0.0 115.156 173.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -109.86 -26.1 9.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 124.977 3.535 . . . . 0.0 118.502 -173.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -104.52 -44.9 4.78 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 116.422 -1.751 . . . . 0.0 115.599 176.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.77 -41.09 88.27 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 124.29 0.994 . . . . 0.0 110.666 158.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 93.6 -171.05 31.56 Favored Glycine 0 C--N 1.337 0.597 0 N-CA-C 116.827 1.491 . . . . 0.0 116.827 155.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -40.13 -32.39 0.17 Allowed 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 129.281 3.032 . . . . 0.0 117.357 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.73 -23.13 49.29 Favored Glycine 0 C--N 1.338 0.676 0 CA-C-O 116.52 -2.267 . . . . 0.0 118.334 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 6.5 tt -50.01 -16.25 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 131.163 3.785 . . . . 0.0 117.611 170.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . 0.276 . . -84.75 -42.46 15.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 116.546 -3.846 . . . . 0.0 114.052 174.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 96.8 m -59.17 -27.55 65.78 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 125.348 2.499 . . . . 0.0 111.754 171.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 39.0 mm -100.12 -25.32 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 O-C-N 120.204 -1.56 . . . . 0.0 112.262 -170.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 44.9 p -109.54 5.19 22.94 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 173.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 41.4 mtp85 -125.05 159.96 30.13 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.664 0.745 . . . . 0.0 109.844 172.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 87.98 151.66 22.58 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-O 125.247 2.582 . . . . 0.0 113.236 -170.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 35.7 p -84.68 2.47 41.63 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 109.58 -3.31 . . . . 0.0 116.971 -153.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -123.41 29.5 6.62 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.268 1.027 . . . . 0.0 112.888 159.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 2.1 p -63.16 173.86 1.34 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 117.198 -1.801 . . . . 0.0 114.571 169.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.6 -21.82 54.39 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 119.846 3.276 . . . . 0.0 119.846 163.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -78.49 -12.41 60.01 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 122.78 1.276 . . . . 0.0 113.328 169.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -123.75 1.07 8.76 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 113.331 -1.759 . . . . 0.0 112.536 -169.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . 0.472 ' HB1' HG22 ' D' ' 94' ' ' VAL . . . 39.55 95.86 0.04 OUTLIER Pre-proline 0 N--CA 1.451 -0.392 0 C-N-CA 127.727 2.411 . . . . 0.0 108.76 144.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . 0.47 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 84.9 Cg_exo 32.15 35.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.257 0 N-CA-C 119.587 2.88 . . . . 0.0 119.587 32.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . 0.472 HG22 ' HB1' ' D' ' 92' ' ' ALA . 39.8 t -60.32 -25.9 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-O 117.263 -1.351 . . . . 0.0 107.665 -176.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.9 -25.21 28.08 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 126.252 2.22 . . . . 0.0 110.886 -171.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 29.4 tp -72.42 -35.75 68.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 124.038 0.836 . . . . 0.0 113.092 162.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -62.61 -53.15 58.93 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 123.205 1.478 . . . . 0.0 113.789 176.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -51.88 -39.94 59.83 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 118.776 -2.453 . . . . 0.0 111.031 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -73.4 -33.39 64.97 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 120.44 -1.412 . . . . 0.0 108.298 -166.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 61.2 mt -81.11 -31.98 34.05 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -174.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -63.19 -31.12 72.18 Favored 'General case' 0 N--CA 1.447 -0.577 1 CA-C-O 111.471 -4.109 . . . . 0.0 109.828 175.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -89.76 -36.71 15.0 Favored 'General case' 0 N--CA 1.447 -0.578 0 O-C-N 126.727 2.517 . . . . 0.0 111.12 -177.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.377 41.8 t -78.8 -36.0 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 C-N-CA 128.508 2.723 . . . . 0.0 113.509 179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 60.5 mt -96.15 -39.09 9.87 Favored 'General case' 0 N--CA 1.447 -0.61 1 CA-C-O 111.285 -4.198 . . . . 0.0 108.109 -175.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 17.6 mt -90.93 14.74 12.96 Favored 'General case' 0 N--CA 1.452 -0.347 1 CA-C-N 127.333 4.606 . . . . 0.0 113.453 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -44.46 156.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 116.256 1.947 . . . . 0.0 116.256 162.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.91 -7.76 52.48 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 127.917 3.722 . . . . 0.0 117.148 -160.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 129.555 3.142 . . . . 0.0 109.434 -179.772 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 118.317 -0.849 . . . . 0.0 109.139 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -58.73 -60.65 3.49 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 116.333 -1.794 . . . . 0.0 114.051 -168.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -76.21 -11.83 59.99 Favored 'General case' 0 N--CA 1.451 -0.414 1 CA-C-N 126.722 4.328 . . . . 0.0 112.492 -174.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -82.43 -37.75 25.0 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 169.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 96.6 p -61.82 146.04 91.49 Favored Pre-proline 0 N--CA 1.45 -0.457 0 CA-C-O 113.813 -2.994 . . . . 0.0 115.224 172.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -80.68 -0.62 10.75 Favored 'Trans proline' 0 N--CA 1.452 -0.937 0 N-CA-C 119.704 2.925 . . . . 0.0 119.704 -170.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -144.17 143.07 30.92 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 129.616 3.166 . . . . 0.0 110.819 -171.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.9 t -113.76 120.0 39.29 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 113.419 -1.719 . . . . 0.0 114.426 162.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.63 -28.13 40.91 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 119.472 -2.017 . . . . 0.0 113.607 167.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.7 -53.56 45.85 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 116.856 -3.653 . . . . 0.0 114.108 166.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.6 ttp -61.97 -40.85 97.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.789 1.236 . . . . 0.0 111.216 -178.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.58 -54.44 45.9 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 114.931 1.456 . . . . 0.0 114.931 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -51.15 -44.04 61.34 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.229 2.611 . . . . 0.0 114.054 166.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -66.7 -41.02 88.7 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 113.317 -3.23 . . . . 0.0 111.951 173.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.9 mmt180 -67.47 -23.27 65.48 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 122.756 2.525 . . . . 0.0 112.647 168.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 25.1 t60 -71.82 -44.38 64.0 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 119.06 2.985 . . . . 0.0 119.06 177.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -56.15 -26.64 51.16 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 166.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -70.85 -36.9 73.07 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 123.308 2.776 . . . . 0.0 111.302 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -58.92 -42.6 90.09 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 125.944 1.698 . . . . 0.0 114.845 166.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.8 mt -70.3 -8.69 52.34 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.529 2.418 . . . . 0.0 117.529 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 -71.45 -36.74 71.35 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.784 1.633 . . . . 0.0 107.996 177.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -66.66 -51.24 58.39 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.977 1.711 . . . . 0.0 111.886 174.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 t -57.39 -41.07 77.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 117.952 2.575 . . . . 0.0 117.952 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -61.19 -50.45 73.1 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 118.29 2.7 . . . . 0.0 118.29 161.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.9 tp -58.28 -36.55 73.45 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 113.115 -1.857 . . . . 0.0 109.589 178.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 54.2 tp -72.98 -43.93 61.66 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 116.345 -1.788 . . . . 0.0 108.846 -177.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -44.62 -60.8 1.82 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.854 1.262 . . . . 0.0 109.42 167.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -71.32 -19.2 62.34 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -171.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.54 -33.06 62.66 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 117.708 -3.12 . . . . 0.0 111.861 173.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -63.43 -26.07 68.56 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 116.762 -1.59 . . . . 0.0 112.823 170.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -91.38 12.95 18.87 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 121.128 1.786 . . . . 0.0 111.48 -176.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -137.9 3.16 2.44 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 130.14 3.376 . . . . 0.0 112.695 173.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 61.77 32.12 18.29 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 120.564 -1.335 . . . . 0.0 111.765 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.274 28.6 mt -105.54 -0.78 25.51 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 126.045 1.738 . . . . 0.0 114.306 172.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 p-80 -58.35 -42.01 85.92 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 114.941 -2.457 . . . . 0.0 116.212 -176.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.292 6.5 mt -66.54 -47.89 56.45 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-N 123.281 2.764 . . . . 0.0 111.618 172.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -49.2 -46.63 25.05 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 122.496 2.13 . . . . 0.0 115.616 163.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . 0.265 26.4 tp -68.63 -41.23 79.74 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.986 1.374 . . . . 0.0 110.741 -177.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.8 mt -74.8 -14.36 60.68 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 117.975 -2.953 . . . . 0.0 116.862 175.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . 0.351 3.9 m-80 -72.44 -23.99 61.15 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 117.503 -3.248 . . . . 0.0 112.727 163.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.0 tt -85.7 -52.49 5.75 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 128.863 2.865 . . . . 0.0 112.808 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.323 83.4 mmm -68.42 -42.84 78.37 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 109.891 -3.322 . . . . 0.0 112.46 -168.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.9 mt -110.4 142.51 42.01 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.939 1.296 . . . . 0.0 109.406 -179.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 p -84.75 151.64 58.48 Favored Pre-proline 0 N--CA 1.447 -0.579 0 C-N-CA 127.888 2.475 . . . . 0.0 113.787 178.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -58.34 -40.71 73.07 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 CA-C-N 126.351 3.304 . . . . 0.0 116.756 -157.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -65.34 -16.31 63.46 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 116.901 -3.624 . . . . 0.0 113.483 172.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -87.64 -28.66 21.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 119.796 1.18 . . . . 0.0 112.711 169.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 38.0 mtm-85 -75.18 -44.93 43.83 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 124.523 1.139 . . . . 0.0 108.225 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.72 -38.48 69.79 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 116.341 1.978 . . . . 0.0 116.341 167.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.64 -37.95 62.63 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.451 HD22 ' CE2' ' B' ' 22' ' ' PHE . 73.5 mt -62.3 -32.98 73.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 114.796 -2.526 . . . . 0.0 115.058 166.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.72 -32.0 68.74 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 123.065 2.666 . . . . 0.0 109.614 168.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.1 m -89.62 -28.42 19.53 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 115.578 -2.449 . . . . 0.0 110.149 -164.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -62.48 -21.23 65.31 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 126.152 2.158 . . . . 0.0 111.244 174.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.81 -49.39 82.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 115.178 -2.344 . . . . 0.0 109.76 169.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -68.33 -24.66 64.86 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 126.272 2.233 . . . . 0.0 116.711 -178.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 55.8 mt -73.26 -47.57 46.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 116.539 -1.696 . . . . 0.0 109.267 168.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 17.1 t -65.12 -20.52 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 CA-C-N 122.784 2.538 . . . . 0.0 110.958 171.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -74.73 -49.84 19.62 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 117.982 -2.949 . . . . 0.0 109.64 167.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -79.39 -25.67 42.08 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 120.375 1.443 . . . . 0.0 111.168 -169.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.31 -43.1 98.78 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.081 1.352 . . . . 0.0 111.266 161.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 51.7 tp -76.29 -38.69 55.78 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 123.083 2.674 . . . . 0.0 109.037 -172.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.1 ttm105 -60.34 -31.68 70.54 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 117.254 2.316 . . . . 0.0 117.254 165.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 62.27 2.36 4.03 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 120.877 3.111 . . . . 0.0 120.877 177.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -85.48 -47.78 9.59 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 129.927 3.291 . . . . 0.0 110.695 -166.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 36.3 ttm -73.65 142.29 46.47 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 126.509 2.38 . . . . 0.0 110.484 167.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.2 p -102.27 170.1 8.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 119.581 3.178 . . . . 0.0 119.581 175.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -58.12 -38.14 75.94 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 113.707 1.002 . . . . 0.0 113.707 -174.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.1 tpt85 -63.48 -39.84 95.51 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 116.879 2.177 . . . . 0.0 116.879 175.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -70.73 -35.14 72.55 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 127.495 2.318 . . . . 0.0 113.493 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . 0.285 56.0 mt -63.15 -40.94 99.04 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 123.284 1.516 . . . . 0.0 111.795 175.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -63.5 -17.72 63.06 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 114.049 -2.881 . . . . 0.0 111.251 -175.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -89.63 -64.34 1.15 Allowed 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 120.54 1.518 . . . . 0.0 109.5 158.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -65.98 -21.0 66.38 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 118.472 2.768 . . . . 0.0 118.472 -159.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.5 mt -130.49 7.33 4.89 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.875 1.27 . . . . 0.0 110.77 168.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.33 31.73 80.32 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-O 114.852 -3.193 . . . . 0.0 113.132 173.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -94.21 118.48 31.64 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.084 2.554 . . . . 0.0 110.18 -168.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.09 125.78 38.48 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 128.655 3.026 . . . . 0.0 108.477 172.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 92.3 mt -54.84 -47.08 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 120.3 2.05 . . . . 0.0 112.055 -163.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -50.73 -41.0 55.9 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 122.197 2.271 . . . . 0.0 114.564 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 19.1 p -69.83 -25.89 63.97 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 127.61 2.364 . . . . 0.0 113.719 -174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 25.7 mm -76.5 -40.16 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 165.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.6 m -62.66 -31.36 72.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.695 -2.503 . . . . 0.0 109.21 -173.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -78.81 -40.05 33.97 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 124.878 2.275 . . . . 0.0 111.962 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -66.61 -26.14 72.87 Favored Glycine 0 N--CA 1.449 -0.491 0 O-C-N 119.653 -1.904 . . . . 0.0 114.393 175.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 15.5 m -64.45 -48.33 75.69 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.496 2.318 . . . . 0.0 112.807 171.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.461 ' HA ' ' HB2' ' A' ' 90' ' ' LYS . 75.2 m-20 -75.49 -21.08 58.35 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 114.711 -2.796 . . . . 0.0 114.514 173.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 18.3 m -73.69 -28.93 61.99 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 117.601 -3.187 . . . . 0.0 114.571 168.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.3 tp -77.52 -27.38 51.72 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 117.631 -3.168 . . . . 0.0 109.138 172.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.461 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 41.3 mttm -69.05 -20.43 64.11 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 112.138 -3.792 . . . . 0.0 108.398 166.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -99.37 -26.9 13.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 125.579 3.809 . . . . 0.0 119.27 177.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.27 140.81 97.75 Favored Pre-proline 0 N--CA 1.449 -0.481 0 O-C-N 125.685 1.866 . . . . 0.0 108.56 168.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -83.83 158.42 13.89 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 121.537 1.491 . . . . 0.0 111.974 -165.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.6 m -61.11 -35.08 63.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 114.572 -2.632 . . . . 0.0 112.887 178.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.446 24.2 pm0 -53.05 -33.7 53.12 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 122.409 2.368 . . . . 0.0 116.378 163.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 15.6 tp -81.69 -51.12 8.52 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.908 -2.995 . . . . 0.0 108.453 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.3 mtm180 -60.35 -49.67 76.67 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.385 1.564 . . . . 0.0 112.933 -173.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.03 -17.8 64.93 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 126.288 2.947 . . . . 0.0 114.05 -177.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -91.44 -27.64 18.16 Favored 'General case' 0 N--CA 1.447 -0.602 1 O-C-N 114.885 -4.884 . . . . 0.0 110.366 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 95.5 mt -68.65 -18.01 64.21 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 118.11 2.633 . . . . 0.0 118.11 161.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -67.06 -28.04 67.87 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 120.36 1.437 . . . . 0.0 111.676 176.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -82.82 -4.51 58.13 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 118.757 -1.177 . . . . 0.0 113.99 -176.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 42.5 t -114.0 -47.71 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 124.443 1.097 . . . . 0.0 113.25 -173.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.5 mt -97.42 -23.67 15.97 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.319 1.048 . . . . 0.0 111.611 -172.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 14.5 mt -112.59 -25.57 9.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.1 tttp -65.12 -24.79 67.52 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 122.245 2.293 . . . . 0.0 114.435 -165.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 71.2 p -110.31 6.76 22.69 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 119.893 3.294 . . . . 0.0 119.893 -160.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 . . . . . 0 C--O 1.253 1.252 0 CA-C-N 112.341 -2.209 . . . . 0.0 114.354 -167.937 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 116.914 -1.517 . . . . 0.0 113.031 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.04 -25.86 68.3 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 122.501 2.41 . . . . 0.0 112.604 -162.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -84.1 -29.47 26.76 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.051 0.841 . . . . 0.0 111.188 -172.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -78.68 -31.75 46.77 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 116.064 1.875 . . . . 0.0 116.064 170.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 19.8 m -81.59 143.57 51.27 Favored Pre-proline 0 N--CA 1.449 -0.513 0 C-N-CA 125.967 1.707 . . . . 0.0 112.06 -170.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -62.3 -32.81 81.82 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.711 2.274 . . . . 0.0 112.353 172.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -134.33 151.73 51.4 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 125.923 2.773 . . . . 0.0 118.174 173.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 20.4 t -143.1 121.47 12.34 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 118.34 -2.725 . . . . 0.0 109.054 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.77 -14.15 60.67 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.052 -1.655 . . . . 0.0 110.445 174.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.8 -36.36 25.67 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 116.767 2.136 . . . . 0.0 116.767 176.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 27.4 mtt -67.99 -36.1 79.43 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 122.228 2.285 . . . . 0.0 114.216 165.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.08 -49.37 60.8 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 118.216 2.673 . . . . 0.0 118.216 167.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 tp10 -57.48 -42.18 82.13 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 112.719 -2.037 . . . . 0.0 113.968 168.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -63.39 -42.49 98.8 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 112.657 -3.544 . . . . 0.0 112.028 176.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -69.88 -34.76 73.99 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 126.673 2.483 . . . . 0.0 114.405 174.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -60.61 -36.61 79.0 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.039 1.745 . . . . 0.0 110.998 170.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -83.85 -31.16 25.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 126.2 1.8 . . . . 0.0 109.635 -174.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -72.92 -34.22 66.46 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 115.491 -2.195 . . . . 0.0 107.902 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 5.2 t-105 -67.34 -25.81 66.18 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 122.329 2.331 . . . . 0.0 112.975 167.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 49.7 mt -65.18 -23.04 66.99 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 123.212 2.733 . . . . 0.0 115.095 176.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -72.49 -20.86 61.3 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 126.119 1.767 . . . . 0.0 113.208 174.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . 0.451 ' CE2' HD22 ' A' ' 51' ' ' LEU . 84.7 t80 -71.61 -47.87 51.76 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 117.571 -1.205 . . . . 0.0 112.11 168.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 33.8 t -61.96 -41.57 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 C-N-CA 126.439 1.896 . . . . 0.0 113.908 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -68.28 -45.18 73.78 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 173.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 37.2 tp -61.88 -42.28 98.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 -174.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 25.9 tp -76.21 -31.4 58.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.749 2.02 . . . . 0.0 108.628 -177.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt -50.41 -42.72 54.22 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 123.406 2.821 . . . . 0.0 112.767 168.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -89.38 -9.42 50.4 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 127.452 2.97 . . . . 0.0 115.102 -177.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.59 -42.85 21.54 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.826 2.05 . . . . 0.0 110.261 178.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -63.36 -34.94 78.8 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 118.041 -2.912 . . . . 0.0 107.262 170.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -75.77 4.36 8.09 Favored 'General case' 0 N--CA 1.453 -0.308 0 O-C-N 118.846 -2.409 . . . . 0.0 116.305 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -128.91 -1.03 5.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 113.889 -1.505 . . . . 0.0 110.235 168.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.417 46.5 m-20 64.7 23.04 12.71 Favored 'General case' 0 N--CA 1.447 -0.582 2 O-C-N 115.117 -4.739 . . . . 0.0 116.749 -168.33 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.278 83.4 mt -99.02 5.48 47.08 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.063 1.745 . . . . 0.0 111.793 174.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 14.3 p-80 -58.14 -54.31 48.36 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 124.797 1.239 . . . . 0.0 113.435 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 28.0 mt -62.88 -47.82 86.29 Favored Pre-proline 0 N--CA 1.448 -0.526 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.67 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -60.02 -24.03 75.17 Favored 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 124.497 3.465 . . . . 0.0 116.057 171.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . 0.329 43.2 tp -76.03 -52.07 10.97 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 125.594 1.809 . . . . 0.0 114.779 169.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . 0.307 17.3 mt -53.28 -49.69 66.42 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 124.925 1.391 . . . . 0.0 110.833 174.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -64.64 -17.77 64.34 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 119.898 -1.751 . . . . 0.0 112.831 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 12.0 tp -93.67 -30.28 15.0 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 9.0 mmt -84.05 -26.13 29.31 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 118.039 2.607 . . . . 0.0 118.039 176.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 5.0 mt -126.75 134.38 50.65 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 126.288 1.835 . . . . 0.0 111.688 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 81.5 p -85.17 160.3 54.99 Favored Pre-proline 0 N--CA 1.45 -0.434 0 C-N-CA 126.006 1.723 . . . . 0.0 107.758 176.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -52.11 -30.66 41.78 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 N-CA-C 121.111 3.466 . . . . 0.0 121.111 -172.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.62 -32.66 64.17 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 124.579 1.174 . . . . 0.0 110.788 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.33 -32.7 62.92 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 126.567 1.947 . . . . 0.0 109.339 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 -70.6 -45.04 66.03 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 127.663 2.385 . . . . 0.0 110.102 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -63.98 -38.36 90.79 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.6 1.56 . . . . 0.0 114.014 168.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.31 -53.56 56.9 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 120.632 1.56 . . . . 0.0 112.879 167.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 27.4 mt -52.22 -38.87 59.24 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 114.631 -2.604 . . . . 0.0 117.33 175.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.75 -56.65 24.11 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 127.679 2.561 . . . . 0.0 111.768 166.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 13.6 m -74.67 -22.82 58.68 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 124.419 2.057 . . . . 0.0 113.927 -169.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 58.8 mtt180 -58.38 -37.14 74.64 Favored 'General case' 0 N--CA 1.449 -0.486 1 O-C-N 114.887 -4.883 . . . . 0.0 113.352 169.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 97.9 t -68.91 -36.81 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 C-N-CA 124.057 0.943 . . . . 0.0 109.757 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -75.72 -33.3 60.29 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.038 -1.039 . . . . 0.0 110.304 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 54.0 mt -69.62 -47.14 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 120.401 1.455 . . . . 0.0 110.611 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.258 59.5 t -74.86 -21.01 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 O-C-N 124.479 1.112 . . . . 0.0 113.527 177.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -72.44 -38.53 68.29 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 119.286 -2.134 . . . . 0.0 113.01 175.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -61.71 -30.62 70.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 124.562 1.145 . . . . 0.0 109.127 171.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 1.1 mt -78.49 -26.19 45.93 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 117.893 -3.004 . . . . 0.0 111.153 -177.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 89.4 mt -83.93 -19.92 33.86 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 119.606 3.188 . . . . 0.0 119.606 166.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 23.5 ttm105 -89.53 -71.75 0.59 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 115.976 -1.964 . . . . 0.0 111.022 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.59 75.11 1.22 Allowed Glycine 0 C--N 1.335 0.478 0 C-N-CA 125.928 1.728 . . . . 0.0 109.68 -171.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -140.5 9.62 2.24 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 121.04 2.42 . . . . 0.0 112.338 173.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 22.1 mtt -119.02 143.77 46.9 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 116.368 -3.957 . . . . 0.0 114.266 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 26.7 p -77.61 162.25 27.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 130.71 3.604 . . . . 0.0 112.739 164.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . 0.258 45.4 mt-30 -67.08 -33.5 75.63 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 116.894 2.183 . . . . 0.0 116.894 -171.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -58.86 -45.31 90.45 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.739 2.496 . . . . 0.0 117.739 160.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -59.71 -36.9 77.46 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 121.075 1.761 . . . . 0.0 112.53 171.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.417 HD23 HD12 ' B' ' 75' ' ' LEU . 90.9 mt -63.49 -33.04 74.7 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.458 175.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -84.72 -31.5 24.02 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.91 2.084 . . . . 0.0 112.956 -177.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 32.6 m120 -130.54 -19.69 3.01 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 117.61 -3.181 . . . . 0.0 114.422 -167.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -87.17 -13.37 44.2 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 160.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.417 HD12 HD23 ' B' ' 71' ' ' LEU . 96.6 mt -132.56 -43.74 0.91 Allowed 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.671 -3.143 . . . . 0.0 114.848 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 98.69 4.04 57.09 Favored Glycine 0 CA--C 1.522 0.476 0 CA-C-O 124.136 1.964 . . . . 0.0 110.257 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.72 80.02 6.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 117.218 -3.519 . . . . 0.0 113.066 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.42 -179.33 5.22 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-O 126.593 3.33 . . . . 0.0 110.97 159.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 45.5 mt -61.68 -40.5 86.98 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 O-C-N 117.354 -3.439 . . . . 0.0 112.407 -168.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.15 -44.26 87.77 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 120.667 -1.271 . . . . 0.0 114.208 171.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 21.6 m -66.43 -34.83 78.83 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.927 1.291 . . . . 0.0 114.121 -178.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mm -81.36 -41.01 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 115.278 -2.296 . . . . 0.0 106.731 -177.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 4.7 m -64.25 -47.54 79.24 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 131.256 3.823 . . . . 0.0 113.055 174.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 19.4 ttt180 -57.59 -51.09 70.89 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 117.237 -1.785 . . . . 0.0 114.691 167.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -45.63 -44.87 12.33 Favored Glycine 0 C--N 1.334 0.471 0 CA-C-O 115.508 -2.829 . . . . 0.0 114.94 173.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 4.3 p -77.86 -36.93 49.3 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 126.542 1.966 . . . . 0.0 112.37 -176.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -62.63 -37.57 86.83 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 106.552 -1.648 . . . . 0.0 106.552 175.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 68.5 m -67.31 -29.03 68.5 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 126.934 3.254 . . . . 0.0 114.712 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 70.6 mt -77.7 -38.44 47.38 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 117.706 -3.121 . . . . 0.0 116.377 173.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 52.6 tttm -64.48 -41.76 96.28 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.309 1.444 . . . . 0.0 108.801 168.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.15 -23.08 62.94 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 118.591 -2.568 . . . . 0.0 113.474 177.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.41 147.56 98.56 Favored Pre-proline 0 N--CA 1.448 -0.575 0 CA-C-N 121.6 2.0 . . . . 0.0 113.474 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -72.03 162.11 42.79 Favored 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 123.989 3.126 . . . . 0.0 113.315 167.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 28.0 m -82.86 -16.31 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 1 O-C-N 115.586 -4.446 . . . . 0.0 117.274 -170.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -65.24 -8.15 16.28 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.779 1.632 . . . . 0.0 114.23 163.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 31.7 tp -112.66 -52.14 2.8 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 104.457 -2.423 . . . . 0.0 104.457 -177.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . 0.275 17.8 mtp180 -58.16 -37.29 74.41 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 124.437 1.086 . . . . 0.0 112.42 -175.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -79.41 -33.91 42.24 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 127.281 2.233 . . . . 0.0 112.822 178.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 81.3 t90 -71.59 -39.39 70.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 121.284 -0.885 . . . . 0.0 112.359 176.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 86.8 mt -63.3 -30.34 71.49 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.659 170.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -54.73 -40.75 69.59 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 119.192 3.034 . . . . 0.0 119.192 169.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -97.09 -1.61 44.91 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 125.521 1.528 . . . . 0.0 113.797 -170.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 25.8 t -113.59 -36.9 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 O-C-N 118.226 -2.797 . . . . 0.0 109.174 176.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 55.7 mt -84.26 -75.71 0.33 Allowed 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 119.979 -1.701 . . . . 0.0 107.18 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 20.9 mt -47.73 -41.1 22.17 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 -165.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.01 3.32 4.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 115.048 -2.406 . . . . 0.0 113.674 178.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 56.4 m -94.92 9.12 40.5 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 115.213 1.561 . . . . 0.0 115.213 166.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 . . . . . 0 C--O 1.251 1.146 0 O-C-N 117.709 -3.12 . . . . 0.0 115.433 164.584 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 22.6 ttt . . . . . 0 N--CA 1.471 0.576 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.66 172.58 10.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 118.097 2.629 . . . . 0.0 118.097 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -89.67 152.27 21.45 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 66.3 tt0 -130.66 141.13 50.41 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 120.623 1.556 . . . . 0.0 113.464 155.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 7.9 p -124.74 148.73 60.23 Favored Pre-proline 0 N--CA 1.448 -0.53 0 O-C-N 120.076 -1.64 . . . . 0.0 114.567 -173.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -67.18 -19.8 50.35 Favored 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 122.259 1.973 . . . . 0.0 115.848 169.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -156.02 148.48 23.72 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 128.546 2.738 . . . . 0.0 111.36 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.8 t -147.81 127.72 13.56 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 125.301 1.626 . . . . 0.0 113.021 174.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.78 62.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 126.953 2.658 . . . . 0.0 110.807 177.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.53 -22.48 63.57 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 129.368 3.067 . . . . 0.0 114.034 167.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 23.0 mtt -81.57 -44.3 17.48 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 118.123 -2.861 . . . . 0.0 113.202 164.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.55 69.18 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 118.998 2.962 . . . . 0.0 118.998 177.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -76.62 -38.67 54.33 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 113.808 -1.542 . . . . 0.0 113.213 168.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -56.54 -43.41 79.86 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.909 -2.369 . . . . 0.0 113.9 170.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -47.74 83.86 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 130.107 3.363 . . . . 0.0 113.538 168.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -45.78 -49.36 15.08 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 117.275 2.324 . . . . 0.0 117.275 162.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 86.3 mm-40 -69.9 -33.98 72.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 176.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.22 -27.7 67.45 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 115.955 -2.298 . . . . 0.0 113.462 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 56.2 t-105 -73.13 -52.75 13.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 126.671 1.988 . . . . 0.0 112.869 169.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . 0.272 1.0 OUTLIER -62.03 -18.91 62.11 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 115.551 -2.166 . . . . 0.0 110.085 178.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -81.55 -44.23 17.61 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 114.935 -2.46 . . . . 0.0 112.644 176.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -48.89 -38.84 23.78 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 118.629 2.826 . . . . 0.0 118.629 171.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 43.7 t -75.04 -34.65 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 C-N-CA 127.526 2.33 . . . . 0.0 113.673 177.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -74.86 -39.54 61.5 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 122.662 2.483 . . . . 0.0 115.908 172.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 37.4 tp -55.59 -34.18 64.61 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 117.631 -3.168 . . . . 0.0 114.661 169.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . 0.283 30.5 tp -71.72 -32.52 67.86 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 126.52 1.928 . . . . 0.0 113.166 170.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -69.15 -34.3 74.76 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 125.603 1.814 . . . . 0.0 111.911 172.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 30.1 m-20 -73.17 -38.17 66.27 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 116.448 -3.907 . . . . 0.0 109.627 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.4 -32.64 65.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 128.723 2.809 . . . . 0.0 118.171 176.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -68.11 -18.25 64.59 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.642 1.977 . . . . 0.0 115.341 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -76.08 -23.32 55.0 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -174.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 19.5 p-10 -141.06 39.08 1.78 Allowed 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 127.417 2.287 . . . . 0.0 112.432 -166.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.345 0.8 OUTLIER 31.86 46.86 0.06 Allowed 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 118.405 2.743 . . . . 0.0 118.405 -176.073 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 27.3 mt -99.3 -2.49 36.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 116.619 2.081 . . . . 0.0 116.619 163.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 -58.28 -49.73 76.11 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 126.726 3.155 . . . . 0.0 110.875 -174.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 18.6 mt -74.03 -41.1 5.16 Favored Pre-proline 0 N--CA 1.447 -0.604 0 O-C-N 116.325 -3.985 . . . . 0.0 110.633 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -56.93 -39.87 88.25 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 124.26 3.306 . . . . 0.0 108.536 170.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 54.7 tp -77.96 -29.14 49.68 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 117.554 2.428 . . . . 0.0 117.554 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 51.5 mt -67.03 -23.31 65.89 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 117.254 -1.355 . . . . 0.0 113.758 161.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -91.31 -25.12 19.59 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 118.773 -1.171 . . . . 0.0 111.605 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 14.7 tp -60.32 -54.34 46.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 119.029 -2.294 . . . . 0.0 112.038 159.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 21.5 mmt -72.05 -36.92 69.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 119.169 3.025 . . . . 0.0 119.169 -171.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 5.2 mp -105.66 144.21 32.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 117.837 2.532 . . . . 0.0 117.837 -175.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 67.0 p -78.38 161.7 69.02 Favored Pre-proline 0 N--CA 1.448 -0.527 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 166.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -47.8 -43.31 29.39 Favored 'Trans proline' 0 N--CA 1.447 -1.255 0 C-N-CA 124.81 3.673 . . . . 0.0 112.725 166.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -58.0 -42.49 85.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 172.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -68.6 -35.43 77.33 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 127.296 3.427 . . . . 0.0 114.239 -174.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 39.5 mtm-85 -73.52 -37.64 65.58 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 118.901 -2.374 . . . . 0.0 111.735 172.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -66.04 -36.59 83.64 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 125.444 1.715 . . . . 0.0 114.818 170.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.08 96.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 128.998 2.919 . . . . 0.0 107.975 177.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 57.4 mt -84.86 -31.73 23.61 Favored 'General case' 0 N--CA 1.445 -0.686 0 O-C-N 117.19 -3.444 . . . . 0.0 111.969 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.52 -37.85 50.38 Favored Glycine 0 CA--C 1.526 0.725 0 O-C-N 126.768 2.542 . . . . 0.0 115.049 158.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 25.8 m -77.49 -40.11 44.08 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 33.5 mtt180 -72.99 -24.95 60.83 Favored 'General case' 0 N--CA 1.448 -0.525 1 CA-C-O 110.55 -4.548 . . . . 0.0 113.405 -173.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 80.3 t -62.54 -41.93 93.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-N 122.623 2.465 . . . . 0.0 111.991 163.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -76.06 -29.58 58.05 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 118.574 2.805 . . . . 0.0 118.574 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 63.5 mt -59.14 -42.1 85.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 O-C-N 118.805 -2.434 . . . . 0.0 111.942 166.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 66.8 t -59.41 -49.26 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 C-N-CA 126.176 1.791 . . . . 0.0 111.591 174.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -64.51 -38.5 91.24 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 113.172 -1.831 . . . . 0.0 110.585 -172.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -73.08 -33.7 65.77 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 117.391 -3.318 . . . . 0.0 114.93 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 87.1 mt -76.36 -13.57 60.13 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 169.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 55.7 mt -93.07 -15.92 25.56 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 120.738 1.608 . . . . 0.0 108.759 170.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -94.41 -34.91 12.57 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 120.51 1.505 . . . . 0.0 113.121 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.71 3.9 74.48 Favored Glycine 0 C--N 1.339 0.739 1 CA-C-O 110.552 -5.582 . . . . 0.0 113.827 165.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -93.24 58.36 2.85 Favored 'General case' 0 N--CA 1.444 -0.758 1 CA-C-N 124.327 4.064 . . . . 0.0 112.365 -154.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 20.3 mtt -147.16 144.4 28.95 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 125.073 1.483 . . . . 0.0 111.62 -167.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . 0.275 83.0 p -64.83 162.2 16.69 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 158.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -52.21 -41.74 62.95 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 129.44 3.096 . . . . 0.0 112.952 166.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 34.0 ttp-105 -53.2 -62.98 1.3 Allowed 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 128.644 3.715 . . . . 0.0 110.022 170.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -51.84 -51.82 53.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 123.931 0.77 . . . . 0.0 113.034 174.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 53.7 mt -50.94 -48.46 60.86 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 121.417 1.917 . . . . 0.0 114.278 174.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 54.5 tttt -62.31 -46.78 87.2 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 121.465 1.939 . . . . 0.0 106.536 -171.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -77.18 -35.45 55.82 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 115.784 -2.055 . . . . 0.0 116.535 -177.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -79.67 -36.95 36.91 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 118.155 2.65 . . . . 0.0 118.155 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . 0.252 7.3 mp -94.39 -27.81 15.86 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 126.011 2.07 . . . . 0.0 110.728 -176.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.18 -149.33 49.94 Favored Glycine 0 CA--C 1.523 0.581 0 O-C-N 119.946 -1.721 . . . . 0.0 113.134 -175.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -52.82 -23.06 6.19 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 116.062 1.875 . . . . 0.0 116.062 163.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.28 -7.61 84.96 Favored Glycine 0 C--N 1.337 0.595 0 CA-C-O 114.855 -3.192 . . . . 0.0 112.794 -169.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 7.4 tt -59.05 -44.15 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 1 CA-C-O 111.512 -4.089 . . . . 0.0 113.155 167.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.53 -22.66 60.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 124.682 3.401 . . . . 0.0 113.871 172.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 8.5 m -64.66 -39.14 93.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.882 1.273 . . . . 0.0 107.665 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 36.8 mm -83.11 -33.73 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 119.327 -2.108 . . . . 0.0 114.384 170.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 72.6 p -105.06 9.56 34.31 Favored 'General case' 0 N--CA 1.449 -0.482 1 N-CA-C 122.846 4.387 . . . . 0.0 122.846 -164.152 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 20.7 mtp85 -128.14 145.56 50.98 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 118.032 -2.917 . . . . 0.0 113.086 -178.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 96.01 166.95 34.46 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 67.3 m -65.29 -30.97 71.88 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -171.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -98.79 6.48 46.87 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -173.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 51.6 p -55.86 158.67 3.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 130.946 3.699 . . . . 0.0 114.627 165.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 48.9 tp -61.81 -32.57 72.89 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 129.664 3.186 . . . . 0.0 111.066 -151.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.25 87.1 mttt -98.59 12.39 35.43 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 120.006 3.336 . . . . 0.0 120.006 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -136.19 -11.45 1.93 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 130.457 3.503 . . . . 0.0 115.217 -179.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.5 161.38 0.33 Allowed Pre-proline 0 N--CA 1.45 -0.47 0 C-N-CA 129.815 3.246 . . . . 0.0 113.14 166.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -49.66 138.61 32.4 Favored 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 123.745 2.964 . . . . 0.0 113.46 162.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 87.5 t -61.89 -31.7 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 128.841 2.856 . . . . 0.0 110.021 -177.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 12.7 pm0 -67.44 -34.6 77.54 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 116.853 -3.654 . . . . 0.0 114.288 -176.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 9.2 tp -73.0 -42.91 62.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.689 1.996 . . . . 0.0 110.1 174.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 70.0 mtp180 -61.53 -49.43 76.72 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 125.654 1.846 . . . . 0.0 112.082 -179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -73.51 -37.69 65.6 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 127.406 2.282 . . . . 0.0 109.289 -176.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.1 t90 -51.6 -56.9 10.93 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 163.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' C' ' 100' ' ' LEU . 55.6 mt -65.75 -17.51 64.67 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 120.107 -1.621 . . . . 0.0 111.975 -174.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -88.98 -25.95 21.75 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 122.819 2.554 . . . . 0.0 114.954 166.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -72.46 -12.89 61.28 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 115.637 1.717 . . . . 0.0 115.637 169.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.16 -48.7 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 C-N-CA 127.005 2.122 . . . . 0.0 113.659 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 96.1 mt -85.12 -31.02 23.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 121.888 2.131 . . . . 0.0 112.635 -169.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.1 27.74 8.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 121.034 1.743 . . . . 0.0 113.695 -168.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . 0.52 ' HG3' ' H ' ' C' ' 108' ' ' ASP . 14.8 pttp -83.57 160.45 21.43 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.214 -1.374 . . . . 0.0 113.049 -169.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 66.9 m -111.75 47.73 1.01 Allowed 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.697 170.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . 0.52 ' H ' ' HG3' ' C' ' 106' ' ' LYS . 18.3 t0 . . . . . 0 C--O 1.249 1.036 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 170.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 11.4 ttt . . . . . 0 N--CA 1.473 0.683 0 CA-C-O 116.032 -1.937 . . . . 0.0 111.955 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.82 127.37 4.07 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 -173.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -85.37 150.05 25.01 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -168.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -124.27 144.45 49.97 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 112.771 -2.013 . . . . 0.0 110.167 176.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 53.6 p -129.97 149.43 73.1 Favored Pre-proline 0 N--CA 1.445 -0.697 0 CA-C-O 117.718 -1.134 . . . . 0.0 110.767 175.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . 0.275 15.7 Cg_exo -68.01 -24.25 39.46 Favored 'Trans proline' 0 N--CA 1.451 -0.992 1 C-N-CA 125.851 4.367 . . . . 0.0 114.147 177.171 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -149.75 145.32 26.58 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-O 113.449 -3.167 . . . . 0.0 109.362 169.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 1.9 t -79.8 130.39 35.28 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 127.424 2.952 . . . . 0.0 108.112 173.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.37 -40.58 59.5 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 128.011 3.319 . . . . 0.0 110.905 162.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.03 -36.06 77.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 115.938 1.829 . . . . 0.0 115.938 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.269 14.0 mmt -62.05 -39.79 93.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.718 -1.134 . . . . 0.0 109.746 165.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.21 -20.46 62.81 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 122.371 2.35 . . . . 0.0 116.504 178.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -88.6 -44.6 10.52 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 119.152 -2.218 . . . . 0.0 107.381 171.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -62.0 -44.0 97.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.045 -1.659 . . . . 0.0 110.703 -172.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -27.97 69.78 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 116.27 1.952 . . . . 0.0 116.27 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -74.65 -34.21 62.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.107 1.763 . . . . 0.0 109.2 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -81.73 -23.11 36.91 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 118.003 -2.936 . . . . 0.0 112.123 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . 0.253 59.4 mt-10 -70.39 -26.03 63.52 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 117.836 -3.04 . . . . 0.0 111.848 161.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 5.9 t-105 -82.04 -35.89 28.31 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 117.019 -1.467 . . . . 0.0 113.44 174.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 83.6 mt -63.49 -25.99 68.51 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 117.0 -1.476 . . . . 0.0 110.336 173.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -73.55 -20.77 60.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 130.58 3.552 . . . . 0.0 107.949 177.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -97.52 -24.66 15.47 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 120.965 1.711 . . . . 0.0 113.014 167.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 79.6 t -65.14 -41.65 92.3 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 O-C-N 117.936 -2.977 . . . . 0.0 110.252 169.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -65.95 -40.62 91.51 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 121.945 2.157 . . . . 0.0 115.351 171.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 16.3 tp -57.76 -43.84 85.74 Favored 'General case' 0 N--CA 1.448 -0.543 0 O-C-N 120.095 -1.628 . . . . 0.0 111.274 174.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 23.8 tp -60.02 -45.75 91.76 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 ttpp -56.05 -45.0 79.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 126.564 3.078 . . . . 0.0 110.809 176.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -69.9 -15.67 63.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 112.139 -2.3 . . . . 0.0 114.574 174.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . 0.44 ' HB1' ' HA ' ' D' ' 35' ' ' HIS . . . -83.03 -34.87 26.17 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 127.911 2.484 . . . . 0.0 117.404 167.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -62.84 -33.45 75.28 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 121.049 -1.032 . . . . 0.0 111.416 170.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -73.8 -25.98 60.4 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 129.595 3.158 . . . . 0.0 115.489 -171.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 43.9 p30 -116.79 1.35 12.73 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.907 1.379 . . . . 0.0 112.788 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 70.01 29.01 4.0 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 129.825 3.25 . . . . 0.0 115.019 -178.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 61.3 mt -99.29 10.31 41.66 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 119.979 -1.701 . . . . 0.0 109.896 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . 0.44 ' HA ' ' HB1' ' D' ' 29' ' ' ALA . 0.0 OUTLIER -54.91 -57.95 9.55 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 3.1 mt -64.95 -36.93 17.93 Favored Pre-proline 0 N--CA 1.449 -0.509 0 O-C-N 121.221 -0.925 . . . . 0.0 110.786 -172.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.81 -40.25 65.18 Favored 'Trans proline' 0 N--CA 1.447 -1.221 0 N-CA-C 119.207 2.734 . . . . 0.0 119.207 162.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 16.5 tp -68.41 -43.07 78.02 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 117.073 -3.517 . . . . 0.0 112.096 178.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 77.1 mt -57.52 -48.38 79.44 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 126.515 2.384 . . . . 0.0 110.137 171.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -78.96 -29.24 43.8 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 117.439 -3.288 . . . . 0.0 108.734 -166.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.38 -54.8 41.24 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.181 0.992 . . . . 0.0 109.348 161.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 5.1 mmt -57.53 -49.16 77.24 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 114.424 -2.703 . . . . 0.0 114.624 -177.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 23.0 mt -111.09 133.03 53.78 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.464 1.906 . . . . 0.0 114.212 -164.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 76.5 p -68.1 151.0 97.53 Favored Pre-proline 0 N--CA 1.448 -0.543 0 O-C-N 126.061 2.101 . . . . 0.0 112.016 173.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -46.46 -43.82 21.64 Favored 'Trans proline' 0 N--CA 1.447 -1.215 1 C-N-CA 129.252 6.634 . . . . 0.0 114.904 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.89 -24.07 62.42 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 174.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -73.46 -25.3 60.43 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 114.187 -2.816 . . . . 0.0 112.986 166.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 26.0 mtm180 -89.31 -26.58 21.04 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 125.072 3.578 . . . . 0.0 111.743 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -51.78 -48.89 63.58 Favored 'General case' 0 N--CA 1.45 -0.455 1 C-N-CA 132.703 4.401 . . . . 0.0 111.761 159.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.3 -38.39 35.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 126.552 2.407 . . . . 0.0 115.272 -179.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.18 -34.74 78.29 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 118.214 2.672 . . . . 0.0 118.214 165.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.34 -41.62 99.74 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-O 117.665 -1.631 . . . . 0.0 115.86 166.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 52.1 m -59.58 -46.8 87.86 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 123.658 1.694 . . . . 0.0 110.016 168.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -59.16 -31.94 69.44 Favored 'General case' 0 N--CA 1.45 -0.453 2 O-C-N 114.297 -5.252 . . . . 0.0 111.011 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 99.0 t -57.37 -57.5 9.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 CA-C-N 122.116 2.234 . . . . 0.0 110.38 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -68.94 -27.24 65.56 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 115.63 -2.128 . . . . 0.0 114.451 176.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 79.6 mt -54.26 -66.14 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-N 121.27 1.85 . . . . 0.0 106.803 167.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 61.2 t -42.87 -51.01 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 O-C-N 120.818 -1.176 . . . . 0.0 113.765 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.36 -48.75 76.19 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . 0.43 ' HA ' ' HB3' ' D' ' 63' ' ' ARG . 29.3 mm-40 -68.35 -22.51 64.67 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 117.474 -1.251 . . . . 0.0 113.505 177.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 31.8 mt -77.33 -3.13 38.41 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 125.397 2.522 . . . . 0.0 116.96 174.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 77.6 mt -104.01 -28.63 11.42 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.573 1.949 . . . . 0.0 111.946 168.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . 0.43 ' HB3' ' HA ' ' D' ' 60' ' ' GLU . 39.4 ttm105 -77.49 -51.11 11.29 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 117.882 -3.011 . . . . 0.0 113.313 175.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.37 41.51 91.0 Favored Glycine 0 C--N 1.337 0.637 0 CA-C-O 116.173 -2.46 . . . . 0.0 111.362 163.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -115.95 -42.07 3.12 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 121.342 2.571 . . . . 0.0 108.212 -174.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 15.0 mmt -77.73 61.37 2.4 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 113.584 -1.644 . . . . 0.0 111.67 159.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 75.2 p -93.42 -176.49 4.13 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.192 1.397 . . . . 0.0 114.032 -173.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.371 2.8 tp-100 69.22 -109.0 0.08 Allowed 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 119.193 -2.192 . . . . 0.0 114.903 165.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 18.0 ttt180 -73.88 -37.29 64.78 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 116.545 -1.693 . . . . 0.0 110.477 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -69.84 -45.1 68.54 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 130.477 3.511 . . . . 0.0 113.631 -169.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.03 -18.03 59.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 113.824 -2.989 . . . . 0.0 111.377 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -106.25 -12.27 15.77 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 123.07 2.668 . . . . 0.0 116.318 174.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -119.76 -15.62 8.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 118.885 2.92 . . . . 0.0 118.885 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -124.59 -17.9 5.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 123.123 2.692 . . . . 0.0 112.204 172.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' D' ' 75' ' ' LEU . 4.4 mm? -84.99 -52.9 5.65 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 116.604 -1.665 . . . . 0.0 111.652 161.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 109.19 -167.14 12.81 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 119.257 -1.449 . . . . 0.0 112.206 146.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -55.09 -34.79 63.94 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -173.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -38.16 -24.14 0.02 OUTLIER Glycine 0 CA--C 1.523 0.548 0 CA-C-O 117.023 -1.987 . . . . 0.0 114.966 165.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 19.8 tt -60.64 -25.77 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 120.373 2.086 . . . . 0.0 112.847 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.85 -33.54 34.43 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 117.293 -1.337 . . . . 0.0 109.03 -176.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 33.9 m -70.57 -20.24 62.8 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 122.159 2.254 . . . . 0.0 109.929 170.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 25.1 mm -95.49 -30.64 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -173.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 7.1 p -105.19 -26.01 12.23 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 114.495 -2.669 . . . . 0.0 113.883 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.275 22.9 mtp85 -82.6 168.77 16.99 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 125.376 3.716 . . . . 0.0 112.493 167.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 89.92 154.24 29.37 Favored Glycine 0 C--N 1.337 0.618 0 CA-C-O 122.952 1.306 . . . . 0.0 114.617 177.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 92.5 p -74.17 -16.66 60.98 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.974 -1.113 . . . . 0.0 111.448 -147.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -135.3 64.48 1.58 Allowed 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 125.612 2.625 . . . . 0.0 107.735 175.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 24.8 p -97.62 -169.4 1.83 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 127.106 2.163 . . . . 0.0 112.389 177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 tp -76.21 -21.39 56.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 119.25 -2.156 . . . . 0.0 111.479 177.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 19.6 tttt -84.96 0.07 52.55 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 128.953 2.901 . . . . 0.0 109.748 174.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.45 -34.43 6.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 120.28 -1.513 . . . . 0.0 110.854 175.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 53.1 76.52 0.52 Allowed Pre-proline 0 N--CA 1.449 -0.519 0 CA-C-N 122.794 2.543 . . . . 0.0 111.389 164.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.283 98.5 Cg_exo 17.2 40.53 0.0 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.002 0 N-CA-C 116.941 1.862 . . . . 0.0 116.941 53.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 72.8 t -43.61 -26.33 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 C-N-CA 128.564 2.746 . . . . 0.0 115.897 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.49 -30.29 8.01 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.695 1.998 . . . . 0.0 110.337 -160.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 24.2 tp -57.5 -46.4 83.81 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.744 -2.472 . . . . 0.0 111.223 147.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -60.38 -43.82 96.24 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 115.742 1.756 . . . . 0.0 115.742 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -62.62 -36.58 83.22 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.116 2.167 . . . . 0.0 113.616 166.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 80.6 t90 -65.45 -44.42 87.34 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 118.351 -2.718 . . . . 0.0 110.137 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . 0.4 ' HB3' HD12 ' D' ' 104' ' ' LEU . 47.2 mt -60.69 -36.3 78.45 Favored 'General case' 0 N--CA 1.446 -0.663 1 O-C-N 116.103 -4.123 . . . . 0.0 109.744 179.023 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -57.41 -29.26 63.97 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 118.152 2.649 . . . . 0.0 118.152 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -101.74 -22.14 14.47 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 129.712 3.205 . . . . 0.0 110.79 -173.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 50.6 t -86.69 -38.53 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-O 123.78 1.752 . . . . 0.0 111.761 175.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . 0.4 HD12 ' HB3' ' D' ' 100' ' ' LEU 0.294 15.3 mt -96.58 -28.73 14.23 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 114.002 -2.904 . . . . 0.0 116.062 -175.479 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 12.3 mt -102.05 34.71 2.6 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 120.754 1.615 . . . . 0.0 107.883 172.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . 0.313 17.6 pttp -62.15 165.69 5.5 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.828 178.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.37 -42.48 15.05 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 130.668 3.587 . . . . 0.0 113.232 -177.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.249 1.032 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 176.756 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.11 -53.81 22.69 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 119.923 -1.736 . . . . 0.0 113.414 -158.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . 0.251 25.3 tt0 -60.97 -20.04 61.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.834 -3.041 . . . . 0.0 113.697 178.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -78.21 -15.97 58.3 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 127.794 2.438 . . . . 0.0 114.571 171.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.432 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 27.7 p -90.78 151.51 43.75 Favored Pre-proline 0 N--CA 1.45 -0.436 0 C-N-CA 125.746 1.618 . . . . 0.0 113.086 -172.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 5' ' ' SER . 53.1 Cg_exo -85.05 14.61 2.43 Favored 'Trans proline' 0 N--CA 1.448 -1.153 0 N-CA-C 118.982 2.647 . . . . 0.0 118.982 167.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -161.95 156.3 22.19 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 117.257 -3.402 . . . . 0.0 110.466 172.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.269 16.1 t -125.48 124.15 40.75 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 124.189 1.947 . . . . 0.0 111.624 175.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -98.82 -22.95 15.57 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 112.37 -2.196 . . . . 0.0 113.354 -175.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.97 77.16 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 126.068 1.747 . . . . 0.0 110.437 159.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 17.0 ttp -52.12 -44.82 64.68 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 119.764 -1.835 . . . . 0.0 111.805 170.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.44 -31.62 68.87 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 114.121 -2.847 . . . . 0.0 110.499 -173.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . 0.271 26.6 tp10 -58.97 -43.63 91.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 125.85 1.969 . . . . 0.0 114.334 168.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -59.8 -50.7 72.77 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 125.783 2.706 . . . . 0.0 114.554 174.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -62.78 -24.74 67.88 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 117.253 -3.404 . . . . 0.0 114.396 170.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . 0.271 1.8 t60 -66.99 -43.17 83.66 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.433 1.493 . . . . 0.0 113.38 171.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -76.38 -30.71 57.64 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 125.955 2.034 . . . . 0.0 107.749 177.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -65.86 -41.59 91.48 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 122.053 2.206 . . . . 0.0 111.448 174.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 12.8 t-105 -70.0 -52.96 19.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 127.651 2.38 . . . . 0.0 108.063 176.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.6 mt -62.17 -21.45 65.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 114.264 -2.779 . . . . 0.0 115.378 177.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -53.28 -43.04 67.15 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 118.439 2.755 . . . . 0.0 118.439 161.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -62.38 -39.31 92.77 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 129.17 2.988 . . . . 0.0 107.429 172.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.4 t -79.68 -24.11 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 CA-C-N 120.465 1.484 . . . . 0.0 109.997 -176.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . 0.26 6.1 m-20 -59.92 -61.25 2.75 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 116.716 -3.74 . . . . 0.0 115.937 160.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 47.9 tp -44.73 -53.22 7.56 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 131.533 3.933 . . . . 0.0 114.154 173.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.6 tp -67.24 -36.29 81.32 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 177.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.2 ttpt -64.73 -38.37 90.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.349 176.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -75.06 -32.8 61.6 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 114.956 -2.45 . . . . 0.0 111.516 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.96 -25.14 52.46 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 120.763 1.62 . . . . 0.0 114.863 172.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -59.8 -44.85 93.77 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 122.361 2.346 . . . . 0.0 112.042 162.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -78.31 16.68 0.74 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 113.978 -2.915 . . . . 0.0 113.348 176.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -131.76 7.39 4.42 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 121.461 1.937 . . . . 0.0 113.659 162.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.28 14.3 m-20 46.58 32.6 1.71 Allowed 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 128.138 2.575 . . . . 0.0 117.576 -165.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 16.1 mt -90.09 4.42 50.37 Favored 'General case' 0 N--CA 1.452 -0.368 1 O-C-N 115.877 -4.264 . . . . 0.0 113.235 166.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.3 p-80 -58.11 -43.73 87.31 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 116.968 -3.583 . . . . 0.0 115.164 -177.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 56.7 mt -64.06 -47.02 80.53 Favored Pre-proline 0 N--CA 1.452 -0.326 0 CA-C-O 117.087 -1.435 . . . . 0.0 111.676 -176.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' A' ' 36' ' ' LEU . 15.0 Cg_exo -53.09 -40.2 77.54 Favored 'Trans proline' 0 N--CA 1.448 -1.187 1 C-N-CA 125.667 4.245 . . . . 0.0 114.471 174.512 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 24.7 tp -74.19 -39.4 63.19 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 117.196 -3.44 . . . . 0.0 110.277 -175.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.8 mt -83.44 3.06 33.63 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 126.334 2.271 . . . . 0.0 112.837 176.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -103.96 -9.04 19.17 Favored 'General case' 0 N--CA 1.446 -0.635 1 O-C-N 115.398 -4.564 . . . . 0.0 116.225 162.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 tt -97.0 -55.77 2.76 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.827 2.051 . . . . 0.0 108.385 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 57.8 mmm -72.69 -10.9 60.34 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 123.693 1.711 . . . . 0.0 115.41 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.5 mt -134.82 135.07 41.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 118.404 -2.685 . . . . 0.0 110.62 -176.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 74.2 p -87.27 162.18 43.9 Favored Pre-proline 0 N--CA 1.448 -0.536 0 O-C-N 116.744 -3.723 . . . . 0.0 111.64 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -56.7 -51.83 8.22 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 C-N-CA 124.139 3.226 . . . . 0.0 112.593 -169.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -68.94 -16.76 63.83 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 127.454 2.302 . . . . 0.0 113.452 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -87.14 -39.41 15.56 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 118.237 -2.789 . . . . 0.0 112.344 170.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.266 78.5 mtm-85 -64.2 -40.5 96.2 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 117.386 -3.321 . . . . 0.0 114.205 167.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.44 ' HG3' ' HD2' ' B' ' 15' ' ' ARG . 23.2 tt0 -61.4 -45.65 93.44 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 116.054 -1.927 . . . . 0.0 111.946 176.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.28 -37.78 78.03 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 128.778 3.799 . . . . 0.0 112.247 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 70.6 mt -69.34 -26.08 64.52 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 121.236 1.834 . . . . 0.0 114.401 172.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.84 -45.49 57.58 Favored Glycine 0 C--N 1.336 0.537 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 173.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.1 m -64.15 -30.26 71.34 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 115.795 -2.05 . . . . 0.0 113.18 171.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.484 HH12 ' CD ' ' B' ' 47' ' ' GLU . 32.0 ttm180 -56.8 -34.78 68.02 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 120.438 1.472 . . . . 0.0 113.099 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 65.5 t -59.03 -37.41 67.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 CA-C-O 116.411 -1.757 . . . . 0.0 113.019 172.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -67.63 -31.84 72.14 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 122.749 2.522 . . . . 0.0 114.236 171.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.276 64.4 mt -63.57 -39.42 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 O-C-N 120.019 -1.676 . . . . 0.0 107.846 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.6 t -79.13 -37.19 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 127.648 2.379 . . . . 0.0 113.369 -177.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -47.16 -60.9 2.16 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 125.711 1.882 . . . . 0.0 110.87 158.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -70.6 -14.05 62.33 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 126.685 3.136 . . . . 0.0 116.204 -175.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.406 HD21 HG22 ' A' ' 82' ' ' ILE . 93.9 mt -82.45 -39.35 22.68 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 116.739 -3.726 . . . . 0.0 111.673 167.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 tp -68.96 -47.48 65.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.354 1.433 . . . . 0.0 111.439 172.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.1 ttm105 -57.21 -62.19 1.94 Allowed 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 117.521 -3.237 . . . . 0.0 108.39 173.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.06 7.53 64.05 Favored Glycine 0 CA--C 1.522 0.506 0 O-C-N 119.756 -1.84 . . . . 0.0 117.404 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -97.11 -12.7 22.82 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 116.149 1.907 . . . . 0.0 116.149 -165.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 22.1 ttm -138.41 134.68 34.42 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 127.394 2.933 . . . . 0.0 114.285 -167.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -97.56 157.9 15.77 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.099 -2.251 . . . . 0.0 115.845 -152.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -48.67 -37.19 17.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -174.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.3 tpt85 -75.83 -13.78 60.28 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 118.18 -2.825 . . . . 0.0 113.509 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -102.0 -36.56 8.55 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 117.159 -3.463 . . . . 0.0 105.778 -173.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 29.0 mt -67.78 -22.11 65.21 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 117.87 -3.019 . . . . 0.0 116.32 170.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.0 tptt -50.44 -29.98 11.53 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 115.502 1.668 . . . . 0.0 115.502 159.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -103.94 -50.74 3.31 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 174.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -66.46 -16.0 63.78 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 116.89 2.181 . . . . 0.0 116.89 -175.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 95.7 mt -129.63 -5.54 4.67 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 115.313 -2.279 . . . . 0.0 112.299 170.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 73.79 6.48 72.52 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-N 119.989 1.268 . . . . 0.0 115.839 -172.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.15 157.09 22.91 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 124.321 2.01 . . . . 0.0 113.404 -160.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.71 130.12 9.61 Favored Glycine 0 N--CA 1.446 -0.689 0 O-C-N 120.436 -1.415 . . . . 0.0 115.971 172.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 16.4 mt -61.32 -38.32 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 C-N-CA 128.346 2.658 . . . . 0.0 114.12 -168.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.12 -13.15 62.27 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 117.686 2.476 . . . . 0.0 117.686 171.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 2.0 p -82.67 -48.3 11.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 120.83 -1.169 . . . . 0.0 111.992 169.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.406 HG22 HD21 ' A' ' 61' ' ' LEU . 6.5 mm -49.13 -39.42 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 123.147 1.451 . . . . 0.0 114.013 164.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.0 m -68.55 -49.2 61.31 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 120.74 -1.225 . . . . 0.0 108.496 -174.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.9 ttt180 -64.2 -37.32 87.04 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 125.411 1.695 . . . . 0.0 113.816 174.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.38 -47.48 62.3 Favored Glycine 0 C--N 1.338 0.64 0 C-N-CA 127.18 2.324 . . . . 0.0 109.791 172.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.6 m -58.99 -54.19 49.92 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 118.966 2.95 . . . . 0.0 118.966 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -59.13 -27.53 65.7 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 126.126 1.77 . . . . 0.0 113.49 168.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 56.1 m -67.0 -43.88 81.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 120.931 1.696 . . . . 0.0 112.011 168.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 89' ' ' LEU . 12.7 tp -62.33 -41.94 98.97 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.811 2.044 . . . . 0.0 109.2 176.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -60.37 -34.97 74.64 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 124.405 3.275 . . . . 0.0 110.29 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.33 -5.72 59.23 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 119.735 -1.853 . . . . 0.0 115.956 177.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.86 140.52 58.42 Favored Pre-proline 0 N--CA 1.449 -0.521 0 O-C-N 125.207 1.567 . . . . 0.0 110.605 -176.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -57.98 139.12 89.29 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 C-N-CA 125.218 3.946 . . . . 0.0 110.037 173.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.9 m -57.23 -29.52 32.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 119.705 -1.872 . . . . 0.0 111.738 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -70.16 -36.49 74.75 Favored 'General case' 0 N--CA 1.451 -0.406 0 O-C-N 124.362 1.039 . . . . 0.0 113.145 -177.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 14.8 tp -60.18 -49.61 76.93 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 166.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -54.15 -42.52 69.66 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 125.61 1.564 . . . . 0.0 107.928 177.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -74.53 -31.1 62.03 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 123.571 1.653 . . . . 0.0 114.131 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . 0.296 65.4 t90 -70.73 -42.42 70.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 O-C-N 116.411 -3.93 . . . . 0.0 109.884 173.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.1 mt -60.83 -37.28 81.5 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 118.75 -2.469 . . . . 0.0 116.88 175.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . 0.274 44.2 mt-10 -60.65 -14.06 18.3 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 118.407 2.743 . . . . 0.0 118.407 -178.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -99.38 -12.81 19.94 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.433 2.293 . . . . 0.0 113.782 176.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.4 t -117.99 -31.98 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 O-C-N 118.106 -2.871 . . . . 0.0 116.807 -174.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 18.2 mt -84.08 -35.04 24.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 126.309 2.957 . . . . 0.0 118.808 174.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.283 21.3 mt -112.02 -18.83 12.53 Favored 'General case' 0 N--CA 1.448 -0.553 1 N-CA-C 122.516 4.265 . . . . 0.0 122.516 -160.289 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -75.13 -4.02 36.21 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.843 2.535 . . . . 0.0 117.843 -176.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.1 p -129.96 13.65 5.76 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -168.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.296 2.4 m-20 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 116.003 -1.951 . . . . 0.0 114.254 175.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? . . . . . 0 N--CA 1.467 0.421 0 CA-C-O 121.827 0.822 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -56.14 -44.25 79.05 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 128.799 2.84 . . . . 0.0 117.6 -175.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -79.36 -16.37 56.39 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 120.564 -1.335 . . . . 0.0 108.263 -175.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -84.39 -12.84 53.73 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.087 -2.258 . . . . 0.0 111.656 175.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 52.7 m -104.22 158.71 31.36 Favored Pre-proline 0 N--CA 1.449 -0.521 0 N-CA-C 119.887 3.292 . . . . 0.0 119.887 -162.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -62.34 -40.68 38.61 Favored 'Trans proline' 0 N--CA 1.448 -1.192 0 CA-C-N 124.364 2.594 . . . . 0.0 110.909 176.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -123.17 158.84 29.89 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 124.937 2.303 . . . . 0.0 111.154 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 4.4 t -160.02 129.73 5.29 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 114.002 -1.454 . . . . 0.0 110.181 169.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.04 74.52 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.329 -2.107 . . . . 0.0 114.133 169.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.275 . . -71.62 -34.15 69.57 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 -172.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 90.4 mtp -74.67 -47.58 30.98 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 120.503 -1.373 . . . . 0.0 110.204 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.4 -37.73 70.53 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 170.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -73.88 -33.62 64.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.779 2.082 . . . . 0.0 116.133 172.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -55.58 -59.11 5.3 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 163.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.44 ' HD2' ' HG3' ' A' ' 49' ' ' GLU . 35.4 mmt180 -48.75 -33.19 9.82 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 120.462 3.504 . . . . 0.0 120.462 172.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -60.27 -40.27 89.78 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 121.269 1.85 . . . . 0.0 112.664 170.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -72.6 -38.61 67.77 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 118.06 2.615 . . . . 0.0 118.06 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -59.87 -23.49 63.47 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.263 -0.975 . . . . 0.0 113.532 169.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 6.4 t-105 -82.22 -46.74 13.33 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.72 2.408 . . . . 0.0 109.167 172.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 76.9 mt -57.82 -27.21 62.96 Favored 'General case' 0 N--CA 1.448 -0.575 0 O-C-N 119.567 -1.958 . . . . 0.0 115.727 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -59.5 -45.32 92.04 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 119.154 -2.216 . . . . 0.0 111.963 174.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -59.31 -51.58 69.32 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 114.942 -2.456 . . . . 0.0 110.96 176.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 89.1 t -67.6 -27.54 38.7 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 O-C-N 127.957 3.286 . . . . 0.0 110.327 -173.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -77.21 -39.74 47.6 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 116.547 -3.846 . . . . 0.0 111.397 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 31.7 tp -70.07 -37.24 75.44 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 117.659 -3.151 . . . . 0.0 110.961 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 16.8 tp -59.61 -47.57 85.05 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 118.793 2.886 . . . . 0.0 118.793 165.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -61.02 -29.66 69.85 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 128.338 3.524 . . . . 0.0 111.698 173.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -91.57 -24.69 19.52 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 117.073 2.249 . . . . 0.0 117.073 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.41 -26.34 63.15 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.253 1.946 . . . . 0.0 116.253 164.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -61.56 -32.09 72.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 126.205 1.802 . . . . 0.0 115.547 169.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -81.64 -2.16 49.29 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 123.744 1.735 . . . . 0.0 111.52 -170.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -128.71 7.96 5.75 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 119.039 -2.288 . . . . 0.0 109.893 -173.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.392 14.5 m-20 58.36 21.58 8.49 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 119.732 -1.855 . . . . 0.0 115.144 -167.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 7.7 mt -102.26 20.02 17.61 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 120.582 3.549 . . . . 0.0 120.582 178.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -76.52 -46.46 26.46 Favored 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 118.692 -2.505 . . . . 0.0 112.779 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 25.7 mt -63.57 -41.66 67.66 Favored Pre-proline 0 N--CA 1.448 -0.569 0 CA-C-N 121.737 2.062 . . . . 0.0 113.18 174.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . 0.287 40.1 Cg_exo -49.08 -47.97 19.93 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 124.941 3.76 . . . . 0.0 115.887 162.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -65.78 -35.01 79.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 118.267 -2.771 . . . . 0.0 108.688 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 57.2 mt -70.04 -40.75 74.95 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 118.087 2.625 . . . . 0.0 118.087 177.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -52.03 -25.54 8.77 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.4 1.88 . . . . 0.0 113.129 162.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 19.0 tp -91.96 -35.31 14.07 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.587 1.555 . . . . 0.0 112.853 178.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 21.8 mmt -94.46 -8.88 37.22 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 118.507 2.78 . . . . 0.0 118.507 -176.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 53.4 mt -141.94 126.85 18.24 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 125.786 1.634 . . . . 0.0 113.501 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 44.7 p -61.08 154.93 58.37 Favored Pre-proline 0 N--CA 1.449 -0.501 1 O-C-N 113.841 -5.537 . . . . 0.0 110.541 169.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -50.28 -22.8 8.96 Favored 'Trans proline' 0 N--CA 1.447 -1.213 0 N-CA-C 120.498 3.23 . . . . 0.0 120.498 174.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -81.68 -36.77 28.36 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 117.483 -3.261 . . . . 0.0 114.554 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . 0.484 ' CD ' HH12 ' A' ' 54' ' ' ARG . 19.5 mt-10 -62.23 -43.63 98.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 114.469 -2.682 . . . . 0.0 111.366 162.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -65.81 -33.99 77.13 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 125.587 1.804 . . . . 0.0 112.045 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -60.48 -43.45 96.94 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.885 -1.052 . . . . 0.0 113.276 168.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . 0.347 . . -65.91 -56.56 11.15 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 115.72 -2.086 . . . . 0.0 109.677 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.302 10.6 mt -59.0 -30.95 68.36 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 121.196 1.816 . . . . 0.0 111.427 -178.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.03 -52.86 44.65 Favored Glycine 0 CA--C 1.523 0.582 0 CA-C-O 114.747 -3.252 . . . . 0.0 110.929 170.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 25.8 m -66.78 -28.63 68.54 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 127.189 2.195 . . . . 0.0 108.713 -174.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -63.08 -26.03 68.64 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 125.937 1.695 . . . . 0.0 111.809 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 79.6 t -64.89 -48.89 82.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 125.032 1.457 . . . . 0.0 111.225 169.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 24.7 mtp180 -66.33 -33.53 75.95 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 118.121 -2.862 . . . . 0.0 109.624 -178.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 85.2 mt -64.07 -59.27 4.51 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 O-C-N 121.022 -1.049 . . . . 0.0 111.7 172.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 39.6 t -56.33 -40.01 63.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 O-C-N 121.399 -0.813 . . . . 0.0 111.449 178.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -67.01 -32.43 73.65 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.228 -0.92 . . . . 0.0 111.828 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -80.79 -18.78 46.45 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.828 1.299 . . . . 0.0 108.935 176.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . 0.334 76.1 mt -88.93 10.18 22.28 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 114.699 -2.572 . . . . 0.0 110.95 170.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 15.1 mt -112.8 -29.33 7.44 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 118.931 2.937 . . . . 0.0 118.931 150.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.37 21.5 ttm105 -58.83 -70.0 0.17 Allowed 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 127.533 2.333 . . . . 0.0 111.639 176.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.67 27.89 9.35 Favored Glycine 0 C--N 1.336 0.538 1 CA-C-O 112.905 -4.275 . . . . 0.0 112.273 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -113.41 -22.19 10.5 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 119.496 3.147 . . . . 0.0 119.496 -176.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . 0.277 13.5 mtt -84.82 147.48 26.8 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 126.364 2.29 . . . . 0.0 111.313 -174.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 87.4 p -95.1 169.55 10.03 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 116.799 -1.961 . . . . 0.0 112.322 168.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -62.56 -31.85 72.73 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 116.883 -1.532 . . . . 0.0 112.51 -176.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 31.3 ttt180 -63.1 -50.88 68.77 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 126.345 2.278 . . . . 0.0 106.052 176.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -61.53 -44.39 97.14 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 127.672 2.389 . . . . 0.0 109.232 -174.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 31.1 mt -63.49 -46.42 86.2 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.82 -1.086 . . . . 0.0 113.48 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -63.93 -43.14 96.78 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.725 1.266 . . . . 0.0 110.954 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -68.58 -59.35 3.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.102 0.961 . . . . 0.0 110.421 -176.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -93.21 -61.11 1.64 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.42 -1.276 . . . . 0.0 111.444 -161.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 30.1 mt -74.23 -14.66 60.96 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 92.89 -1.29 70.76 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-O 124.188 1.993 . . . . 0.0 112.033 162.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.07 114.72 26.67 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -162.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.7 171.1 53.65 Favored Glycine 0 C--N 1.332 0.312 0 O-C-N 119.42 -2.05 . . . . 0.0 116.074 -176.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 11.4 mm -52.91 -43.62 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-O 115.319 -2.276 . . . . 0.0 111.368 -174.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.58 -27.52 62.24 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 123.366 2.803 . . . . 0.0 113.91 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 30.3 m -67.45 -49.62 62.88 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 121.252 1.842 . . . . 0.0 112.822 173.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 15.6 mm -64.5 -39.6 86.15 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 C-N-CA 125.827 1.651 . . . . 0.0 112.777 177.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 98.3 m -49.25 -52.63 25.98 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 162.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 42.5 ttt180 -63.22 -34.56 77.93 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 125.91 1.684 . . . . 0.0 114.498 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -60.49 -46.76 93.76 Favored Glycine 0 CA--C 1.521 0.438 0 O-C-N 126.125 2.141 . . . . 0.0 114.198 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 2.4 p -76.02 -27.36 57.32 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.614 1.166 . . . . 0.0 107.855 -176.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -67.26 -43.09 82.74 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 119.71 1.141 . . . . 0.0 112.314 170.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . 0.26 51.5 m -79.66 -22.6 43.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.728 2.411 . . . . 0.0 109.886 -168.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 15.0 mt -78.13 -39.92 39.68 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 118.993 -2.317 . . . . 0.0 109.102 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 47.8 tttm -70.44 -24.32 62.88 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 124.873 1.269 . . . . 0.0 110.483 -172.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.9 -23.67 31.11 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 115.25 -2.309 . . . . 0.0 113.502 166.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.93 150.2 88.48 Favored Pre-proline 0 N--CA 1.45 -0.46 0 CA-C-N 121.391 1.905 . . . . 0.0 115.098 -164.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -46.52 132.56 16.17 Favored 'Trans proline' 0 N--CA 1.451 -1.024 0 O-C-N 122.944 0.971 . . . . 0.0 110.641 163.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.422 ' H ' HG13 ' B' ' 94' ' ' VAL . 1.1 m -61.93 -26.38 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 O-C-N 119.583 -1.948 . . . . 0.0 113.322 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pm0 -67.84 -25.04 65.35 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 124.372 2.034 . . . . 0.0 114.829 176.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 21.3 tp -73.33 -46.94 46.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 117.046 -3.534 . . . . 0.0 109.478 167.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 48.8 mtp85 -60.75 -38.63 85.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 126.743 2.527 . . . . 0.0 115.386 -175.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -60.45 -45.14 94.78 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.967 2.107 . . . . 0.0 112.182 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -77.28 -46.19 23.88 Favored 'General case' 0 N--CA 1.449 -0.525 1 C-N-CA 131.731 4.013 . . . . 0.0 108.264 -170.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 38.3 mt -54.77 -49.23 71.39 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 174.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -49.24 -55.35 12.87 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 126.099 2.125 . . . . 0.0 109.614 172.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -72.59 -18.03 61.64 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 121.037 3.717 . . . . 0.0 121.037 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 56.3 t -87.8 -42.28 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-O 115.639 -2.124 . . . . 0.0 111.281 171.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 52.7 mt -88.19 -65.57 1.0 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 120.405 1.457 . . . . 0.0 112.752 -167.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 83.9 mt -57.0 -30.52 64.24 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 120.054 -1.654 . . . . 0.0 114.022 -167.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -66.38 -10.26 41.65 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 117.78 2.511 . . . . 0.0 117.78 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 45.8 m -104.81 7.07 34.4 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 124.38 2.038 . . . . 0.0 114.651 -177.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 . . . . . 0 C--O 1.25 1.119 1 O-C-N 115.555 -4.466 . . . . 0.0 113.697 163.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ttt . . . . . 0 N--CA 1.469 0.51 0 N-CA-C 104.306 -2.479 . . . . 0.0 104.306 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.24 155.68 20.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.502 1.921 . . . . 0.0 112.77 176.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -122.6 161.88 22.9 Favored 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 125.825 1.953 . . . . 0.0 110.219 177.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -123.59 164.64 18.62 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.737 1.215 . . . . 0.0 110.157 165.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -151.83 154.25 32.66 Favored Pre-proline 0 N--CA 1.447 -0.592 0 O-C-N 127.25 2.843 . . . . 0.0 115.479 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.92 -14.24 13.83 Favored 'Trans proline' 0 N--CA 1.446 -1.307 1 C-N-CA 125.591 4.194 . . . . 0.0 113.321 174.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -147.48 135.31 21.15 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 118.766 -2.459 . . . . 0.0 106.33 172.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 15.4 t -138.19 134.47 34.53 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 123.15 1.452 . . . . 0.0 109.819 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.38 -34.54 78.19 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 116.39 -3.944 . . . . 0.0 115.198 177.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.96 -35.38 72.14 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.622 1.569 . . . . 0.0 113.018 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 59.2 mtt -64.0 -40.71 96.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 122.264 1.03 . . . . 0.0 109.374 171.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.29 -20.46 61.5 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 176.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -66.14 -50.86 62.52 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 120.456 -1.403 . . . . 0.0 107.86 162.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -60.96 -40.42 93.3 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -170.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -44.57 83.08 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 128.737 2.815 . . . . 0.0 113.906 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -62.65 -28.83 70.19 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 170.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 93.8 mm-40 -68.68 -24.81 64.55 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 119.01 2.967 . . . . 0.0 119.01 169.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -80.92 -42.05 21.99 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 125.729 1.893 . . . . 0.0 110.544 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . 0.661 ' CZ2' ' HD2' ' D' ' 48' ' ' ARG . 28.9 t-105 -62.96 -46.7 86.47 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 125.674 1.59 . . . . 0.0 112.997 169.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 5.7 mp -60.89 -36.8 80.17 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 116.358 -1.782 . . . . 0.0 109.551 175.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -70.24 -31.59 69.06 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 118.852 2.908 . . . . 0.0 118.852 171.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -53.34 -42.93 67.25 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.564 1.945 . . . . 0.0 111.175 161.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.312 42.6 t -65.63 -50.23 72.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 124.89 1.369 . . . . 0.0 112.287 174.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -70.44 -29.54 66.14 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 117.569 2.433 . . . . 0.0 117.569 -175.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 24.0 tp -70.19 -61.2 1.87 Allowed 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 126.453 3.025 . . . . 0.0 104.501 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 36.0 tp -52.12 -30.35 25.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 118.155 -2.84 . . . . 0.0 113.695 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -62.52 -39.5 93.75 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 124.804 1.241 . . . . 0.0 113.631 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -81.71 -20.52 39.24 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 125.868 1.667 . . . . 0.0 111.265 178.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.14 71.26 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.377 1.071 . . . . 0.0 112.102 -176.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -61.03 -35.68 77.54 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 120.059 1.3 . . . . 0.0 112.406 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -59.42 -29.22 67.6 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 126.922 2.639 . . . . 0.0 110.552 -157.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 34.7 p-10 -128.68 35.36 4.37 Favored 'General case' 0 N--CA 1.447 -0.587 1 C-N-CA 132.886 4.474 . . . . 0.0 115.339 172.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.415 79.3 m-20 61.98 18.3 9.76 Favored 'General case' 0 N--CA 1.45 -0.472 1 N-CA-C 122.293 4.183 . . . . 0.0 122.293 175.543 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.309 45.6 mt -78.71 -4.31 48.51 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 118.072 -2.893 . . . . 0.0 116.343 174.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 3.2 p-80 -71.39 -41.98 68.97 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 117.081 -1.438 . . . . 0.0 111.892 -170.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . 0.449 ' HB2' ' HD3' ' C' ' 37' ' ' PRO . 12.9 mt -64.2 -51.23 63.5 Favored Pre-proline 0 N--CA 1.446 -0.669 0 CA-C-O 116.017 -1.944 . . . . 0.0 110.923 174.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . 0.449 ' HD3' ' HB2' ' C' ' 36' ' ' LEU . 7.7 Cg_exo -45.22 -36.5 12.4 Favored 'Trans proline' 0 N--CA 1.452 -0.963 1 C-N-CA 130.296 7.331 . . . . 0.0 116.495 167.069 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.79 -44.84 22.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 116.552 -1.689 . . . . 0.0 110.019 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 36.2 mt -69.63 -28.88 66.29 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 126.21 2.194 . . . . 0.0 110.67 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -79.29 -14.8 58.78 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.918 2.487 . . . . 0.0 110.493 -177.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . 0.53 HD13 ' HA ' ' D' ' 88' ' ' SER . 58.4 tp -101.71 -42.74 6.08 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.034 3.334 . . . . 0.0 111.808 172.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 12.0 mmt -62.99 -22.65 66.99 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 117.41 2.374 . . . . 0.0 117.41 175.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mp -125.3 155.51 40.09 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.936 2.094 . . . . 0.0 115.092 -175.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 41.7 p -90.54 167.4 16.61 Favored Pre-proline 0 N--CA 1.45 -0.45 0 C-N-CA 129.136 2.975 . . . . 0.0 115.555 163.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -56.65 -38.36 95.75 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 N-CA-C 115.689 1.38 . . . . 0.0 115.689 177.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -68.76 -37.11 79.12 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 128.553 2.741 . . . . 0.0 108.442 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -71.66 -26.11 62.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 116.193 -1.86 . . . . 0.0 112.104 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . 0.256 34.0 mtm-85 -64.99 -47.48 77.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 127.688 2.395 . . . . 0.0 115.96 168.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.27 -49.3 77.62 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.587 1.955 . . . . 0.0 108.406 176.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -45.94 -52.91 10.82 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 126.225 2.203 . . . . 0.0 112.491 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 92.0 mt -66.89 -45.58 77.6 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 126.346 1.858 . . . . 0.0 113.03 -177.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.17 -29.03 67.62 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 121.433 1.924 . . . . 0.0 109.269 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 94.0 m -82.47 -41.42 19.81 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 121.175 -1.191 . . . . 0.0 110.249 -174.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.35 55.2 mtt180 -44.95 -38.27 4.58 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 116.045 1.869 . . . . 0.0 116.045 165.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 54.7 t -67.72 -38.3 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-O 114.093 -2.86 . . . . 0.0 109.547 174.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -70.79 -36.22 72.92 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 124.658 3.39 . . . . 0.0 113.799 170.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 70.5 mt -69.48 -27.7 35.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 122.336 2.335 . . . . 0.0 113.476 171.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 79.6 t -71.79 -29.49 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 117.056 2.243 . . . . 0.0 117.056 167.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -70.75 -43.36 68.99 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 128.766 2.826 . . . . 0.0 113.023 171.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -71.65 -42.42 67.57 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 119.548 1.067 . . . . 0.0 112.127 -176.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 90.8 mt -68.8 -33.29 73.61 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 117.351 -1.309 . . . . 0.0 113.507 174.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . 0.392 72.0 mt -56.59 -51.7 67.64 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 121.775 2.08 . . . . 0.0 110.115 164.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -59.13 -45.2 91.56 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.36 56.65 10.41 Favored Glycine 0 C--N 1.339 0.71 0 N-CA-C 106.75 -2.54 . . . . 0.0 106.75 174.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -125.45 57.96 1.31 Allowed 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 129.631 3.172 . . . . 0.0 103.719 168.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 34.0 mtt -136.69 142.61 43.15 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 127.618 2.367 . . . . 0.0 110.983 176.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 94.5 p -77.2 159.71 29.48 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 128.749 2.82 . . . . 0.0 115.711 163.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -58.73 -24.13 61.04 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.136 3.375 . . . . 0.0 111.325 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 31.3 ttp-105 -77.07 -35.0 56.96 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 167.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -75.23 -36.83 61.3 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 121.673 -0.642 . . . . 0.0 111.036 174.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.54 -14.46 42.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.081 -2.262 . . . . 0.0 113.947 171.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 47.7 tttt -94.4 -44.42 7.92 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 118.036 -2.915 . . . . 0.0 114.817 165.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -97.44 -23.28 16.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 126.893 2.077 . . . . 0.0 115.54 -163.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -94.35 -36.43 11.94 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 119.346 -2.096 . . . . 0.0 114.224 170.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 9.4 mp -88.25 -29.61 20.3 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.228 -1.844 . . . . 0.0 108.579 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 75.87 -154.25 44.85 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 122.038 2.199 . . . . 0.0 110.968 -176.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.71 -15.96 60.22 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 126.564 3.078 . . . . 0.0 111.959 174.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.79 -12.39 82.95 Favored Glycine 0 N--CA 1.446 -0.68 0 O-C-N 117.121 -3.487 . . . . 0.0 113.742 -166.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 13.9 tt -54.95 -40.07 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-O 115.471 -2.204 . . . . 0.0 110.989 170.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.24 -42.72 63.84 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 123.601 2.909 . . . . 0.0 112.652 174.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 3.4 m -50.47 -33.71 22.21 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 127.329 2.251 . . . . 0.0 115.726 176.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 32.1 mm -105.17 -10.68 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 126.539 1.936 . . . . 0.0 112.154 -171.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . 0.367 20.8 p -125.4 -15.97 6.01 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 119.344 3.091 . . . . 0.0 119.344 -167.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 38.9 mtp85 -110.83 164.94 12.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 O-C-N 119.799 -1.813 . . . . 0.0 112.468 162.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.88 160.48 17.85 Favored Glycine 0 C--N 1.339 0.72 0 C-N-CA 129.792 3.568 . . . . 0.0 111.44 -171.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 2.1 m -65.73 -7.31 14.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 116.858 2.17 . . . . 0.0 116.858 -173.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -105.47 7.24 32.99 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 -179.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 45.6 p -75.63 168.75 19.44 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 111.707 -3.996 . . . . 0.0 112.39 -170.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . 0.3 54.9 tp -65.93 -28.21 68.76 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 122.366 2.348 . . . . 0.0 113.454 -145.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 81.4 mttt -104.22 -14.54 15.79 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.998 1.272 . . . . 0.0 114.047 178.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.73 -38.12 88.29 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 117.21 -3.431 . . . . 0.0 115.066 155.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' C' ' 93' ' ' PRO . . . -47.33 153.46 0.95 Allowed Pre-proline 0 N--CA 1.449 -0.516 0 C-N-CA 128.868 2.867 . . . . 0.0 113.052 174.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' C' ' 92' ' ' ALA . 1.0 OUTLIER -65.7 149.98 86.63 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-O 124.838 1.933 . . . . 0.0 114.521 -172.547 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . 0.46 ' HA ' ' HB2' ' C' ' 97' ' ' ARG . 7.4 t -79.21 -24.07 12.63 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-O 114.559 -2.639 . . . . 0.0 106.913 -167.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 21.8 pm0 -75.24 -16.41 60.46 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 122.043 2.201 . . . . 0.0 113.488 171.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -86.41 -37.97 17.83 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 106.195 -1.78 . . . . 0.0 106.195 167.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . 0.46 ' HB2' ' HA ' ' C' ' 94' ' ' VAL . 66.6 mtp180 -68.12 -31.28 70.77 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 120.443 -1.411 . . . . 0.0 112.896 -170.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -84.72 -50.59 7.49 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.181 2.192 . . . . 0.0 110.118 -178.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 49.5 t90 -53.97 -40.4 66.85 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 172.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.42 -40.18 93.48 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 118.764 -2.46 . . . . 0.0 112.701 178.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -70.73 -33.85 71.27 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 120.519 1.509 . . . . 0.0 111.79 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -61.71 -27.25 68.57 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 116.516 2.043 . . . . 0.0 116.516 168.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 60.3 t -91.77 -53.28 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 114.327 -1.306 . . . . 0.0 111.756 -178.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 52.0 mt -91.99 -39.57 11.59 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 117.976 -1.489 . . . . 0.0 113.057 -166.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 11.0 mt -108.45 50.26 0.78 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 -173.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -96.1 144.89 25.95 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 119.333 -2.104 . . . . 0.0 113.808 -173.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 58.8 m -88.43 -1.23 57.93 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 127.435 2.294 . . . . 0.0 117.115 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 30.6 t0 . . . . . 0 C--O 1.249 1.038 0 C-N-CA 130.228 3.411 . . . . 0.0 112.157 174.862 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 43.4 mtp . . . . . 0 N--CA 1.47 0.536 0 CA-C-O 127.173 3.368 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.74 122.2 7.35 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 118.542 -2.599 . . . . 0.0 114.14 -176.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -85.18 91.33 8.11 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 114.908 -2.472 . . . . 0.0 108.3 -174.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -83.94 107.54 16.37 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 126.42 2.325 . . . . 0.0 112.859 178.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 96.2 p -85.09 170.67 12.72 Favored Pre-proline 0 N--CA 1.449 -0.498 0 CA-C-N 112.391 -2.186 . . . . 0.0 113.075 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -67.98 -32.86 27.56 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 N-CA-C 121.102 3.462 . . . . 0.0 121.102 -173.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -160.74 132.69 5.92 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 109.383 -3.553 . . . . 0.0 103.923 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.5 t -54.17 132.6 43.48 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 118.269 -2.769 . . . . 0.0 115.812 178.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.09 -34.62 73.73 Favored 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 117.58 -3.2 . . . . 0.0 114.737 176.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.98 -23.57 55.31 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 124.044 1.878 . . . . 0.0 111.173 -177.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -77.92 -35.7 50.25 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 117.128 -3.482 . . . . 0.0 111.095 173.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -41.6 98.29 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 121.986 0.898 . . . . 0.0 112.52 169.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -60.91 -52.18 66.14 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 113.71 -1.586 . . . . 0.0 108.644 169.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -55.1 -35.78 64.98 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 176.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.56 0.3 34.46 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 117.391 2.367 . . . . 0.0 117.391 172.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -101.69 -19.35 15.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 116.879 -1.928 . . . . 0.0 110.513 158.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 78.7 mm-40 -82.18 -31.4 30.43 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 115.098 1.518 . . . . 0.0 115.098 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -66.55 -27.11 67.48 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 119.168 -2.208 . . . . 0.0 112.273 165.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -73.8 -44.5 55.67 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.045 0.841 . . . . 0.0 112.406 173.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 73.3 mt -59.85 -16.75 31.27 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 118.342 2.719 . . . . 0.0 118.342 165.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -75.17 -40.91 59.1 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 125.404 2.526 . . . . 0.0 109.17 169.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -65.51 -47.0 77.48 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.014 -3.554 . . . . 0.0 110.907 171.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 58.6 t -55.52 -53.36 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-O 116.479 -1.724 . . . . 0.0 110.236 178.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -55.43 -36.58 66.66 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 118.597 2.814 . . . . 0.0 118.597 175.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 31.3 tp -76.72 -44.78 31.93 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 113.594 -1.639 . . . . 0.0 114.132 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.01 -41.04 99.47 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 113.369 -3.205 . . . . 0.0 111.103 170.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 15.2 ttpp -53.83 -57.22 11.69 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 122.319 2.327 . . . . 0.0 113.42 165.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -42.81 -48.88 5.78 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 116.468 -1.729 . . . . 0.0 113.186 164.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.359 . . -58.26 -38.37 76.8 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 120.454 1.479 . . . . 0.0 114.74 175.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -59.54 -31.4 69.37 Favored 'General case' 0 N--CA 1.454 -0.268 1 O-C-N 115.045 -4.784 . . . . 0.0 111.439 174.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -86.53 -23.35 25.9 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 126.919 2.088 . . . . 0.0 111.672 -167.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 50.4 p30 -122.95 5.08 9.35 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.985 1.314 . . . . 0.0 108.991 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.385 11.9 m-20 74.88 25.74 1.4 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 114.529 -2.653 . . . . 0.0 117.593 176.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . 0.269 66.0 mt -96.78 5.74 50.03 Favored 'General case' 0 N--CA 1.449 -0.483 0 O-C-N 126.456 2.348 . . . . 0.0 112.432 -172.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -80.49 -48.84 12.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 129.852 3.261 . . . . 0.0 111.72 -155.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 1.2 mt -50.77 -46.88 86.69 Favored Pre-proline 0 N--CA 1.451 -0.418 0 O-C-N 119.707 -1.87 . . . . 0.0 112.894 174.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.256 17.1 Cg_exo -70.23 -18.19 34.94 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 N-CA-C 117.731 2.166 . . . . 0.0 117.731 176.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 32.0 tp -77.32 -37.09 53.28 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.313 3.045 . . . . 0.0 108.886 167.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 58.3 mt -75.13 -38.88 60.88 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 115.372 -2.252 . . . . 0.0 108.789 -179.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -75.43 -22.2 57.54 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 128.523 3.64 . . . . 0.0 112.312 174.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 18.6 tp -70.72 -42.98 69.87 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 115.898 -2.001 . . . . 0.0 111.338 171.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 19.8 mmt -84.74 -36.34 21.85 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 129.148 2.979 . . . . 0.0 114.846 -171.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mt -122.35 126.98 49.19 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 125.049 2.357 . . . . 0.0 109.208 -171.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 68.2 p -78.32 166.62 41.76 Favored Pre-proline 0 N--CA 1.448 -0.534 0 CA-C-N 111.2 -2.727 . . . . 0.0 113.352 -176.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_exo -59.07 -43.84 39.32 Favored 'Trans proline' 0 N--CA 1.447 -1.21 0 CA-C-N 121.575 1.598 . . . . 0.0 114.912 -162.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.274 48.7 m-20 -75.37 -17.28 60.26 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 117.558 -3.214 . . . . 0.0 109.238 -177.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -74.25 -37.52 63.74 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 124.912 2.292 . . . . 0.0 108.602 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . 0.661 ' HD2' ' CZ2' ' C' ' 19' ' ' TRP . 17.1 mtm180 -76.72 -31.07 56.91 Favored 'General case' 0 N--CA 1.45 -0.459 1 C-N-CA 132.386 4.275 . . . . 0.0 108.599 174.155 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -66.85 -38.34 86.18 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 122.566 2.439 . . . . 0.0 109.549 168.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.277 . . -79.71 -36.89 36.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 114.718 -2.563 . . . . 0.0 116.635 -179.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 18.2 mt -61.16 -49.07 78.72 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 125.182 1.551 . . . . 0.0 114.418 164.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -52.37 -44.43 58.43 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 82.7 m -73.76 -23.33 59.72 Favored 'General case' 0 N--CA 1.447 -0.575 0 C-N-CA 127.212 2.205 . . . . 0.0 113.118 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -62.26 -20.69 64.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 117.428 -3.295 . . . . 0.0 115.288 166.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 43.7 t -66.59 -57.51 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 119.946 1.248 . . . . 0.0 108.216 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -69.31 -17.39 63.72 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 126.247 1.819 . . . . 0.0 112.837 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 31.8 mt -74.4 -44.2 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 O-C-N 118.055 -2.903 . . . . 0.0 110.803 173.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.45 -39.39 80.66 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 C-N-CA 128.274 2.63 . . . . 0.0 111.718 174.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -58.13 -49.44 76.97 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 117.931 -2.981 . . . . 0.0 109.731 176.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -70.42 -22.27 62.74 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 116.223 1.935 . . . . 0.0 116.223 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 46.1 mt -72.82 -28.51 62.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 121.44 1.927 . . . . 0.0 112.691 164.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . 0.415 HD22 ' HB2' ' D' ' 101' ' ' GLU . 78.9 mt -76.53 -36.89 57.43 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 120.835 1.652 . . . . 0.0 110.239 169.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -76.94 -33.88 57.67 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.437 0.695 . . . . 0.0 111.498 -173.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 45.31 52.46 8.58 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 121.909 3.523 . . . . 0.0 121.909 176.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -127.48 -12.69 5.55 Favored 'General case' 0 N--CA 1.444 -0.736 0 O-C-N 119.232 -2.334 . . . . 0.0 109.701 173.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 16.4 mmt -87.85 59.36 5.33 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.093 1.357 . . . . 0.0 109.977 164.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 1.5 p -66.23 144.72 56.45 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 119.94 3.311 . . . . 0.0 119.94 -171.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 49.03 -101.41 0.08 Allowed 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 128.768 2.827 . . . . 0.0 109.355 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -58.42 -37.38 75.24 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 115.038 -2.411 . . . . 0.0 114.785 -174.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -70.79 -38.73 73.38 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.279 1.99 . . . . 0.0 111.708 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.75 -35.6 81.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 117.992 -2.943 . . . . 0.0 112.13 169.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -76.68 -25.13 53.34 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 121.119 1.781 . . . . 0.0 115.691 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -119.85 -30.78 4.66 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 113.103 -3.332 . . . . 0.0 111.95 -171.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . 0.258 17.5 tp10 -94.99 -45.54 7.21 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 123.453 2.842 . . . . 0.0 110.899 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . 0.462 HD13 ' HA ' ' D' ' 75' ' ' LEU . 4.3 mm? -73.87 -50.51 19.95 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 102.676 -3.083 . . . . 0.0 102.676 170.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 94.33 -141.28 15.47 Favored Glycine 0 N--CA 1.448 -0.506 1 CA-C-O 129.212 4.784 . . . . 0.0 118.298 153.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.61 -33.38 73.81 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 118.694 -2.651 . . . . 0.0 113.616 -167.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.18 -25.56 25.77 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 126.175 1.845 . . . . 0.0 116.166 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 5.2 tt -65.39 -15.29 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 119.732 1.766 . . . . 0.0 115.597 -173.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.23 -44.16 65.91 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.902 -1.047 . . . . 0.0 113.571 173.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 26.4 m -61.64 -39.63 91.99 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 115.823 1.786 . . . . 0.0 115.823 170.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 45.6 mm -77.2 -34.98 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 O-C-N 120.864 -1.148 . . . . 0.0 111.131 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 70.0 p -104.01 -9.8 18.56 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 113.308 -3.234 . . . . 0.0 112.761 -174.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -96.16 -175.7 3.45 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 104.354 -2.461 . . . . 0.0 104.354 173.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 66.37 161.62 1.08 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 126.518 2.008 . . . . 0.0 112.445 -173.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 57.1 p -77.49 -22.5 51.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 116.142 1.905 . . . . 0.0 116.142 -148.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 72.0 m-80 -121.67 62.71 0.92 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 131.335 3.854 . . . . 0.0 111.093 175.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . 0.53 ' HA ' HD13 ' C' ' 41' ' ' LEU . 84.0 p -85.41 175.92 8.58 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 125.821 2.724 . . . . 0.0 115.324 171.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.39 -11.56 60.28 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 118.933 -2.354 . . . . 0.0 110.977 161.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -71.22 -18.18 62.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 162.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -118.21 -23.38 7.34 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 116.947 2.202 . . . . 0.0 116.947 -165.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 42.62 85.85 0.15 Allowed Pre-proline 0 N--CA 1.449 -0.488 0 CA-C-O 124.298 1.999 . . . . 0.0 111.707 169.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo 20.11 45.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.123 0 O-C-N 116.84 -2.242 . . . . 0.0 114.45 51.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -58.95 -23.79 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 C-N-CA 127.363 2.265 . . . . 0.0 106.747 -175.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.53 -27.76 11.2 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 117.31 -1.329 . . . . 0.0 109.207 -160.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 34.5 tp -60.92 -54.24 47.51 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 128.486 2.715 . . . . 0.0 107.003 152.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 43.7 ttp180 -55.34 -52.81 62.29 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 124.739 3.427 . . . . 0.0 112.857 175.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -56.39 -24.78 46.84 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 124.2 3.182 . . . . 0.0 115.868 172.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . 0.429 ' CZ2' HG21 ' D' ' 103' ' ' VAL . 84.6 t90 -85.11 -40.93 16.2 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 123.238 1.494 . . . . 0.0 112.475 176.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.06 -35.25 79.61 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 118.331 -2.73 . . . . 0.0 108.967 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . 0.415 ' HB2' HD22 ' D' ' 62' ' ' LEU . 18.1 tt0 -68.08 -4.84 14.85 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 112.635 -2.075 . . . . 0.0 114.051 176.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -119.21 -33.63 4.08 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 119.331 -0.948 . . . . 0.0 108.599 177.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . 0.429 HG21 ' CZ2' ' D' ' 99' ' ' TRP . 25.4 t -77.34 -36.21 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 116.169 1.915 . . . . 0.0 116.169 171.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 24.6 mt -80.24 -39.38 29.13 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 127.923 2.489 . . . . 0.0 112.659 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 15.1 mt -110.84 37.41 2.8 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 126.62 3.105 . . . . 0.0 111.622 -174.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -58.08 165.71 1.81 Allowed 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.526 -2.609 . . . . 0.0 112.113 176.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 59.6 m -44.79 -36.48 3.25 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 129.258 3.023 . . . . 0.0 114.692 173.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 . . . . . 0 C--O 1.253 1.242 0 C-N-CA 129.175 2.99 . . . . 0.0 115.48 -178.612 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 113.457 -3.163 . . . . 0.0 113.011 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -35.53 -52.0 0.65 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 124.341 3.246 . . . . 0.0 115.427 177.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -83.02 -15.1 52.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 128.67 2.788 . . . . 0.0 116.88 -171.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -87.57 -22.73 24.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 117.322 -1.323 . . . . 0.0 114.174 -166.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.51 159.78 52.15 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 121.284 1.856 . . . . 0.0 112.862 -172.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -81.86 -11.79 11.17 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 C-N-CA 124.715 3.61 . . . . 0.0 113.061 174.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -137.2 145.08 43.24 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.292 2.237 . . . . 0.0 114.399 165.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 33.4 t -120.93 124.3 44.6 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 126.895 2.078 . . . . 0.0 107.681 170.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.94 -33.27 21.21 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.027 0.931 . . . . 0.0 110.613 -177.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.88 -44.94 96.39 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 117.044 2.238 . . . . 0.0 117.044 163.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -28.15 67.94 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 117.466 -3.271 . . . . 0.0 115.403 170.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.39 -41.72 88.92 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 125.735 2.683 . . . . 0.0 114.014 171.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -71.5 -32.62 68.43 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 127.22 2.208 . . . . 0.0 112.105 171.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -60.33 -46.89 88.29 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.498 -2.001 . . . . 0.0 113.145 165.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.7 mmt-85 -70.32 -31.6 68.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 115.762 -2.066 . . . . 0.0 112.581 -176.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.8 t60 -58.06 -50.88 71.91 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 116.038 -1.934 . . . . 0.0 111.796 165.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -53.53 -41.08 66.01 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.164 1.785 . . . . 0.0 113.421 174.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . 0.254 34.7 tt0 -60.19 -49.86 75.95 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 126.187 1.795 . . . . 0.0 110.013 170.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -57.77 -61.07 2.78 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 118.394 -2.691 . . . . 0.0 117.014 172.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.8 mt -55.88 -29.17 59.56 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -175.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -47.89 -43.48 28.73 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 128.547 2.739 . . . . 0.0 111.023 168.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -67.15 -43.23 82.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 119.72 -1.862 . . . . 0.0 110.198 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.7 t -66.23 -36.81 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-O 113.722 -3.037 . . . . 0.0 111.171 175.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -61.99 -58.33 8.29 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 121.168 1.804 . . . . 0.0 109.67 168.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 36.8 tp -47.12 -54.62 10.08 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 120.171 -1.581 . . . . 0.0 113.17 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 36.3 tp -62.35 -39.95 94.8 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 124.137 3.153 . . . . 0.0 113.271 176.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -54.87 -35.77 64.4 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 127.003 3.287 . . . . 0.0 111.406 170.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -90.48 -6.28 55.01 Favored 'General case' 0 N--CA 1.452 -0.341 1 O-C-N 116.208 -4.057 . . . . 0.0 112.244 -177.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.0 -31.67 17.99 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 119.376 0.989 . . . . 0.0 111.961 163.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -50.95 -37.1 42.34 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.238 -2.163 . . . . 0.0 111.63 165.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -81.64 -10.46 59.41 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 121.91 2.141 . . . . 0.0 116.309 -174.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -109.76 -1.44 17.95 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.678 1.191 . . . . 0.0 113.771 172.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.442 12.4 m-20 63.94 34.52 11.51 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.822 2.049 . . . . 0.0 114.574 -175.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 78.6 mt -107.14 13.72 27.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 128.748 2.819 . . . . 0.0 113.978 174.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.3 p-80 -63.24 -60.04 3.93 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 116.091 1.886 . . . . 0.0 116.091 172.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . 0.27 14.3 mt -59.92 -43.18 94.01 Favored Pre-proline 0 N--CA 1.449 -0.494 0 O-C-N 125.056 1.472 . . . . 0.0 112.734 -177.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -45.46 -57.63 2.04 Favored 'Trans proline' 0 N--CA 1.448 -1.164 0 C-N-CA 123.216 2.611 . . . . 0.0 117.48 160.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.52 -40.38 92.9 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 117.605 -3.184 . . . . 0.0 117.375 178.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.3 mt -53.79 -35.18 61.06 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 115.793 -2.051 . . . . 0.0 110.434 169.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 -81.2 -10.45 59.62 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 120.789 1.631 . . . . 0.0 112.475 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.5 tt -92.68 -32.75 14.62 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 116.976 -3.578 . . . . 0.0 114.839 169.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 94.8 mmm -92.01 -17.59 24.86 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 120.065 3.358 . . . . 0.0 120.065 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.5 mt -120.6 129.83 53.92 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 169.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.9 p -70.34 154.11 94.71 Favored Pre-proline 0 N--CA 1.449 -0.481 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -49.01 -51.37 10.69 Favored 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 124.739 3.626 . . . . 0.0 119.089 -172.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.42 -9.59 58.74 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 116.863 -3.648 . . . . 0.0 115.269 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -81.92 -43.03 18.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 117.616 -3.177 . . . . 0.0 110.889 168.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 78.6 mtm-85 -54.28 -41.83 69.33 Favored 'General case' 0 N--CA 1.445 -0.693 1 O-C-N 114.666 -5.021 . . . . 0.0 112.226 171.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -65.83 -50.02 66.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 110.672 -2.967 . . . . 0.0 110.829 174.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.95 -33.6 62.49 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.953 2.101 . . . . 0.0 113.187 174.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.5 mt -88.75 -21.74 23.67 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 114.674 -2.584 . . . . 0.0 108.785 -175.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.93 -46.85 92.72 Favored Glycine 0 C--N 1.337 0.626 0 CA-C-N 121.391 1.905 . . . . 0.0 111.098 162.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.6 m -61.76 -28.67 69.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.132 -2.393 . . . . 0.0 110.462 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -60.68 -33.4 72.78 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 115.551 -2.166 . . . . 0.0 113.485 175.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.2 t -65.63 -40.33 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 121.592 1.996 . . . . 0.0 112.809 169.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -66.2 -23.17 66.39 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 122.641 2.473 . . . . 0.0 116.961 170.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.279 72.7 mt -64.67 -52.84 49.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-O 125.188 2.423 . . . . 0.0 109.101 168.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.4 t -68.55 -29.33 43.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 CA-C-N 113.208 -1.815 . . . . 0.0 111.879 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -63.59 -44.98 92.45 Favored 'General case' 0 N--CA 1.447 -0.619 0 O-C-N 118.604 -2.56 . . . . 0.0 112.816 174.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -83.9 -10.97 57.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -178.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 21.5 mt -78.74 -41.23 31.3 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 120.542 -1.349 . . . . 0.0 109.878 166.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 21.2 tp -82.2 -43.44 17.66 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 115.475 -2.203 . . . . 0.0 107.476 -166.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.6 ttm105 -62.59 -36.97 84.41 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 126.317 2.261 . . . . 0.0 112.258 166.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.84 14.29 81.67 Favored Glycine 0 C--N 1.336 0.568 0 CA-C-N 122.392 2.36 . . . . 0.0 116.082 162.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -81.58 -28.58 33.75 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 129.255 3.022 . . . . 0.0 112.955 173.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.8 mtt -100.69 141.39 33.64 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 123.9 1.809 . . . . 0.0 108.399 -174.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 93.2 p -93.95 165.17 12.79 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.778 165.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -56.35 -35.48 67.71 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 125.72 2.676 . . . . 0.0 116.094 178.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 49.1 tpt85 -73.59 -21.23 60.39 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.808 -2.433 . . . . 0.0 110.532 -177.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -79.22 -42.53 25.79 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 113.911 -2.947 . . . . 0.0 110.55 166.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 57.4 mt -70.77 -18.36 62.76 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 115.612 -2.435 . . . . 0.0 114.752 177.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 tptt -57.25 -34.75 68.93 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.736 2.014 . . . . 0.0 111.804 169.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -90.83 -59.57 2.14 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.186 1.794 . . . . 0.0 107.914 167.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -62.32 -26.71 68.57 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 128.552 2.741 . . . . 0.0 117.829 -166.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.5 mt -122.82 11.35 9.68 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 126.393 1.877 . . . . 0.0 114.383 165.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 57.52 20.53 38.46 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 120.309 1.413 . . . . 0.0 114.26 -171.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -79.99 139.03 37.17 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.128 1.771 . . . . 0.0 114.051 -161.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.42 103.57 1.53 Allowed Glycine 0 CA--C 1.523 0.56 0 C-N-CA 127.908 2.671 . . . . 0.0 109.571 172.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 67.6 mt -37.61 -48.83 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 128.877 2.871 . . . . 0.0 112.347 -179.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.32 -34.45 74.66 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 129.731 3.212 . . . . 0.0 110.972 -172.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 13.3 p -65.31 -45.81 82.85 Favored 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 119.24 -2.162 . . . . 0.0 111.788 167.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.0 mm -63.64 -32.06 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 O-C-N 117.604 -3.185 . . . . 0.0 110.952 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 m -49.97 -52.52 33.03 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 118.645 -2.534 . . . . 0.0 115.137 165.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -59.55 -42.29 92.05 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 125.32 1.638 . . . . 0.0 110.729 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.86 -40.67 99.15 Favored Glycine 0 CA--C 1.524 0.622 0 CA-C-N 113.06 -1.882 . . . . 0.0 113.65 -177.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.9 m -61.74 -34.9 76.65 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 113.529 -3.129 . . . . 0.0 110.877 171.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -75.8 -30.17 58.97 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 120.771 1.623 . . . . 0.0 114.561 177.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 17.8 m -68.39 -34.97 76.99 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 115.902 -1.999 . . . . 0.0 109.967 171.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 67.9 tp -77.58 -45.61 24.72 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 117.255 -1.355 . . . . 0.0 111.41 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -53.76 -45.64 70.69 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 130.264 3.425 . . . . 0.0 108.262 169.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.25 -34.94 75.97 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 126.073 1.749 . . . . 0.0 115.302 176.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.05 171.87 4.19 Favored Pre-proline 0 N--CA 1.447 -0.614 0 O-C-N 119.496 -2.003 . . . . 0.0 113.321 -168.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . 0.317 28.5 Cg_exo -67.79 131.74 24.95 Favored 'Trans proline' 0 N--CA 1.447 -1.258 1 C-N-CA 126.847 5.032 . . . . 0.0 116.615 178.514 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.1 m -45.08 -39.93 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 N-CA-C 117.838 2.533 . . . . 0.0 117.838 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.1 pm0 -75.93 -31.84 59.31 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 118.26 -2.775 . . . . 0.0 110.796 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.495 HD12 HD13 ' B' ' 34' ' ' LEU . 15.7 tp -64.87 -41.95 95.24 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 112.696 -3.526 . . . . 0.0 111.394 164.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 89.1 mtm-85 -64.53 -43.47 93.91 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 126.167 2.167 . . . . 0.0 111.572 -179.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -56.32 -20.86 20.87 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.376 2.27 . . . . 0.0 113.752 170.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -94.78 -46.26 6.98 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 127.562 3.553 . . . . 0.0 110.378 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 29.2 mt -56.32 -26.69 53.2 Favored 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 115.373 -4.579 . . . . 0.0 111.263 171.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -70.65 -24.85 62.78 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 118.11 -2.869 . . . . 0.0 117.433 170.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -101.41 -4.17 27.4 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.29 1.836 . . . . 0.0 111.968 176.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . 0.301 59.6 t -122.67 -36.66 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -170.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.2 mt -82.36 -54.83 4.91 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 117.866 -3.021 . . . . 0.0 115.135 165.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.7 mt -70.08 -3.89 18.63 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.747 2.019 . . . . 0.0 112.832 -167.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.264 28.9 tttt -101.5 0.37 36.51 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 129.597 3.159 . . . . 0.0 113.694 -166.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.8 p -75.37 -9.03 58.2 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 120.102 3.371 . . . . 0.0 120.102 160.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.256 1.399 0 CA-C-O 123.981 1.848 . . . . 0.0 114.367 -166.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 15.2 tmm? . . . . . 0 N--CA 1.472 0.664 0 CA-C-O 115.565 -2.16 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -56.72 -24.72 51.56 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 122.232 2.287 . . . . 0.0 115.566 -165.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -75.85 -36.71 59.5 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 127.259 2.224 . . . . 0.0 109.015 -178.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -92.25 -24.05 19.12 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 124.345 1.058 . . . . 0.0 111.529 -163.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -86.98 131.59 44.41 Favored Pre-proline 0 N--CA 1.446 -0.668 0 C-N-CA 128.438 2.695 . . . . 0.0 108.578 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -81.48 0.15 10.1 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 O-C-N 115.483 -2.956 . . . . 0.0 117.081 -174.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -123.88 135.46 53.74 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 126.311 2.257 . . . . 0.0 111.32 158.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 1.3 t -133.66 141.81 47.77 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 120.742 -1.224 . . . . 0.0 112.651 161.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.25 -39.91 84.32 Favored 'General case' 0 N--CA 1.448 -0.571 1 O-C-N 116.255 -4.028 . . . . 0.0 116.896 172.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.89 -43.8 82.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 125.95 2.031 . . . . 0.0 111.236 175.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 36.9 mtt -69.73 -34.77 74.31 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 114.152 -2.832 . . . . 0.0 110.402 176.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.68 -40.68 93.05 Favored 'General case' 0 N--CA 1.449 -0.509 1 O-C-N 130.196 4.685 . . . . 0.0 111.766 177.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 32.1 tp10 -65.46 -29.56 70.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 126.474 3.035 . . . . 0.0 116.86 171.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -68.36 -37.99 81.0 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 125.326 2.489 . . . . 0.0 116.761 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 51.9 mmt-85 -81.34 -20.0 41.61 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 115.036 -2.411 . . . . 0.0 111.078 176.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -61.53 -57.24 12.91 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 122.502 2.41 . . . . 0.0 108.064 162.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.35 -31.68 72.98 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 123.107 2.685 . . . . 0.0 116.767 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.69 -39.25 83.93 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 117.648 2.462 . . . . 0.0 117.648 165.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 11.8 t-105 -74.69 -46.91 34.64 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.708 2.003 . . . . 0.0 107.385 175.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 83.7 mt -58.93 -17.94 29.04 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 118.105 -2.872 . . . . 0.0 114.996 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . 0.381 49.4 ttt180 -67.55 -45.04 76.79 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 126.172 1.789 . . . . 0.0 113.527 168.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -60.03 -39.66 86.67 Favored 'General case' 0 N--CA 1.451 -0.4 1 O-C-N 115.997 -4.189 . . . . 0.0 119.492 165.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.01 -34.14 67.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-O 122.656 1.217 . . . . 0.0 110.738 176.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -61.88 -47.91 82.86 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 116.719 -3.738 . . . . 0.0 110.771 173.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 51.6 tp -62.79 -41.58 99.32 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.974 1.845 . . . . 0.0 109.061 -173.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.327 14.1 tp -76.46 -28.49 56.54 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 124.003 1.859 . . . . 0.0 115.917 -178.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -62.98 -37.52 87.46 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 119.04 -2.287 . . . . 0.0 111.987 164.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -79.41 -23.29 43.33 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 119.622 -1.924 . . . . 0.0 110.727 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.49 -32.34 32.5 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -69.61 -35.79 75.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 124.107 3.14 . . . . 0.0 113.921 167.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.33 -8.97 4.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 120.469 3.507 . . . . 0.0 120.469 159.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . 0.266 65.2 m-80 -128.74 9.79 5.95 Favored 'General case' 0 N--CA 1.449 -0.482 0 O-C-N 116.389 -3.945 . . . . 0.0 110.002 -175.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.489 5.2 m-20 55.65 9.7 0.44 Allowed 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 121.137 3.754 . . . . 0.0 121.137 -168.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.495 HD13 HD12 ' A' ' 96' ' ' LEU . 25.3 mt -82.04 10.0 7.41 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 113.654 -1.612 . . . . 0.0 115.078 176.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . 0.266 18.5 p-80 -61.3 -49.92 75.07 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 119.801 -1.812 . . . . 0.0 112.783 -170.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.337 54.8 mt -63.07 -55.29 38.57 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-O 115.724 -2.084 . . . . 0.0 113.679 176.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -42.23 -36.24 4.01 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 N-CA-C 118.918 2.622 . . . . 0.0 118.918 168.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 58.6 tp -87.23 -28.35 22.42 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.141 0.428 . . . . 0.0 111.291 -176.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 19.8 mt -79.9 -34.07 39.37 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 120.833 -1.167 . . . . 0.0 113.362 172.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . 0.44 ' HA ' ' NH1' ' B' ' 48' ' ' ARG . 86.8 m-20 -60.8 -42.97 98.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 113.309 -3.234 . . . . 0.0 108.032 167.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -61.89 -55.59 28.07 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 126.245 2.216 . . . . 0.0 112.14 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.0 mmt -82.85 -31.5 27.98 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 126.398 2.311 . . . . 0.0 114.759 -165.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 33.4 mt -108.3 127.13 53.59 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 104.715 -2.328 . . . . 0.0 104.715 -179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 24.3 p -69.59 157.4 89.64 Favored Pre-proline 0 N--CA 1.448 -0.538 0 C-N-CA 125.393 1.477 . . . . 0.0 113.741 172.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.67 -29.79 63.08 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 123.68 2.92 . . . . 0.0 115.721 -176.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.05 -21.04 43.91 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 125.244 1.59 . . . . 0.0 114.429 178.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -84.15 -28.11 27.65 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 169.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . 0.44 ' NH1' ' HA ' ' B' ' 40' ' ' ASN . 25.1 mtm180 -70.86 -46.77 62.09 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 117.703 -3.123 . . . . 0.0 107.076 171.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -58.72 -37.61 76.52 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.102 1.501 . . . . 0.0 114.007 170.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.88 -45.32 95.03 Favored 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 119.666 -1.896 . . . . 0.0 114.31 169.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 12.0 mt -68.51 -43.42 76.85 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 117.33 -1.748 . . . . 0.0 112.426 -174.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.11 -30.27 60.54 Favored Glycine 0 CA--C 1.525 0.715 0 O-C-N 125.427 1.704 . . . . 0.0 115.485 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 20.6 m -73.85 -44.41 55.66 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 174.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 38.2 mtt180 -60.56 -27.9 68.04 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.064 -3.523 . . . . 0.0 110.74 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 90.9 t -41.76 -62.75 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 123.245 2.748 . . . . 0.0 114.5 162.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 -71.13 -29.09 64.81 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -166.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 19.1 mt -71.45 -44.51 71.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 C-N-CA 126.795 2.038 . . . . 0.0 112.572 177.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 93.7 t -66.76 -41.8 88.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 124.332 2.015 . . . . 0.0 111.232 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -52.67 -49.19 65.75 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 115.343 1.608 . . . . 0.0 115.343 168.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . 0.254 22.8 tp10 -68.35 -30.45 69.42 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 113.169 -3.3 . . . . 0.0 109.798 174.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 8.5 mt -66.58 -25.11 66.47 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 123.353 2.797 . . . . 0.0 111.568 172.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 48.4 mt -86.61 -28.68 23.11 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 124.52 1.138 . . . . 0.0 109.614 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 28.5 ttm105 -83.02 -44.86 14.74 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 118.855 2.909 . . . . 0.0 118.855 -171.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.79 64.19 3.72 Favored Glycine 0 CA--C 1.522 0.47 0 O-C-N 119.256 -2.152 . . . . 0.0 114.638 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -128.39 -36.13 1.92 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 127.298 2.239 . . . . 0.0 109.077 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 60.0 mtp -81.16 134.31 35.61 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 118.526 -2.609 . . . . 0.0 116.117 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 88.5 p -84.29 174.41 10.17 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 125.322 1.639 . . . . 0.0 113.255 168.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -64.47 -36.47 84.3 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.293 -2.129 . . . . 0.0 113.657 -169.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -72.25 -35.88 68.91 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 120.029 -1.669 . . . . 0.0 112.923 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -68.72 -40.75 79.79 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 113.457 -1.701 . . . . 0.0 109.051 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 87.5 mt -58.93 -61.45 2.63 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 127.181 2.192 . . . . 0.0 112.21 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -53.58 -50.55 65.35 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 128.342 2.657 . . . . 0.0 112.974 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -104.14 -7.44 20.18 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 128.129 3.393 . . . . 0.0 109.764 -165.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -118.47 -7.04 10.7 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 125.201 3.637 . . . . 0.0 111.466 173.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 36.4 mt -122.09 -17.24 7.28 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 113.985 -2.912 . . . . 0.0 115.316 168.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.56 16.85 78.68 Favored Glycine 0 C--N 1.336 0.533 0 CA-C-N 125.08 3.582 . . . . 0.0 119.376 -168.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -105.23 71.03 0.92 Allowed 'General case' 0 N--CA 1.447 -0.58 1 C-N-CA 132.278 4.231 . . . . 0.0 106.571 -160.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.92 179.58 44.54 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 119.805 -1.188 . . . . 0.0 115.749 172.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 51.2 mm -44.85 -51.27 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-O 115.788 -2.054 . . . . 0.0 114.089 -171.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.8 -32.02 73.39 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 117.272 2.323 . . . . 0.0 117.272 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 2.9 m -66.59 -43.07 85.88 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 31.4 mm -70.08 -42.25 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 C-N-CA 130.228 3.411 . . . . 0.0 113.432 168.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 26.3 m -59.17 -51.04 71.71 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 118.284 -2.76 . . . . 0.0 109.52 172.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -63.11 -42.58 99.59 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 114.916 -2.469 . . . . 0.0 113.077 175.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.84 -45.16 90.05 Favored Glycine 0 CA--C 1.522 0.499 0 O-C-N 125.703 1.877 . . . . 0.0 115.779 -176.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 88.2 p -62.88 -39.85 95.72 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 164.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -68.07 -37.46 81.28 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 117.074 -3.516 . . . . 0.0 112.469 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 48.1 m -74.41 -0.75 18.34 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 171.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 2.2 mt -95.77 -43.52 7.84 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 128.271 2.628 . . . . 0.0 116.548 167.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 54.8 tttm -68.84 -31.76 70.95 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 123.003 0.521 . . . . 0.0 110.698 169.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.74 -14.72 60.33 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 129.554 3.141 . . . . 0.0 117.227 166.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.38 148.36 98.71 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-N 121.599 2.0 . . . . 0.0 108.9 165.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -72.71 151.53 52.04 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 122.598 2.198 . . . . 0.0 115.308 169.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.323 31.4 m -62.71 -34.84 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 O-C-N 118.892 -2.38 . . . . 0.0 117.362 -166.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -50.62 -34.51 26.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 128.204 2.602 . . . . 0.0 111.63 172.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 7.0 tp -97.23 -38.61 9.62 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 115.952 -1.975 . . . . 0.0 108.333 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 26.0 mtp85 -47.87 -51.91 21.25 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 121.748 2.067 . . . . 0.0 111.552 171.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -62.86 -28.64 70.17 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 117.365 2.357 . . . . 0.0 117.365 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -71.26 -60.4 2.25 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.35 1.86 . . . . 0.0 110.702 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 96.4 mt -54.49 -43.79 72.09 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -66.48 -13.94 61.55 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -104.19 -8.51 19.34 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 126.478 1.911 . . . . 0.0 114.134 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 39.4 t -111.55 -43.55 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 123.38 1.562 . . . . 0.0 107.875 -177.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.96 -47.17 39.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 116.948 -3.595 . . . . 0.0 109.567 -178.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 84.0 mt -72.25 -24.25 61.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 117.75 -1.58 . . . . 0.0 112.701 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -90.25 -8.97 49.66 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 119.373 -2.08 . . . . 0.0 111.329 -178.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 68.3 m -71.89 -22.77 61.46 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 165.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.394 61.9 m-20 . . . . . 0 C--O 1.249 1.036 0 N-CA-C 117.117 2.266 . . . . 0.0 117.117 161.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ttt . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.61 170.36 15.93 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 118.454 -1.299 . . . . 0.0 113.832 172.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -130.81 149.72 52.32 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 113.485 -1.689 . . . . 0.0 108.542 177.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -121.48 153.49 37.86 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 124.155 3.161 . . . . 0.0 109.492 177.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 94.9 p -143.85 169.7 9.84 Favored Pre-proline 0 N--CA 1.45 -0.436 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 172.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -89.8 -27.24 0.34 Allowed 'Trans proline' 0 N--CA 1.449 -1.113 0 C-N-CA 116.873 -1.618 . . . . 0.0 114.333 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -140.88 144.29 35.17 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 117.167 -1.397 . . . . 0.0 114.16 176.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.7 t -148.06 118.53 7.42 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 125.335 1.647 . . . . 0.0 113.243 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.71 -12.31 2.85 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 157.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.87 -40.76 95.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 123.485 2.857 . . . . 0.0 115.399 163.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 39.2 mtt -79.38 -36.98 38.4 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 124.067 1.889 . . . . 0.0 110.513 -172.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.06 -36.04 60.18 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 128.549 2.74 . . . . 0.0 112.158 175.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -79.58 -37.69 35.74 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 119.4 -2.063 . . . . 0.0 109.724 175.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -70.56 -43.79 68.77 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 120.36 1.437 . . . . 0.0 112.334 -178.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -30.69 71.59 Favored 'General case' 0 N--CA 1.446 -0.627 0 O-C-N 119.269 -2.144 . . . . 0.0 114.09 174.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -72.78 -48.38 38.73 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 126.6 2.437 . . . . 0.0 110.964 171.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -61.47 -24.01 66.27 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 112.748 -3.501 . . . . 0.0 113.871 171.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -59.65 -39.01 82.98 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 123.794 2.997 . . . . 0.0 115.999 164.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 65.3 t-105 -78.22 -41.3 34.8 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.067 -1.424 . . . . 0.0 110.58 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 4.8 mp -67.12 -17.69 64.98 Favored 'General case' 0 N--CA 1.447 -0.603 0 O-C-N 119.927 -1.733 . . . . 0.0 110.715 174.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 26.2 ttt180 -82.98 -38.56 22.52 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 118.159 -2.838 . . . . 0.0 116.668 175.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' D' ' 51' ' ' LEU . 73.8 t80 -55.46 -38.79 69.52 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 113.383 -1.735 . . . . 0.0 110.405 165.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 5.6 t -70.6 -41.94 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 O-C-N 118.91 -2.369 . . . . 0.0 108.466 -177.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -72.71 -25.62 61.3 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 119.077 2.991 . . . . 0.0 119.077 176.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 49.1 tp -71.63 -40.49 69.71 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 52.7 tp -69.35 -40.28 77.61 Favored 'General case' 0 N--CA 1.451 -0.375 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -44.0 -51.5 7.71 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 123.342 1.544 . . . . 0.0 114.187 178.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -79.67 -13.4 59.51 Favored 'General case' 0 N--CA 1.45 -0.425 0 O-C-N 119.311 -2.118 . . . . 0.0 113.269 -175.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.31 -28.49 61.19 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 120.977 1.717 . . . . 0.0 114.968 177.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -65.19 -22.97 66.97 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 117.867 -3.021 . . . . 0.0 109.598 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.79 -20.74 61.1 Favored 'General case' 0 N--CA 1.448 -0.564 1 O-C-N 113.869 -5.519 . . . . 0.0 110.947 -166.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -126.66 30.4 5.53 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 118.545 -2.597 . . . . 0.0 113.677 168.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 42.16 44.84 3.33 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 129.151 2.98 . . . . 0.0 115.262 -173.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.264 95.9 mt -93.55 -10.0 36.3 Favored 'General case' 0 N--CA 1.448 -0.549 1 C-N-CA 132.125 4.17 . . . . 0.0 109.71 172.801 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 29.4 p-80 -47.9 -41.81 25.39 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 130.947 3.699 . . . . 0.0 109.653 168.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 7.9 mt -76.34 -52.35 2.37 Favored Pre-proline 0 N--CA 1.45 -0.452 1 O-C-N 115.612 -4.43 . . . . 0.0 117.074 174.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -49.43 -33.58 30.2 Favored 'Trans proline' 0 N--CA 1.448 -1.174 0 C-N-CA 123.751 2.967 . . . . 0.0 118.54 164.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 18.8 tp -65.74 -39.18 90.85 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.005 -2.309 . . . . 0.0 115.337 168.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 66.9 mt -84.8 -16.22 42.2 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 121.986 2.175 . . . . 0.0 115.422 172.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -85.38 -5.12 59.33 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 129.336 3.054 . . . . 0.0 113.816 163.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 54.7 tp -91.77 -64.59 1.1 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 116.025 -1.941 . . . . 0.0 110.971 156.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -83.46 -5.83 59.28 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 119.642 3.201 . . . . 0.0 119.642 -162.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mp -114.85 155.06 27.49 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 112.731 -2.032 . . . . 0.0 111.915 162.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . 0.427 ' HB ' ' CD ' ' C' ' 45' ' ' PRO . 58.6 p -94.23 173.56 4.51 Favored Pre-proline 0 N--CA 1.449 -0.495 0 C-N-CA 129.965 3.306 . . . . 0.0 110.624 166.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . 0.427 ' CD ' ' HB ' ' C' ' 44' ' ' THR . 16.8 Cg_exo -70.91 -30.91 16.23 Favored 'Trans proline' 0 N--CA 1.451 -0.989 1 C-N-CA 125.815 4.344 . . . . 0.0 111.385 -168.109 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -43.59 97.01 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 127.073 2.149 . . . . 0.0 108.44 178.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -71.53 -24.12 61.89 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 125.132 1.373 . . . . 0.0 114.465 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 82.8 mtm-85 -80.28 -33.02 38.04 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 117.156 -3.465 . . . . 0.0 108.968 170.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -64.76 -42.77 94.89 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 123.226 1.488 . . . . 0.0 113.827 175.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.79 -56.58 18.79 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 128.705 2.802 . . . . 0.0 109.671 175.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 79.9 mt -56.6 -39.81 74.23 Favored 'General case' 0 N--CA 1.446 -0.641 1 O-C-N 116.146 -4.096 . . . . 0.0 116.823 170.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.63 -18.89 46.74 Favored Glycine 0 N--CA 1.448 -0.506 0 O-C-N 119.643 -1.91 . . . . 0.0 114.598 170.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 19.7 m -92.5 -43.54 9.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 112.945 -1.628 . . . . 0.0 110.714 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -63.68 -37.65 88.15 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 115.61 -2.138 . . . . 0.0 107.747 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 6.8 t -52.9 -47.49 52.58 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-N 124.332 3.242 . . . . 0.0 114.346 170.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -65.36 -38.39 89.92 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 115.68 -2.105 . . . . 0.0 114.254 173.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 20.8 mt -65.14 -45.43 94.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 123.294 2.77 . . . . 0.0 107.316 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 24.3 t -57.95 -37.87 63.37 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 115.503 -2.189 . . . . 0.0 112.171 167.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -70.92 -41.27 71.43 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 124.159 3.163 . . . . 0.0 113.324 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -66.48 -36.33 82.46 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 114.402 -2.713 . . . . 0.0 111.427 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 63.7 mt -70.94 -37.62 72.85 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 122.688 2.495 . . . . 0.0 114.276 172.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 35.8 mt -77.53 -22.23 51.44 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 114.645 -2.822 . . . . 0.0 109.9 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -67.34 -51.64 49.95 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.069 -2.269 . . . . 0.0 112.502 165.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.27 21.02 74.19 Favored Glycine 0 CA--C 1.521 0.429 0 O-C-N 117.824 -3.048 . . . . 0.0 118.483 177.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . 0.501 30.6 tt0 -83.48 40.35 0.72 Allowed 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 128.425 2.69 . . . . 0.0 113.995 171.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 23.2 mmt -110.42 119.19 38.39 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -173.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 85.1 p -80.75 160.06 25.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.291 -3.381 . . . . 0.0 113.46 161.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.98 -30.2 61.41 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 119.275 -2.141 . . . . 0.0 112.718 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . 0.253 35.9 ttp-105 -58.7 -45.21 90.03 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 119.966 3.321 . . . . 0.0 119.966 161.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -76.16 -29.58 57.79 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 126.569 2.418 . . . . 0.0 112.03 -177.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.92 -16.66 52.6 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 117.326 -3.359 . . . . 0.0 115.799 171.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -98.74 -69.58 0.76 Allowed 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 172.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -74.87 -10.92 59.96 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.618 -3.176 . . . . 0.0 113.679 -164.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -106.32 -35.57 7.11 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 120.301 1.41 . . . . 0.0 110.896 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 10.5 mp -88.81 -28.23 20.57 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 116.776 -1.583 . . . . 0.0 113.165 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . 0.436 ' O ' HG22 ' C' ' 79' ' ' ILE . . . 54.66 -122.85 26.56 Favored Glycine 0 C--N 1.336 0.577 1 C-N-CA 130.95 4.119 . . . . 0.0 114.79 -173.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.2 -23.99 37.76 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 126.121 1.768 . . . . 0.0 113.301 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.68 -14.7 77.86 Favored Glycine 0 CA--C 1.526 0.74 0 O-C-N 128.617 3.698 . . . . 0.0 117.198 -177.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . 0.436 HG22 ' O ' ' C' ' 76' ' ' GLY . 17.4 tt -51.4 -55.94 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 155.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . 0.425 ' HB1' ' HD3' ' C' ' 84' ' ' ARG . . . -69.31 -25.85 64.43 Favored 'General case' 0 N--CA 1.445 -0.715 0 O-C-N 119.327 -2.108 . . . . 0.0 111.724 -177.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 1.4 m -68.92 -27.91 66.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.916 1.686 . . . . 0.0 113.171 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 19.5 mm -98.33 -36.55 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 O-C-N 125.538 1.774 . . . . 0.0 114.075 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 78.1 p -91.95 -24.33 19.3 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -170.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . 0.425 ' HD3' ' HB1' ' C' ' 80' ' ' ALA . 71.9 mtp85 -93.6 161.09 14.49 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 130.654 3.582 . . . . 0.0 112.053 177.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.06 169.28 41.38 Favored Glycine 0 CA--C 1.524 0.642 0 O-C-N 118.706 -2.496 . . . . 0.0 116.879 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 25.5 m -64.26 -33.93 76.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 119.048 2.981 . . . . 0.0 119.048 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -93.78 28.66 2.29 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 126.649 2.468 . . . . 0.0 113.749 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 8.0 p -75.15 159.17 31.95 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 118.766 -2.459 . . . . 0.0 108.27 -172.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 30.3 tp -44.13 -54.7 5.35 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.833 2.453 . . . . 0.0 113.1 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -82.73 2.45 33.72 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 120.893 1.679 . . . . 0.0 112.663 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -124.03 -16.4 6.55 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.376 1.87 . . . . 0.0 113.054 -172.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.53 152.9 88.36 Favored Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 130.536 3.534 . . . . 0.0 114.822 163.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -66.01 158.98 51.44 Favored 'Trans proline' 0 N--CA 1.446 -1.295 0 O-C-N 115.515 -2.939 . . . . 0.0 117.926 -167.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 89.3 t -65.9 -43.63 92.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-O 117.948 -1.025 . . . . 0.0 108.648 -170.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.3 pm0 -60.88 -23.05 64.89 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 116.194 -1.86 . . . . 0.0 112.229 -178.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 18.3 tp -76.86 -49.71 15.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.254 1.822 . . . . 0.0 108.745 169.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 67.6 mtp180 -71.84 -42.44 66.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 118.695 -2.503 . . . . 0.0 111.208 -167.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -50.05 -50.0 49.24 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 128.794 2.838 . . . . 0.0 108.783 167.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 90.6 t90 -63.31 -41.25 98.91 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 127.998 3.311 . . . . 0.0 117.467 -178.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 81.3 mt -51.79 -36.67 48.54 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 117.077 -1.44 . . . . 0.0 114.349 168.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -80.94 -24.57 38.03 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 124.774 1.296 . . . . 0.0 113.708 172.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -71.12 -14.23 62.22 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 119.944 1.247 . . . . 0.0 111.162 175.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 72.9 t -112.03 -61.3 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-O 115.221 -2.324 . . . . 0.0 112.454 176.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 31.6 mt -66.05 -32.43 73.9 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 121.58 1.991 . . . . 0.0 115.398 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 84.9 mt -136.83 62.82 1.59 Allowed 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 125.662 1.585 . . . . 0.0 111.185 -168.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.281 15.2 pttp -98.42 173.83 6.76 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 112.262 -2.244 . . . . 0.0 112.595 -174.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 6.7 m -132.79 2.21 3.69 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 173.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 35.4 t0 . . . . . 0 C--O 1.251 1.166 0 O-C-N 117.347 -3.346 . . . . 0.0 111.646 172.846 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 6.5 ttt . . . . . 0 N--CA 1.468 0.475 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.62 165.59 35.11 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.047 1.339 . . . . 0.0 110.428 -167.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -128.82 140.51 51.67 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 118.496 -2.628 . . . . 0.0 107.683 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -143.95 125.15 14.56 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 117.339 2.348 . . . . 0.0 117.339 172.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 78.2 p -100.38 154.79 37.0 Favored Pre-proline 0 N--CA 1.452 -0.357 0 C-N-CA 125.392 1.477 . . . . 0.0 114.41 -173.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -50.18 -38.71 51.47 Favored 'Trans proline' 0 N--CA 1.446 -1.322 1 C-N-CA 125.585 4.19 . . . . 0.0 109.728 170.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -153.24 147.22 25.44 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 128.325 2.65 . . . . 0.0 108.889 178.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 12.7 t -92.66 140.37 29.6 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 120.382 1.446 . . . . 0.0 113.935 -175.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.6 -17.47 64.13 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 120.558 -1.339 . . . . 0.0 112.939 173.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.28 -35.74 66.21 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 120.653 -1.28 . . . . 0.0 111.194 167.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 14.8 mmm -72.01 -47.86 48.85 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 127.311 2.244 . . . . 0.0 114.193 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -43.97 -59.97 2.05 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.279 2.632 . . . . 0.0 112.263 169.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -67.43 -37.56 83.19 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 116.648 -1.644 . . . . 0.0 113.909 173.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -57.69 -22.54 46.68 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 121.705 2.048 . . . . 0.0 114.286 164.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER -93.88 -4.67 49.56 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 125.13 3.605 . . . . 0.0 106.74 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -90.19 -21.13 22.33 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 122.683 2.492 . . . . 0.0 114.81 153.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . 0.305 75.3 mm-40 -92.41 -36.14 13.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 123.876 1.798 . . . . 0.0 110.13 -166.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -46.6 -36.27 6.75 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 127.201 2.201 . . . . 0.0 111.807 161.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . 0.456 ' CZ3' ' CD1' ' D' ' 22' ' ' PHE 0.254 4.7 t-105 -85.14 -36.32 21.16 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 118.778 -2.451 . . . . 0.0 114.658 -177.564 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 50.7 mt -70.95 -22.75 62.17 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 120.037 -1.664 . . . . 0.0 113.05 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -66.51 -32.19 73.38 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 164.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . 0.456 ' CD1' ' CZ3' ' D' ' 19' ' ' TRP 0.297 13.8 t80 -66.76 -55.26 15.79 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 121.049 1.75 . . . . 0.0 107.728 173.86 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 61.1 t -57.83 -36.33 55.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 117.057 -1.449 . . . . 0.0 110.123 -172.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . 0.281 22.1 t70 -84.92 -28.38 25.96 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 125.745 1.618 . . . . 0.0 112.637 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 23.8 tp -66.27 -53.59 35.0 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 170.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . 0.558 ' O ' ' HB3' ' D' ' 29' ' ' ALA . 57.7 tp -55.33 -38.55 68.87 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 114.386 -2.721 . . . . 0.0 112.123 -178.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 10.7 ttpp -66.96 -37.35 84.12 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 127.124 2.765 . . . . 0.0 112.895 -175.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -72.17 -29.98 64.54 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 113.535 -1.666 . . . . 0.0 113.143 171.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' D' ' 26' ' ' LEU . . . -60.3 -35.91 76.66 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 126.217 1.807 . . . . 0.0 115.591 164.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -73.39 -11.03 60.34 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 123.553 1.645 . . . . 0.0 113.734 172.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -102.36 -2.47 28.85 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 112.308 -3.71 . . . . 0.0 116.266 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 52.1 p30 -137.4 10.63 2.97 Favored 'General case' 0 N--CA 1.448 -0.55 1 O-C-N 129.228 4.08 . . . . 0.0 117.857 169.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 66.28 33.93 6.84 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 117.627 2.455 . . . . 0.0 117.627 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 20.2 mt -103.24 7.69 38.45 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.553 1.541 . . . . 0.0 111.485 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.42 -49.18 77.07 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 130.762 3.625 . . . . 0.0 112.541 174.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 18.0 mt -71.37 -45.68 13.59 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-N 122.729 2.513 . . . . 0.0 110.486 -178.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . 0.259 82.4 Cg_exo -61.26 -32.47 90.3 Favored 'Trans proline' 0 N--CA 1.45 -1.085 1 C-N-CA 125.465 4.11 . . . . 0.0 115.982 173.745 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 34.6 tp -72.46 -45.59 58.84 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 118.836 -2.415 . . . . 0.0 110.726 174.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 11.3 mt -70.02 -27.85 65.01 Favored 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 117.575 -3.203 . . . . 0.0 112.53 176.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -76.85 -30.39 56.29 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 118.046 -2.909 . . . . 0.0 115.195 172.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 56.9 tp -57.97 -46.43 85.15 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 157.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.0 mmt -82.59 -37.7 24.68 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 121.064 -1.023 . . . . 0.0 112.695 -165.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 64.0 mt -114.63 137.42 51.91 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 114.691 -2.576 . . . . 0.0 111.957 -165.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 42.7 p -78.27 168.16 29.72 Favored Pre-proline 0 N--CA 1.449 -0.493 0 O-C-N 125.421 1.701 . . . . 0.0 112.342 -176.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -52.34 -32.9 53.57 Favored 'Trans proline' 0 N--CA 1.447 -1.207 0 CA-C-N 123.164 2.166 . . . . 0.0 117.631 -174.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -91.49 -32.12 15.7 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 127.028 2.131 . . . . 0.0 112.805 -172.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -58.36 -39.75 80.38 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.05 1.34 . . . . 0.0 113.318 168.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 31.2 mtm-85 -64.26 -52.6 57.89 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 127.589 2.356 . . . . 0.0 108.491 169.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -54.28 -35.99 63.18 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 127.535 3.022 . . . . 0.0 114.082 174.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.22 -36.91 66.55 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 119.615 -1.928 . . . . 0.0 114.374 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . 0.444 ' HB3' ' CE2' ' C' ' 22' ' ' PHE . 43.5 mt -72.15 -45.73 59.29 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 119.211 -2.181 . . . . 0.0 113.412 -179.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -61.3 -42.41 99.77 Favored Glycine 0 C--N 1.338 0.676 0 C-N-CA 125.16 1.362 . . . . 0.0 110.572 166.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 36.2 m -60.67 -33.86 73.47 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 124.175 3.988 . . . . 0.0 114.504 169.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . 0.4 61.2 mtt180 -52.99 -27.12 17.67 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 118.038 -2.914 . . . . 0.0 116.993 166.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 76.4 t -69.2 -50.5 52.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-O 114.75 -2.548 . . . . 0.0 107.377 175.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . 0.4 ' HG2' ' H ' ' D' ' 56' ' ' ARG . 3.2 ptm180 -68.02 -35.9 79.05 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 125.601 3.819 . . . . 0.0 110.67 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . 0.41 HD13 HG21 ' D' ' 57' ' ' ILE . 59.4 mt -52.48 -53.8 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 120.56 1.527 . . . . 0.0 109.877 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 69.6 t -67.66 -44.96 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 O-C-N 117.136 -3.478 . . . . 0.0 106.234 -175.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -49.67 -41.72 43.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.043 -2.286 . . . . 0.0 116.427 168.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . 0.254 45.1 mm-40 -76.28 -24.3 54.44 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 125.802 1.939 . . . . 0.0 110.73 178.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 48.0 mt -76.74 -44.78 31.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 119.29 -2.131 . . . . 0.0 110.447 176.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . 0.261 30.6 mt -62.11 -25.79 67.93 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.957 1.703 . . . . 0.0 114.213 168.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 37.4 ttm180 -84.99 -41.41 15.86 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 119.924 -1.735 . . . . 0.0 111.547 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 41.03 64.71 1.21 Allowed Glycine 0 CA--C 1.522 0.478 0 C-N-CA 126.524 2.011 . . . . 0.0 116.797 -174.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -130.95 -36.81 1.33 Allowed 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 131.121 3.768 . . . . 0.0 112.457 177.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 13.4 mmt -85.37 49.08 1.68 Allowed 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 130.04 3.336 . . . . 0.0 108.322 166.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 53.3 p -69.64 165.3 21.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 124.549 2.119 . . . . 0.0 115.583 -168.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 56.62 -103.42 0.18 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 117.594 2.442 . . . . 0.0 117.594 158.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -53.44 -45.06 69.33 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 114.306 -2.759 . . . . 0.0 114.48 168.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -82.03 -40.1 22.55 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 123.682 2.946 . . . . 0.0 110.314 -166.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.63 -30.74 14.16 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 118.146 2.647 . . . . 0.0 118.146 165.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -86.2 -46.85 9.99 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 116.792 2.145 . . . . 0.0 116.792 169.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -74.74 -45.81 41.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 115.278 -2.296 . . . . 0.0 110.9 -175.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -119.0 -32.55 4.43 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 120.085 1.311 . . . . 0.0 112.788 -160.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . 0.258 1.3 mm? -72.73 -28.85 62.89 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 116.131 -1.89 . . . . 0.0 109.24 157.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 105.68 -174.35 20.88 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-O 125.63 2.795 . . . . 0.0 106.959 151.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.254 . . -58.72 -9.2 1.61 Allowed 'General case' 0 N--CA 1.45 -0.47 1 C-N-CA 133.719 4.808 . . . . 0.0 119.596 171.2 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.87 -21.79 65.81 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 115.243 0.857 . . . . 0.0 115.243 164.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 3.7 tt -38.06 -31.26 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 127.031 2.132 . . . . 0.0 115.672 172.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -113.54 -7.25 13.39 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 118.283 -2.761 . . . . 0.0 114.924 -171.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 47.3 m -66.89 -44.02 81.94 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.536 150.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 15.7 mm -68.09 -35.85 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 129.164 2.986 . . . . 0.0 114.328 168.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 68.4 p -119.75 8.1 11.12 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 123.868 3.031 . . . . 0.0 116.692 -175.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.2 mtp85 -115.76 170.54 8.38 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 121.744 2.066 . . . . 0.0 113.848 149.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.11 156.12 32.38 Favored Glycine 0 C--N 1.334 0.464 0 CA-C-O 123.794 1.775 . . . . 0.0 111.659 -166.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 53.1 p -78.16 -5.91 53.17 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 -156.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -138.89 41.24 2.14 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 128.839 2.856 . . . . 0.0 109.944 169.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 12.7 p -56.67 174.51 0.15 Allowed 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 129.271 3.028 . . . . 0.0 107.586 164.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp -66.38 -24.76 66.54 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 118.021 -2.925 . . . . 0.0 111.145 174.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 36.8 tttt -76.65 0.75 19.13 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 167.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -130.86 5.32 4.58 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 115.069 -2.396 . . . . 0.0 115.09 -176.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . 0.57 ' HA ' ' C ' ' D' ' 93' ' ' PRO 0.376 . . 48.33 76.5 0.54 Allowed Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 119.252 3.056 . . . . 0.0 119.252 140.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . 0.57 ' C ' ' HA ' ' D' ' 92' ' ' ALA . 76.8 Cg_exo 33.01 28.4 0.0 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.985 0 CA-C-N 123.543 2.301 . . . . 0.0 113.665 36.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . 0.42 ' H ' ' C ' ' D' ' 92' ' ' ALA . 3.6 t -50.76 -21.93 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 C-N-CA 125.784 1.634 . . . . 0.0 108.781 166.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . 0.46 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.333 0.0 OUTLIER -103.47 -35.92 8.17 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.948 1.699 . . . . 0.0 111.919 -169.082 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 27.4 tp -50.86 -54.24 25.6 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 117.445 -1.702 . . . . 0.0 110.031 151.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 -60.48 -46.02 91.62 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 128.582 2.753 . . . . 0.0 113.816 -169.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -75.1 -12.99 60.43 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 116.957 -3.589 . . . . 0.0 116.927 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 64.5 t90 -77.47 -48.41 17.19 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 117.144 -1.408 . . . . 0.0 110.81 174.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 38.9 mt -58.24 -34.68 70.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 126.742 2.526 . . . . 0.0 108.33 169.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -60.97 -31.74 71.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.298 2.239 . . . . 0.0 114.018 175.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -97.97 -23.12 15.94 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 119.681 -1.887 . . . . 0.0 112.884 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.254 49.0 t -78.19 -23.57 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 CA-C-N 121.702 2.047 . . . . 0.0 111.488 167.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 78.7 mt -120.75 -20.1 7.13 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 -163.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 67.7 mt -115.44 29.72 7.82 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.252 2.221 . . . . 0.0 107.188 166.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -52.6 167.32 0.15 Allowed 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.713 2.805 . . . . 0.0 115.704 173.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 53.8 m -40.35 -50.26 2.81 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 119.524 3.157 . . . . 0.0 119.524 -175.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 . . . . . 0 C--O 1.245 0.832 0 C-N-CA 126.055 1.742 . . . . 0.0 113.944 177.54 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.254 1.1 tmt? . . . . . 0 N--CA 1.47 0.541 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.39 -43.9 97.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 116.352 -1.785 . . . . 0.0 113.35 177.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -69.95 -9.98 56.97 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 124.699 3.409 . . . . 0.0 113.272 -175.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -106.22 -42.64 5.01 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 116.493 -3.879 . . . . 0.0 107.658 -171.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.6 m -73.32 117.44 60.35 Favored Pre-proline 0 N--CA 1.446 -0.641 0 C-N-CA 126.72 2.008 . . . . 0.0 108.643 -163.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -71.82 0.64 6.78 Favored 'Trans proline' 0 N--CA 1.449 -1.113 1 C-N-CA 127.406 5.404 . . . . 0.0 110.469 -165.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -155.99 151.73 27.29 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 117.711 -3.118 . . . . 0.0 112.279 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.9 t -142.36 111.62 6.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.242 1.417 . . . . 0.0 107.208 -174.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.96 -36.47 81.54 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 125.274 1.609 . . . . 0.0 113.075 177.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.67 -31.25 64.92 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 119.4 -2.063 . . . . 0.0 115.042 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.2 ttt -67.53 -47.12 70.81 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.004 0.922 . . . . 0.0 111.02 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -37.62 74.78 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.215 -0.902 . . . . 0.0 112.915 175.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -64.97 -37.19 86.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 120.027 -1.671 . . . . 0.0 110.915 166.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -55.33 -49.34 72.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 117.231 -3.418 . . . . 0.0 111.141 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.6 mmt180 -74.53 -17.84 60.69 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.769 -177.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -65.84 -49.74 67.1 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 118.914 -1.115 . . . . 0.0 110.85 168.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -70.12 -24.78 63.24 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 117.332 2.345 . . . . 0.0 117.332 177.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -67.31 -41.93 84.54 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 127.756 2.423 . . . . 0.0 109.808 170.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . 0.261 3.0 t-105 -74.51 -44.1 52.86 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.977 -2.327 . . . . 0.0 113.456 174.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 15.4 mt -67.07 -29.27 68.99 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 117.527 -1.669 . . . . 0.0 112.061 -176.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 25.8 ttt180 -30.14 -63.05 0.14 Allowed 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 116.437 2.014 . . . . 0.0 116.437 153.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -53.95 -37.07 63.51 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 116.326 1.972 . . . . 0.0 116.326 173.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . 0.279 2.7 t -69.51 -40.62 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 125.406 1.482 . . . . 0.0 112.282 -176.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -68.54 -50.68 50.13 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 116.203 -1.856 . . . . 0.0 109.329 167.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.429 ' CD1' HG11 ' B' ' 103' ' ' VAL . 22.0 tp -53.26 -40.15 64.4 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 123.536 2.88 . . . . 0.0 111.506 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.47 HD11 ' CE2' ' A' ' 30' ' ' TYR . 14.3 tp -76.74 -30.16 56.47 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 120.103 1.319 . . . . 0.0 111.526 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -62.74 -47.67 82.56 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 114.359 1.244 . . . . 0.0 114.359 166.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -53.97 -38.81 65.39 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.38 -2.724 . . . . 0.0 111.028 165.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.94 -38.81 57.21 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 122.834 2.561 . . . . 0.0 110.964 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.47 ' CE2' HD11 ' A' ' 26' ' ' LEU . 28.2 m-85 -67.49 -35.42 79.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 118.732 -2.48 . . . . 0.0 109.02 176.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -66.59 -10.78 49.03 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 173.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -115.8 7.22 14.52 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.384 1.073 . . . . 0.0 112.242 177.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.28 24.7 m-20 60.88 14.91 5.56 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 121.474 3.879 . . . . 0.0 121.474 -171.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.1 mt -101.03 13.49 35.03 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 119.624 -1.922 . . . . 0.0 113.648 -175.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.434 ' CG ' ' CD1' ' A' ' 30' ' ' TYR . 19.8 p-80 -55.2 -53.38 56.8 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.822 -2.423 . . . . 0.0 113.381 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.9 mt -70.09 -47.33 21.74 Favored Pre-proline 0 N--CA 1.445 -0.716 0 CA-C-N 123.547 2.885 . . . . 0.0 111.039 -178.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -41.87 -47.81 6.28 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.299 2.666 . . . . 0.0 114.524 168.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 27.4 tp -66.56 -55.47 15.28 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 112.887 -1.96 . . . . 0.0 113.419 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 29.0 mt -61.71 -21.92 64.9 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 119.702 1.137 . . . . 0.0 112.37 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 -73.63 -31.95 63.79 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 126.084 1.754 . . . . 0.0 109.549 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.87 -39.48 43.19 Favored 'General case' 0 N--CA 1.45 -0.465 1 C-N-CA 133.915 4.886 . . . . 0.0 115.993 169.229 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.3 mmm -73.58 -32.13 63.97 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 129.066 2.946 . . . . 0.0 113.241 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.4 mt -127.59 120.6 28.54 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 125.132 1.373 . . . . 0.0 108.724 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.4 p -53.79 163.01 1.19 Allowed Pre-proline 0 N--CA 1.45 -0.465 0 CA-C-N 114.836 -1.074 . . . . 0.0 113.418 172.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -64.86 -28.11 58.92 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 CA-C-N 121.965 1.737 . . . . 0.0 115.93 -172.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -77.23 -27.2 53.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 116.73 2.122 . . . . 0.0 116.73 177.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -72.17 -39.56 68.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.625 1.97 . . . . 0.0 114.07 172.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.6 mtm-85 -55.96 -46.58 78.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 168.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -49.26 -54.05 18.72 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 119.568 -1.958 . . . . 0.0 113.173 169.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.31 -50.08 55.98 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 114.934 -2.46 . . . . 0.0 107.464 -172.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 22.9 mt -54.4 -33.42 59.28 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 124.443 3.292 . . . . 0.0 115.707 171.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.24 -47.06 92.35 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 127.928 2.68 . . . . 0.0 114.566 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.0 m -60.11 -27.3 66.91 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 114.857 -2.497 . . . . 0.0 112.331 163.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -81.61 -23.49 37.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 125.429 1.706 . . . . 0.0 110.795 -173.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 51.6 t -57.36 -45.22 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-O 115.795 -2.05 . . . . 0.0 107.992 167.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.29 11.6 ttt180 -63.26 -37.75 88.45 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 126.779 2.032 . . . . 0.0 110.707 173.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 28.6 mt -57.79 -42.82 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 O-C-N 117.422 -3.299 . . . . 0.0 112.358 174.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 71.5 t -65.19 -48.25 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 O-C-N 119.178 -2.201 . . . . 0.0 112.458 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -57.27 -47.99 80.03 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.904 1.282 . . . . 0.0 110.526 178.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -69.0 -44.15 73.37 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 115.202 -2.333 . . . . 0.0 114.623 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 44.1 mt -67.63 -27.13 66.63 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 120.61 1.55 . . . . 0.0 113.997 177.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 tp -77.59 -47.66 18.84 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.359 1.464 . . . . 0.0 108.915 177.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.3 ttm105 -53.96 -35.42 61.75 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 169.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.33 -9.24 14.42 Favored Glycine 0 C--N 1.334 0.45 0 C-N-CA 129.25 3.309 . . . . 0.0 117.259 169.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -60.25 -22.51 63.15 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 127.458 2.303 . . . . 0.0 116.084 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 41.4 mtt -95.4 140.83 29.72 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 126.176 1.79 . . . . 0.0 114.915 175.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.8 p -93.44 176.87 6.22 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 127.628 2.371 . . . . 0.0 109.906 174.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -69.16 -31.88 70.83 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 119.368 -2.082 . . . . 0.0 111.482 169.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.5 tpt85 -62.27 -27.52 69.07 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 117.204 2.298 . . . . 0.0 117.204 167.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -90.67 -40.04 12.11 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 117.265 -1.35 . . . . 0.0 111.763 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.4 mt -63.56 -30.21 71.36 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 120.153 1.342 . . . . 0.0 109.997 176.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -56.86 -25.48 56.63 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -95.79 -54.32 3.38 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 126.2 1.8 . . . . 0.0 111.861 172.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -65.73 -47.81 74.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 118.219 -2.801 . . . . 0.0 114.439 -170.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 65.3 mt -108.73 -0.34 20.07 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.535 -171.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.86 21.36 73.2 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 119.841 1.2 . . . . 0.0 114.106 -171.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.08 133.1 33.64 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 116.434 2.013 . . . . 0.0 116.434 -165.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.57 129.46 9.13 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-O 114.562 -3.354 . . . . 0.0 111.601 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 83.8 mt -61.48 -17.77 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 1 O-C-N 131.356 4.798 . . . . 0.0 111.477 -164.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -77.19 -28.38 53.93 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.852 2.569 . . . . 0.0 113.361 169.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 26.4 p -84.69 -25.38 28.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 118.067 -1.453 . . . . 0.0 109.855 -173.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 51.1 mm -69.92 -43.29 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-O 113.886 -2.959 . . . . 0.0 109.619 166.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 52.6 m -49.75 -52.05 34.5 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 122.981 2.628 . . . . 0.0 113.347 168.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.277 42.7 ttt180 -62.45 -29.62 70.65 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 113.779 -3.01 . . . . 0.0 115.396 175.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.64 -36.86 41.84 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 122.216 2.28 . . . . 0.0 117.696 166.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 16.3 m -61.35 -44.35 97.33 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 114.988 -2.434 . . . . 0.0 114.223 173.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -58.27 -37.85 75.8 Favored 'General case' 0 N--CA 1.448 -0.527 1 O-C-N 129.186 4.054 . . . . 0.0 112.02 165.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 64.5 m -70.55 -35.32 73.04 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 124.083 3.129 . . . . 0.0 117.709 172.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.4 tp -69.35 -40.12 77.7 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 128.176 3.422 . . . . 0.0 113.499 170.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 18.7 tttp -59.99 -36.99 78.38 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 120.575 -1.328 . . . . 0.0 113.252 176.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.13 -13.13 58.98 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 172.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.55 126.36 91.42 Favored Pre-proline 0 N--CA 1.449 -0.504 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -67.63 155.73 68.91 Favored 'Trans proline' 0 N--CA 1.446 -1.281 1 C-N-CA 126.786 4.991 . . . . 0.0 108.759 -172.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . 0.396 3.1 m -68.06 -34.03 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 113.288 -1.778 . . . . 0.0 113.906 -165.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . 0.28 13.0 pm0 -61.29 -35.46 77.38 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 170.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 43.0 tp -70.34 -44.7 67.64 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 124.525 2.107 . . . . 0.0 108.618 173.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.5 mtm180 -70.09 -29.41 66.38 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 116.733 -3.729 . . . . 0.0 114.661 -168.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -80.1 -30.45 39.16 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 117.028 2.232 . . . . 0.0 117.028 168.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 85.7 t90 -73.12 -37.16 66.77 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 169.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.99 -24.31 67.67 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.489 1.516 . . . . 0.0 114.078 174.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -80.33 -8.61 59.56 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.922 2.489 . . . . 0.0 114.883 165.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -99.34 -38.61 8.78 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-O 112.019 -3.848 . . . . 0.0 105.904 173.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.8 t -83.88 -57.72 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 O-C-N 127.992 3.308 . . . . 0.0 106.879 -165.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.4 mt -85.25 -30.33 23.9 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 120.413 1.46 . . . . 0.0 114.04 -158.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mt -105.86 -27.64 11.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 124.686 2.184 . . . . 0.0 108.276 -148.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 32.8 tttt -83.18 5.12 23.87 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 128.568 2.747 . . . . 0.0 115.994 -159.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.4 p -86.5 -18.28 32.01 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.669 2.787 . . . . 0.0 110.939 171.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.261 3.6 m-20 . . . . . 0 C--O 1.249 1.031 0 C-N-CA 129.257 3.023 . . . . 0.0 118.305 -161.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.7 tmm? . . . . . 0 N--CA 1.468 0.44 0 CA-C-O 124.478 2.085 . . . . 0.0 115.126 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.56 -8.2 53.98 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 120.325 -1.485 . . . . 0.0 114.86 -157.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -106.23 -19.5 13.69 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 117.867 2.543 . . . . 0.0 117.867 165.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . 0.283 3.8 tp-100 -72.53 -38.45 68.04 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 168.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 17.5 m -82.74 137.57 44.08 Favored Pre-proline 0 N--CA 1.449 -0.485 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 178.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -74.02 5.92 3.24 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 N-CA-C 121.214 3.505 . . . . 0.0 121.214 172.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . 0.293 48.1 t80 -134.32 145.34 48.95 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 129.892 3.277 . . . . 0.0 113.323 167.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 2.2 t -162.05 137.3 7.27 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 126.858 2.599 . . . . 0.0 108.618 167.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.51 -28.28 65.91 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 129.062 2.945 . . . . 0.0 108.718 -179.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.93 -37.12 62.12 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 124.564 2.126 . . . . 0.0 108.332 173.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 21.7 mmt -74.32 -24.81 59.26 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 117.674 -3.141 . . . . 0.0 108.936 -178.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.94 -42.86 56.85 Favored 'General case' 0 N--CA 1.446 -0.634 0 O-C-N 120.305 -1.497 . . . . 0.0 109.837 171.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -62.02 -40.56 96.11 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.075 1.75 . . . . 0.0 111.022 177.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -65.8 -39.25 90.75 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 127.577 2.351 . . . . 0.0 108.79 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -86.38 -14.54 43.15 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 118.027 -2.921 . . . . 0.0 112.824 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -51.7 -47.7 63.83 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 121.025 1.739 . . . . 0.0 114.757 149.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -64.68 -44.83 89.07 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 118.354 -2.716 . . . . 0.0 110.605 -177.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -53.94 -45.88 71.4 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.702 1.601 . . . . 0.0 112.425 174.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 28.0 t-105 -64.26 -58.91 5.19 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 170.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 73.8 mt -51.78 -25.84 8.42 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 116.721 -1.609 . . . . 0.0 110.651 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 -65.08 -31.93 73.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 174.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -67.43 -53.84 25.56 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 121.048 1.749 . . . . 0.0 109.941 165.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.443 HG23 ' H ' ' B' ' 23' ' ' VAL . 29.7 t -46.11 -38.57 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 117.495 2.405 . . . . 0.0 117.495 171.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -75.07 -52.49 10.91 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 127.106 2.162 . . . . 0.0 106.61 171.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 46.2 tp -59.27 -34.08 71.83 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 124.891 3.496 . . . . 0.0 112.083 -175.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 27.8 tp -72.76 -37.58 67.62 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 114.503 -2.665 . . . . 0.0 115.39 173.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -65.14 -39.03 92.47 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 121.098 1.772 . . . . 0.0 113.363 176.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -71.59 -34.7 70.11 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 127.011 2.125 . . . . 0.0 108.484 173.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.51 -26.22 65.34 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 121.938 2.154 . . . . 0.0 113.098 175.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -70.77 -28.08 64.41 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 119.138 -2.226 . . . . 0.0 110.267 173.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -71.59 -13.08 61.66 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -123.55 -1.22 8.56 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 118.214 -2.804 . . . . 0.0 112.194 -172.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.332 0.3 OUTLIER 70.66 8.69 6.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 128.063 2.545 . . . . 0.0 116.556 -172.522 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.44 3.89 26.36 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 119.566 -1.959 . . . . 0.0 111.905 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -54.49 -47.86 72.53 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 177.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 27.8 tp -65.16 -61.9 5.47 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-O 116.167 -1.873 . . . . 0.0 111.23 -178.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -55.95 -31.47 81.96 Favored 'Trans proline' 0 N--CA 1.447 -1.258 0 CA-C-N 124.338 2.585 . . . . 0.0 118.687 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 46.5 tp -70.39 -42.11 72.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 113.623 -3.084 . . . . 0.0 114.22 170.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 21.8 mt -69.47 -33.59 73.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 123.403 2.819 . . . . 0.0 111.576 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -70.56 -26.88 63.75 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 125.144 1.528 . . . . 0.0 112.332 171.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . 0.282 11.7 tp -75.38 -33.48 61.03 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 116.543 -3.848 . . . . 0.0 115.277 164.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 24.4 mmt -84.2 -26.76 28.51 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -170.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 38.7 mt -122.82 136.92 55.03 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 124.242 0.964 . . . . 0.0 109.452 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 59.7 p -68.03 155.78 91.16 Favored Pre-proline 0 N--CA 1.447 -0.601 0 O-C-N 120.05 -1.656 . . . . 0.0 108.926 174.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -47.11 -38.84 25.43 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 122.886 2.391 . . . . 0.0 113.894 174.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -66.91 -45.41 78.05 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 115.592 -2.147 . . . . 0.0 114.902 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -64.1 -38.73 92.12 Favored 'General case' 0 N--CA 1.444 -0.757 0 O-C-N 125.91 2.006 . . . . 0.0 115.118 171.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 42.2 mtm-85 -64.96 -37.95 89.35 Favored 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 119.052 -2.28 . . . . 0.0 111.595 170.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -69.46 -31.26 69.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 173.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.04 -62.42 1.71 Allowed 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 114.622 -2.608 . . . . 0.0 109.218 170.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 7.2 mt -53.5 -35.7 60.9 Favored 'General case' 0 N--CA 1.447 -0.59 0 O-C-N 127.965 3.291 . . . . 0.0 117.548 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.17 -28.87 70.95 Favored Glycine 0 CA--C 1.522 0.494 0 O-C-N 125.446 1.716 . . . . 0.0 113.485 168.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.7 m -72.87 -34.72 66.91 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 118.716 -2.638 . . . . 0.0 110.099 166.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.471 ' HA ' ' HB ' ' B' ' 57' ' ' ILE . 95.4 mtt180 -69.79 -18.67 63.49 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 112.634 -3.555 . . . . 0.0 114.804 174.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.38 -59.15 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 122.145 2.248 . . . . 0.0 109.882 157.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 63.0 mtp180 -55.42 -34.71 64.67 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 122.437 2.381 . . . . 0.0 116.81 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.471 ' HB ' ' HA ' ' B' ' 54' ' ' ARG 0.347 45.1 mt -57.11 -70.09 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 124.763 2.22 . . . . 0.0 108.678 173.556 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 57.6 t -54.52 -38.15 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 125.382 1.473 . . . . 0.0 112.29 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -65.46 -39.48 92.03 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 119.32 3.082 . . . . 0.0 119.32 169.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -74.38 -31.55 62.41 Favored 'General case' 0 N--CA 1.451 -0.394 0 O-C-N 119.533 -1.979 . . . . 0.0 111.096 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 3.6 mt -55.47 -33.77 63.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.442 1.897 . . . . 0.0 113.227 168.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . 0.284 73.3 mt -85.52 -45.84 11.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 116.384 -1.77 . . . . 0.0 108.625 174.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.319 5.0 ttm105 -62.17 -64.3 0.97 Allowed 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 130.035 3.334 . . . . 0.0 110.79 -169.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.91 44.87 13.19 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 119.375 2.51 . . . . 0.0 119.375 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -106.63 -36.48 6.72 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 112.538 -1.831 . . . . 0.0 115.075 168.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 52.2 mtt -70.77 145.6 50.32 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 116.836 2.162 . . . . 0.0 116.836 -173.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 83.3 p -78.46 161.59 26.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 119.77 -1.831 . . . . 0.0 112.738 164.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -68.25 -20.15 64.78 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 119.345 -2.097 . . . . 0.0 108.665 -175.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -64.26 -45.09 89.62 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 115.093 -2.384 . . . . 0.0 113.083 164.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -62.3 -36.94 83.69 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 125.173 1.545 . . . . 0.0 113.059 177.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 91.3 mt -73.01 -51.81 16.8 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.43 1.492 . . . . 0.0 113.554 173.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 18.0 tptp -65.92 -46.14 79.33 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 119.443 -2.036 . . . . 0.0 110.892 -174.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -100.93 -17.53 16.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 124.177 0.923 . . . . 0.0 111.004 -164.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . 0.296 34.9 mt-10 -121.92 -16.25 7.64 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 115.613 -2.137 . . . . 0.0 111.432 -172.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 81.7 mt -112.04 -5.03 14.32 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 117.589 2.44 . . . . 0.0 117.589 162.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.63 21.65 69.18 Favored Glycine 0 C--N 1.334 0.467 0 O-C-N 124.433 1.083 . . . . 0.0 111.758 -177.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -111.9 108.32 17.65 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.617 -0.931 . . . . 0.0 112.131 -172.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.5 -176.19 51.26 Favored Glycine 0 CA--C 1.523 0.558 0 O-C-N 126.374 2.296 . . . . 0.0 109.606 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 26.8 mm -53.68 -46.02 61.24 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-O 125.925 2.774 . . . . 0.0 112.833 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.38 -23.94 54.1 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 117.643 -3.16 . . . . 0.0 110.12 -171.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 5.6 m -79.1 -35.47 42.23 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 125.696 1.873 . . . . 0.0 109.919 177.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 38.5 mm -74.77 -52.03 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 C-N-CA 130.884 3.674 . . . . 0.0 110.549 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 30.9 m -57.61 -37.98 74.17 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 130.095 3.358 . . . . 0.0 113.34 173.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -66.75 -47.09 73.32 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.997 -1.001 . . . . 0.0 111.531 169.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -54.64 -36.97 59.98 Favored Glycine 0 CA--C 1.521 0.466 0 O-C-N 119.121 -2.237 . . . . 0.0 114.83 166.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 24.2 p -72.47 -29.19 63.43 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 118.223 1.011 . . . . 0.0 110.24 -178.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 69.6 m-20 -70.77 -44.59 66.39 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.475 1.51 . . . . 0.0 114.821 166.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 70.5 m -57.85 -34.63 69.93 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 115.072 1.508 . . . . 0.0 115.072 177.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' B' ' 89' ' ' LEU . 16.8 mt -60.89 -24.64 66.13 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 127.599 3.062 . . . . 0.0 111.598 168.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -93.8 -43.35 8.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.697 1.999 . . . . 0.0 111.353 178.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.35 -1.21 1.56 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 126.398 1.879 . . . . 0.0 115.328 162.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.16 149.76 50.7 Favored Pre-proline 0 N--CA 1.447 -0.585 0 O-C-N 119.708 -1.87 . . . . 0.0 110.287 174.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -60.47 144.61 99.53 Favored 'Trans proline' 0 N--CA 1.448 -1.204 0 C-N-CA 122.857 2.371 . . . . 0.0 112.658 164.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 25.2 m -67.92 -23.72 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -178.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 3.8 pm0 -68.84 -4.68 17.17 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 117.852 -3.03 . . . . 0.0 114.308 166.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 15.0 tp -99.5 -35.61 9.82 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 120.726 1.603 . . . . 0.0 110.338 170.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 57.9 mtp85 -54.55 -41.29 69.59 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 130.9 3.68 . . . . 0.0 113.959 173.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -74.44 -42.41 59.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.158 2.183 . . . . 0.0 110.409 167.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -52.81 -36.82 59.01 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 116.362 -1.78 . . . . 0.0 114.244 178.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 21.0 mt -83.76 -35.27 24.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 126.081 1.753 . . . . 0.0 113.606 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -61.91 -31.54 71.86 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 171.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -103.1 -15.49 16.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 125.493 1.746 . . . . 0.0 115.378 -175.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.429 HG11 ' CD1' ' A' ' 25' ' ' LEU . 53.9 t -85.1 -54.21 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 128.668 2.787 . . . . 0.0 110.879 167.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 14.0 mt -78.11 -44.36 26.34 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 116.886 2.18 . . . . 0.0 116.886 -168.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 88.3 mt -76.67 -22.72 53.62 Favored 'General case' 0 N--CA 1.45 -0.452 0 O-C-N 127.308 2.88 . . . . 0.0 111.07 -169.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -86.58 -4.7 59.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 128.704 2.802 . . . . 0.0 112.255 170.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 17.6 m -104.49 3.57 32.17 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.304 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 19.1 t70 . . . . . 0 C--O 1.251 1.139 0 C-N-CA 128.704 2.802 . . . . 0.0 114.203 178.444 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 23.4 ttt . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.86 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.275 . . -72.33 154.43 40.95 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 127.45 2.969 . . . . 0.0 113.35 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -126.94 145.74 50.57 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 126.193 1.797 . . . . 0.0 110.414 -177.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -121.14 126.17 49.06 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.935 1.294 . . . . 0.0 112.228 171.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . 0.506 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 58.5 p -136.82 142.3 38.25 Favored Pre-proline 0 N--CA 1.445 -0.725 0 C-N-CA 128.117 2.567 . . . . 0.0 109.225 -179.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . 0.506 ' HD3' ' HA ' ' C' ' 5' ' ' SER . 53.3 Cg_exo -64.88 -14.99 48.12 Favored 'Trans proline' 0 N--CA 1.451 -1.013 0 N-CA-C 120.157 3.099 . . . . 0.0 120.157 -164.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -140.97 147.76 39.26 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.125 1.37 . . . . 0.0 114.29 176.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 9.1 t -140.84 133.65 28.98 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 124.222 1.963 . . . . 0.0 108.527 164.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.52 -25.05 53.75 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 111.981 -2.372 . . . . 0.0 113.576 173.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.19 -29.36 34.61 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 119.381 -2.074 . . . . 0.0 110.096 178.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 39.8 mtt -66.07 -38.32 88.0 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.174 2.19 . . . . 0.0 112.284 169.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.17 84.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 117.441 2.386 . . . . 0.0 117.441 164.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -73.01 -35.48 66.81 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 125.533 1.771 . . . . 0.0 106.467 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -63.51 -44.92 92.91 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.514 2.042 . . . . 0.0 116.514 166.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -32.33 73.83 Favored 'General case' 0 N--CA 1.448 -0.547 1 O-C-N 116.141 -4.099 . . . . 0.0 107.973 177.066 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -68.0 -54.09 21.08 Favored 'General case' 0 N--CA 1.453 -0.292 1 O-C-N 115.628 -4.42 . . . . 0.0 111.416 173.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.275 67.0 mm-40 -54.44 -35.78 63.35 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 114.867 1.432 . . . . 0.0 114.867 172.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -64.58 -35.04 79.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 172.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 5.4 t-105 -71.16 -37.51 72.23 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 124.257 1.98 . . . . 0.0 108.383 177.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . 0.285 9.7 mp -67.09 -16.87 64.6 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.628 177.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -93.31 -31.41 14.69 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 114.099 -2.857 . . . . 0.0 113.377 178.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -64.06 -33.9 76.81 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 126.518 2.386 . . . . 0.0 109.008 168.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.284 11.1 t -60.99 -44.31 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 O-C-N 118.562 -2.586 . . . . 0.0 114.917 168.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -71.7 -32.3 67.68 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 126.623 2.452 . . . . 0.0 117.229 -174.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 50.0 tp -68.37 -50.61 51.92 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 118.482 -1.287 . . . . 0.0 108.599 173.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 61.7 tp -57.23 -37.2 71.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 120.544 -1.347 . . . . 0.0 110.461 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -47.67 -55.66 8.94 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.789 2.436 . . . . 0.0 111.849 173.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -74.87 -25.13 58.74 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 114.192 -2.813 . . . . 0.0 107.57 -177.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.5 -26.12 68.29 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 118.818 2.896 . . . . 0.0 118.818 -175.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -64.01 -41.33 97.49 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 122.745 1.259 . . . . 0.0 114.343 171.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -61.34 -36.5 80.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.072 -1.422 . . . . 0.0 111.551 -174.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . 0.312 29.6 p-10 -108.29 9.31 27.95 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.13 2.172 . . . . 0.0 116.756 173.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.535 5.0 m-20 61.21 28.45 18.05 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 117.065 -3.522 . . . . 0.0 120.507 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 31.3 mt -85.02 4.13 35.33 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 116.654 2.094 . . . . 0.0 116.654 165.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -67.59 -43.31 80.84 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 122.08 2.218 . . . . 0.0 115.212 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 80.6 mt -65.92 -50.21 54.12 Favored Pre-proline 0 N--CA 1.45 -0.432 0 O-C-N 117.747 -3.096 . . . . 0.0 112.449 166.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -42.82 -49.4 6.78 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 CA-C-N 124.176 2.527 . . . . 0.0 118.205 162.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 19.8 tp -63.36 -40.62 97.77 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 175.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.318 66.8 mt -70.77 -8.4 52.05 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 118.329 -2.732 . . . . 0.0 115.514 174.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -107.96 -1.49 20.58 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 130.997 3.719 . . . . 0.0 111.32 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 12.3 tp -104.98 -48.05 3.84 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 120.814 -1.179 . . . . 0.0 113.194 166.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 87.5 mmm -78.29 -2.53 38.41 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 -170.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mp -138.75 154.84 48.56 Favored 'General case' 0 N--CA 1.452 -0.342 1 O-C-N 115.877 -4.264 . . . . 0.0 107.663 -172.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 54.6 p -79.67 160.25 69.94 Favored Pre-proline 0 N--CA 1.449 -0.521 0 C-N-CA 129.791 3.236 . . . . 0.0 112.655 163.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -48.52 -43.35 33.43 Favored 'Trans proline' 0 N--CA 1.446 -1.292 0 C-N-CA 122.811 2.341 . . . . 0.0 114.907 169.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -40.35 94.9 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 118.091 -2.881 . . . . 0.0 108.717 175.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -66.94 -35.32 79.72 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 123.686 2.948 . . . . 0.0 113.346 -176.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 82.3 mtm-85 -64.8 -31.36 72.56 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 127.608 3.575 . . . . 0.0 115.132 165.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.78 -30.0 45.33 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 111.882 -2.417 . . . . 0.0 105.521 -172.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.46 -37.05 77.15 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 123.485 1.612 . . . . 0.0 114.613 175.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 68.6 mt -74.91 -25.63 59.05 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 117.724 2.49 . . . . 0.0 117.724 167.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.11 -45.88 94.49 Favored Glycine 0 CA--C 1.526 0.751 0 O-C-N 118.837 -2.414 . . . . 0.0 111.87 164.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 58.3 m -60.98 -57.16 13.8 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 130.249 3.42 . . . . 0.0 109.412 174.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.38 26.9 mtt180 -60.59 -31.37 70.52 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.025 -1.047 . . . . 0.0 113.452 -170.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 46.8 t -67.97 -45.47 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.251 0.62 . . . . 0.0 110.088 174.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.76 -1.96 6.27 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.549 -2.594 . . . . 0.0 115.329 171.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . . . . . . . . . 53.1 mt -99.49 -34.13 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 120.557 1.526 . . . . 0.0 110.328 173.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 77.5 t -69.85 -41.49 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 O-C-N 117.592 -3.192 . . . . 0.0 113.852 172.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -64.02 -42.66 97.06 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 122.494 1.14 . . . . 0.0 111.944 176.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -64.34 -24.6 67.7 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 170.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 97.0 mt -90.73 -17.34 26.88 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 63.5 mt -84.81 -41.08 16.44 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.881 2.472 . . . . 0.0 111.482 163.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 29.7 ttm105 -61.88 -41.85 98.35 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 126.228 2.918 . . . . 0.0 112.373 175.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 67.35 12.99 61.96 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 119.682 2.633 . . . . 0.0 119.682 172.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -73.28 -31.49 64.09 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 118.442 -2.799 . . . . 0.0 111.604 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 17.3 mmt -72.04 141.53 49.29 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 126.503 3.049 . . . . 0.0 110.585 -177.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 53.8 p -114.1 169.01 9.33 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 111.466 -2.606 . . . . 0.0 113.833 -171.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -43.43 -33.91 1.18 Allowed 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 126.668 2.48 . . . . 0.0 116.606 -170.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 26.2 ttp-105 -72.37 -51.68 19.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 126.252 1.821 . . . . 0.0 109.468 -178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -69.37 -40.78 77.24 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 128.523 2.729 . . . . 0.0 112.414 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 91.1 mt -52.28 -21.46 3.5 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 117.233 2.309 . . . . 0.0 117.233 167.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -106.16 -42.79 4.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 120.322 -1.486 . . . . 0.0 110.949 166.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -88.16 -8.21 55.72 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 120.927 -1.108 . . . . 0.0 112.788 -165.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -129.71 -47.31 1.15 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 116.185 -1.864 . . . . 0.0 114.342 -177.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 mp -64.71 -28.3 69.5 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 120.164 1.347 . . . . 0.0 111.336 163.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 57.09 -151.6 26.35 Favored Glycine 0 N--CA 1.447 -0.595 0 N-CA-C 117.214 1.645 . . . . 0.0 117.214 -168.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.03 -20.84 55.42 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 116.491 -3.947 . . . . 0.0 114.981 -168.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.32 -5.1 26.63 Favored Glycine 0 C--N 1.337 0.599 0 O-C-N 126.958 2.661 . . . . 0.0 115.618 -178.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 16.5 tt -64.4 -31.87 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 O-C-N 117.601 -3.293 . . . . 0.0 110.468 170.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -84.15 -18.44 36.72 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 122.326 2.33 . . . . 0.0 114.142 -177.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 55.1 m -73.99 -26.8 60.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.269 2.228 . . . . 0.0 112.841 170.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 24.4 mm -98.13 -6.39 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 O-C-N 117.134 -3.479 . . . . 0.0 110.954 178.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 80.8 p -125.01 4.95 7.96 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 118.584 -2.573 . . . . 0.0 116.586 -166.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 53.5 mtp85 -127.66 149.09 50.36 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.399 0.68 . . . . 0.0 111.952 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 91.61 178.15 42.55 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-O 117.194 -1.892 . . . . 0.0 114.77 177.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 18.4 m -71.16 -15.56 62.49 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 118.045 2.609 . . . . 0.0 118.045 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -96.15 -7.3 36.22 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 120.524 3.528 . . . . 0.0 120.524 170.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 8.4 p -42.96 158.71 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 123.209 1.48 . . . . 0.0 114.277 175.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 57.5 tp -54.59 -38.24 66.5 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 130.536 3.534 . . . . 0.0 109.119 -167.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -99.3 -1.15 39.7 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 122.126 2.239 . . . . 0.0 113.077 -175.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -116.4 -13.21 11.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.322 -0.853 . . . . 0.0 112.656 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.29 155.76 6.54 Favored Pre-proline 0 N--CA 1.454 -0.257 0 C-N-CA 126.628 1.971 . . . . 0.0 113.896 171.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.28 149.86 83.27 Favored 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.12 1.88 . . . . 0.0 112.73 178.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 29.3 t -65.88 -46.61 88.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 126.105 1.762 . . . . 0.0 109.614 -172.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -62.29 -25.85 68.08 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 113.172 -3.299 . . . . 0.0 117.684 176.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 15.8 tp -66.55 -48.37 69.89 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 125.793 1.933 . . . . 0.0 109.377 163.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -63.95 -51.01 66.35 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.355 -165.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -60.15 -29.76 68.86 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.819 2.048 . . . . 0.0 116.236 168.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.7 t90 -78.25 -30.11 48.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 122.384 2.357 . . . . 0.0 108.673 -177.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 16.2 mt -63.77 -40.54 96.93 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 116.815 -1.564 . . . . 0.0 115.121 177.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -70.18 -18.32 63.19 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 127.522 2.329 . . . . 0.0 111.552 177.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -85.7 -28.16 24.84 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 115.359 -2.258 . . . . 0.0 116.158 167.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 17.4 t -96.42 -51.03 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 122.99 2.632 . . . . 0.0 112.803 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 85.1 mt -76.58 -23.63 53.49 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.101 -175.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 71.6 mt -128.91 29.48 5.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.102 1.761 . . . . 0.0 110.494 -168.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -53.55 131.82 39.22 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 128.08 3.8 . . . . 0.0 117.518 -174.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 70.3 m -100.92 -27.19 13.44 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 117.308 -3.37 . . . . 0.0 113.269 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 29.8 t70 . . . . . 0 C--O 1.253 1.278 0 CA-C-N 120.844 1.656 . . . . 0.0 108.521 -167.81 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 11.4 ttt . . . . . 0 N--CA 1.471 0.587 0 CA-C-O 117.19 -1.386 . . . . 0.0 114.318 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -156.36 145.03 20.09 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -168.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . 0.252 4.6 tt0 -119.23 139.88 51.14 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.382 1.473 . . . . 0.0 110.49 171.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -130.88 150.53 52.0 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 116.705 -1.616 . . . . 0.0 109.922 175.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . 0.447 ' HB2' ' HD2' ' D' ' 6' ' ' PRO . 59.7 p -103.14 168.03 9.36 Favored Pre-proline 0 N--CA 1.451 -0.388 0 C-N-CA 126.037 1.735 . . . . 0.0 111.292 170.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' D' ' 5' ' ' SER 0.329 89.5 Cg_endo -78.74 -18.42 11.83 Favored 'Trans proline' 0 N--CA 1.45 -1.049 1 C-N-CA 126.943 5.095 . . . . 0.0 118.774 -166.822 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -154.87 129.69 9.35 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.638 3.175 . . . . 0.0 106.513 156.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 30.9 t -64.81 124.74 22.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 118.432 2.752 . . . . 0.0 118.432 -174.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.82 -42.54 58.41 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 128.033 2.533 . . . . 0.0 110.37 166.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.38 -27.08 65.92 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.294 -2.129 . . . . 0.0 111.979 177.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . 0.298 9.2 mmt -66.57 -49.09 67.55 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 112.956 -3.402 . . . . 0.0 113.882 161.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.14 -36.52 51.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 125.842 2.734 . . . . 0.0 115.126 175.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 35.7 tp10 -76.04 -47.9 22.96 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 116.406 -1.759 . . . . 0.0 108.899 174.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -55.55 -44.23 76.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 128.682 2.793 . . . . 0.0 110.668 176.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . 0.406 HH21 ' CD ' ' D' ' 18' ' ' GLU . 0.0 OUTLIER -64.66 -37.06 86.28 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 118.324 -2.735 . . . . 0.0 115.372 173.651 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -57.56 -45.39 85.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 119.809 1.186 . . . . 0.0 114.199 165.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -74.99 -35.04 62.04 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.639 -1.913 . . . . 0.0 114.305 -175.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . 0.406 ' CD ' HH21 ' D' ' 15' ' ' ARG . 79.0 mt-10 -62.0 -21.28 64.73 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 116.189 -1.862 . . . . 0.0 113.924 163.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -89.33 -26.72 20.95 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 127.22 2.825 . . . . 0.0 113.104 172.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . 0.479 HD23 ' HA ' ' D' ' 20' ' ' LEU . 20.4 mt -69.61 -30.23 67.93 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 123.788 1.756 . . . . 0.0 113.607 172.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 37.7 ttt180 -71.51 -24.79 62.03 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.317 -2.115 . . . . 0.0 112.261 168.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . 0.406 ' CZ ' HD22 ' D' ' 26' ' ' LEU . 69.3 t80 -74.06 -56.45 4.92 Favored 'General case' 0 N--CA 1.453 -0.318 1 O-C-N 115.746 -4.346 . . . . 0.0 108.972 167.406 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 23.4 t -58.76 -37.82 68.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 121.527 1.967 . . . . 0.0 114.476 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -61.19 -39.4 90.03 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 124.76 1.288 . . . . 0.0 114.442 166.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 16.6 tp -67.44 -41.67 84.38 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 119.937 -1.727 . . . . 0.0 112.466 177.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . 0.406 HD22 ' CZ ' ' D' ' 22' ' ' PHE . 55.0 tp -63.07 -49.36 74.8 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 113.53 -3.128 . . . . 0.0 112.07 171.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -48.91 -55.7 11.0 Favored 'General case' 0 N--CA 1.451 -0.389 1 CA-C-N 126.978 4.445 . . . . 0.0 111.561 167.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -52.81 -30.84 35.65 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 121.294 1.861 . . . . 0.0 112.655 176.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.88 -34.06 62.16 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 123.126 1.441 . . . . 0.0 112.746 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -68.78 -4.93 17.9 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.109 -3.494 . . . . 0.0 115.233 163.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -104.94 -6.97 19.63 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 117.347 -3.345 . . . . 0.0 113.054 176.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 50.2 p30 -132.97 9.75 4.18 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 128.251 2.62 . . . . 0.0 114.016 174.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.38 7.1 m-20 67.35 6.76 5.07 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 116.555 2.058 . . . . 0.0 116.555 173.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 32.1 mt -77.68 16.24 0.7 Allowed 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 116.484 -3.885 . . . . 0.0 115.2 166.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -81.19 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.872 2.469 . . . . 0.0 114.059 171.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 14.3 mt -48.58 -30.12 1.95 Allowed Pre-proline 0 N--CA 1.447 -0.615 0 O-C-N 116.613 -3.804 . . . . 0.0 114.085 -176.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -68.13 -48.17 1.42 Allowed 'Trans proline' 0 N--CA 1.447 -1.241 0 O-C-N 114.412 -3.52 . . . . 0.0 116.095 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . 0.261 63.6 tp -48.97 -50.74 34.15 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 116.558 -1.687 . . . . 0.0 108.713 170.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 2.8 mt -66.54 -39.32 88.5 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 113.69 -3.052 . . . . 0.0 106.299 -172.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 -84.22 -17.26 40.44 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 115.587 -2.149 . . . . 0.0 114.119 -176.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 39.9 tp -65.72 -54.5 26.49 Favored 'General case' 0 N--CA 1.446 -0.655 0 O-C-N 125.01 1.444 . . . . 0.0 108.379 161.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 1.7 mmt -68.1 -39.52 82.81 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 117.101 -1.428 . . . . 0.0 108.43 -168.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 37.3 mt -119.59 137.32 53.93 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 -165.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 8.0 p -73.85 153.75 89.07 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-N 114.057 -1.429 . . . . 0.0 112.757 177.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -48.99 -37.15 36.66 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 124.97 3.78 . . . . 0.0 120.496 -174.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.365 24.5 m-20 -72.39 -23.16 61.07 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 115.069 -2.396 . . . . 0.0 111.189 176.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -85.1 -32.03 23.03 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 15.7 mtm180 -75.8 -37.1 59.46 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.597 1.559 . . . . 0.0 110.6 173.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -54.83 -47.21 74.4 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 129.401 3.081 . . . . 0.0 107.76 170.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.46 -46.18 80.86 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -178.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.71 -42.76 95.05 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 116.141 -1.885 . . . . 0.0 113.4 174.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -60.76 -27.07 65.97 Favored Glycine 0 C--N 1.338 0.643 0 CA-C-N 120.307 1.412 . . . . 0.0 116.063 167.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 95.7 m -82.99 -35.48 25.84 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 117.052 -3.617 . . . . 0.0 110.94 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -60.71 -33.39 72.81 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 116.841 -3.662 . . . . 0.0 108.519 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 43.9 t -64.27 -36.11 76.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 123.738 2.972 . . . . 0.0 114.124 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -80.56 -32.28 36.66 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 115.973 -1.965 . . . . 0.0 114.52 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 82.7 mt -49.0 -48.75 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.6 0 CA-C-O 116.612 -1.661 . . . . 0.0 113.568 160.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 75.3 t -68.99 -43.77 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 O-C-N 124.578 1.174 . . . . 0.0 109.835 -178.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -59.13 -40.02 84.16 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -67.04 -25.86 66.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 116.213 -1.851 . . . . 0.0 112.35 175.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 mt -72.96 -13.35 61.22 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 122.152 2.251 . . . . 0.0 112.169 173.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 85.5 mt -111.85 -18.96 12.57 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 117.393 -1.289 . . . . 0.0 113.759 176.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 ttm105 -69.85 -47.49 62.46 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 162.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 44.55 66.02 1.54 Allowed Glycine 0 CA--C 1.52 0.381 0 C-N-CA 126.285 1.898 . . . . 0.0 110.156 -173.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -130.67 -29.78 1.91 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.023 0.929 . . . . 0.0 112.282 164.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 22.2 mmt -81.02 69.35 7.6 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 125.213 2.435 . . . . 0.0 108.342 165.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 89.6 p -79.16 145.68 33.55 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.593 1.957 . . . . 0.0 111.243 -162.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 56.55 -88.17 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 112.125 -2.307 . . . . 0.0 115.927 156.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -72.54 -33.46 66.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 169.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -64.66 -42.72 95.2 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.94 -41.09 77.62 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 125.58 1.8 . . . . 0.0 112.517 174.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 58.1 mtmt -77.71 -37.31 49.77 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 125.09 1.493 . . . . 0.0 112.088 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -83.34 -56.3 3.84 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 121.692 2.042 . . . . 0.0 111.441 -177.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -93.95 -38.69 11.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 125.126 1.516 . . . . 0.0 113.128 -162.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -90.21 -24.06 21.1 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 117.258 -1.353 . . . . 0.0 108.152 175.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 74.58 -153.76 46.38 Favored Glycine 0 C--N 1.335 0.52 0 O-C-N 118.356 -2.715 . . . . 0.0 118.187 141.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -34.83 -65.02 0.23 Allowed 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 129.228 3.011 . . . . 0.0 113.71 -165.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.73 -1.7 2.9 Favored Glycine 0 C--N 1.339 0.701 0 O-C-N 126.412 2.32 . . . . 0.0 116.851 -174.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 2.2 tt -47.53 -34.69 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 122.549 3.175 . . . . 0.0 111.181 164.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -91.63 -20.78 21.26 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 119.388 -2.07 . . . . 0.0 110.266 -169.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 81.9 m -65.55 -46.2 80.46 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.349 1.86 . . . . 0.0 110.695 163.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 mm -73.9 -33.89 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.639 0 C-N-CA 125.347 1.459 . . . . 0.0 111.361 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 16.3 p -119.72 9.61 11.45 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 118.775 2.88 . . . . 0.0 118.775 -174.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 17.8 mtp85 -123.85 173.47 8.16 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 153.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.63 152.98 29.72 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-O 116.633 -2.204 . . . . 0.0 113.498 -154.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 9.6 p -61.44 -29.6 70.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -165.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -128.6 45.05 2.85 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 123.878 1.799 . . . . 0.0 112.18 -177.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 1.7 p -69.24 177.73 2.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 119.808 -1.808 . . . . 0.0 109.382 -178.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 2.0 tp -66.22 -24.05 66.54 Favored 'General case' 0 N--CA 1.451 -0.379 1 O-C-N 116.108 -4.12 . . . . 0.0 114.731 176.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -67.72 -7.81 30.24 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 118.394 2.739 . . . . 0.0 118.394 159.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -133.93 11.95 3.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 115.382 -2.247 . . . . 0.0 113.245 -168.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . 0.428 ' HA ' ' C ' ' D' ' 93' ' ' PRO . . . 30.35 99.32 0.03 OUTLIER Pre-proline 0 N--CA 1.452 -0.343 0 N-CA-C 116.558 2.058 . . . . 0.0 116.558 134.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . 0.428 ' C ' ' HA ' ' D' ' 92' ' ' ALA 0.346 0.3 OUTLIER 39.33 43.98 0.0 OUTLIER 'Cis proline' 0 N--CA 1.445 -1.341 0 O-C-N 117.147 -2.08 . . . . 0.0 109.902 26.339 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.94 -21.11 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 O-C-N 119.508 -1.995 . . . . 0.0 111.26 170.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.304 0.0 OUTLIER -91.15 -26.16 19.23 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 125.462 1.726 . . . . 0.0 112.201 -171.414 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 46.3 tp -66.21 -51.7 55.14 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 131.064 3.745 . . . . 0.0 108.495 162.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -58.94 -48.8 80.2 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 126.128 1.771 . . . . 0.0 113.802 -174.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -63.56 -29.14 70.44 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 125.423 1.702 . . . . 0.0 115.399 170.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 70.6 t90 -83.37 -27.31 29.76 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 121.335 1.88 . . . . 0.0 111.652 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 25.7 mt -69.59 -34.8 74.65 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 117.179 -3.451 . . . . 0.0 110.498 171.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -67.64 -20.52 65.34 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 116.812 -1.566 . . . . 0.0 112.769 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -104.74 -9.88 17.82 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 126.556 2.41 . . . . 0.0 116.765 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . 0.439 3.2 t -106.74 -26.61 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-O 125.698 2.666 . . . . 0.0 116.141 171.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 36.0 mt -104.83 -19.24 13.96 Favored 'General case' 0 N--CA 1.445 -0.685 0 O-C-N 116.611 -3.806 . . . . 0.0 114.545 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 5.1 mp -110.73 44.7 1.23 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.771 1.628 . . . . 0.0 110.495 153.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -62.83 167.71 4.44 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 117.835 2.532 . . . . 0.0 117.835 169.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 15.9 m -52.4 -42.23 63.85 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 119.314 -2.116 . . . . 0.0 115.08 -170.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.247 0.945 0 C-N-CA 128.612 2.765 . . . . 0.0 118.104 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 117.905 -1.045 . . . . 0.0 112.308 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.97 -1.93 53.8 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 112.683 -3.607 . . . . 0.0 115.435 -159.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . 0.254 36.4 tt0 -89.32 -19.44 25.28 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 128.973 2.909 . . . . 0.0 110.488 171.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 mp0 -79.49 7.73 7.61 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 117.628 2.455 . . . . 0.0 117.628 162.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.31 142.1 39.23 Favored Pre-proline 0 N--CA 1.447 -0.621 0 C-N-CA 128.342 2.657 . . . . 0.0 111.995 178.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -101.4 13.32 0.41 Allowed 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 123.71 2.94 . . . . 0.0 110.311 176.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -143.94 154.55 43.43 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.213 2.205 . . . . 0.0 113.791 170.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.0 t -152.77 132.65 13.28 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 129.764 3.225 . . . . 0.0 112.543 168.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.06 -15.78 63.35 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 116.687 -1.625 . . . . 0.0 111.682 175.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.46 -43.26 10.98 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 121.999 2.181 . . . . 0.0 111.228 -172.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 14.3 tpt -69.12 -27.56 65.68 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 126.473 1.909 . . . . 0.0 109.286 167.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.32 -22.78 61.13 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 120.428 3.492 . . . . 0.0 120.428 167.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -69.78 -37.51 76.37 Favored 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 120.985 -1.072 . . . . 0.0 112.292 157.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -66.78 -37.25 84.22 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 116.645 -3.784 . . . . 0.0 109.414 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.5 mmt180 -76.97 -3.81 40.83 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 130.747 3.619 . . . . 0.0 116.683 169.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -83.0 -50.31 8.67 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 116.412 -2.115 . . . . 0.0 110.334 163.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -41.76 -41.19 2.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 119.37 3.1 . . . . 0.0 119.37 161.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -65.17 -36.9 85.66 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.032 1.333 . . . . 0.0 113.694 174.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 9.2 t-105 -72.44 -45.57 59.01 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 117.61 -1.186 . . . . 0.0 112.807 170.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.32 -27.52 67.4 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 117.696 -1.145 . . . . 0.0 113.002 178.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . 0.313 12.1 ttt-85 -60.24 -23.22 63.9 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 130.756 3.622 . . . . 0.0 115.329 169.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . 0.252 61.6 t80 -79.79 -43.95 21.54 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 115.427 -2.509 . . . . 0.0 109.684 165.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 68.8 t -69.51 -35.99 69.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 114.949 1.463 . . . . 0.0 114.949 -168.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -60.96 -37.01 80.89 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 165.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.9 tp -72.61 -30.41 64.32 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.257 1.023 . . . . 0.0 112.298 -177.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 48.5 tp -82.28 -31.76 29.91 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 128.047 2.539 . . . . 0.0 106.056 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -62.73 -44.35 96.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 121.996 2.18 . . . . 0.0 108.261 175.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -68.39 -36.29 78.94 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 127.475 3.512 . . . . 0.0 109.65 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.83 -40.93 95.98 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 116.535 -3.853 . . . . 0.0 117.477 175.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -68.84 -33.48 73.9 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 120.544 1.52 . . . . 0.0 113.044 173.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -71.96 -21.24 61.62 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 117.161 -3.462 . . . . 0.0 116.39 170.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -101.26 11.72 38.81 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 114.04 -2.886 . . . . 0.0 114.512 168.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 48.67 42.94 20.27 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 125.225 1.578 . . . . 0.0 113.142 -175.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.5 mt -114.28 -1.66 13.53 Favored 'General case' 0 N--CA 1.45 -0.458 1 C-N-CA 133.538 4.735 . . . . 0.0 113.314 176.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -56.81 -43.08 80.62 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 122.683 2.492 . . . . 0.0 112.951 -178.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.444 HD23 ' HA ' ' A' ' 36' ' ' LEU . 12.5 mt -64.17 -63.45 3.82 Favored Pre-proline 0 N--CA 1.447 -0.584 0 O-C-N 120.549 -1.344 . . . . 0.0 109.841 -175.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -70.17 -11.58 30.56 Favored 'Trans proline' 0 N--CA 1.451 -1.014 0 CA-C-O 115.462 -1.974 . . . . 0.0 112.716 -174.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 37.6 tp -70.52 -63.25 1.13 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 129.254 3.021 . . . . 0.0 105.105 167.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 37.0 mt -58.86 -34.5 71.67 Favored 'General case' 0 N--CA 1.447 -0.587 0 O-C-N 119.571 -1.956 . . . . 0.0 114.537 -175.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -51.71 -50.76 59.88 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 124.479 1.112 . . . . 0.0 112.299 164.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.8 tt -64.32 -47.18 80.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 126.584 1.954 . . . . 0.0 109.869 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 65.9 mmm -83.86 -17.95 39.17 Favored 'General case' 0 N--CA 1.453 -0.295 1 CA-C-O 111.306 -4.188 . . . . 0.0 116.49 -167.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 mt -133.5 138.77 46.28 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 124.201 3.182 . . . . 0.0 108.444 170.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 76.9 p -73.5 155.5 89.41 Favored Pre-proline 0 N--CA 1.448 -0.544 0 CA-C-N 114.359 -1.291 . . . . 0.0 111.011 177.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -59.45 -29.24 89.55 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 CA-C-O 114.905 -2.206 . . . . 0.0 117.212 -170.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.49 -23.61 53.76 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 122.748 2.522 . . . . 0.0 107.372 178.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -81.26 -27.63 35.08 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 116.74 -3.725 . . . . 0.0 113.221 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.8 mtm-85 -69.73 -57.13 5.5 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 117.904 -2.998 . . . . 0.0 108.373 178.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . 0.275 24.4 tt0 -61.84 -27.18 68.59 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 126.365 1.866 . . . . 0.0 111.889 177.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.75 -38.05 70.44 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 127.62 2.368 . . . . 0.0 110.269 174.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 8.9 mt -70.62 -27.71 64.29 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 120.823 1.647 . . . . 0.0 115.199 166.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.5 -38.02 95.69 Favored Glycine 0 C--N 1.335 0.501 0 CA-C-N 122.094 2.225 . . . . 0.0 111.299 167.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.0 m -68.91 -39.87 79.42 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 119.614 3.19 . . . . 0.0 119.614 171.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -54.93 -24.13 22.21 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 114.829 -2.51 . . . . 0.0 115.724 163.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.3 t -60.93 -38.66 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 122.397 2.362 . . . . 0.0 113.17 164.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.8 ttt180 -77.74 -29.67 51.23 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 114.983 -2.436 . . . . 0.0 114.378 171.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 66.8 mt -74.74 -24.57 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 122.48 2.4 . . . . 0.0 112.556 172.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 4.3 t -71.12 -51.77 32.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 C-N-CA 124.789 1.236 . . . . 0.0 110.986 159.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -50.51 -67.99 0.21 Allowed 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.067 1.747 . . . . 0.0 111.922 178.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -71.79 -34.93 69.82 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.611 2.365 . . . . 0.0 110.541 -165.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.66 -39.45 91.42 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 118.022 2.601 . . . . 0.0 118.022 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.89 -37.14 72.98 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.751 2.02 . . . . 0.0 113.877 177.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 34.8 ttm105 -66.76 -44.6 80.97 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 117.192 2.293 . . . . 0.0 117.192 165.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.7 18.02 55.49 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 110.014 -3.266 . . . . 0.0 113.372 155.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . 0.257 47.9 mm-40 -88.18 -27.22 21.98 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 120.595 2.198 . . . . 0.0 107.025 -179.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 57.3 mtt -91.91 124.95 36.4 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 125.098 1.499 . . . . 0.0 112.603 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.8 p -73.07 164.63 26.41 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.024 1.73 . . . . 0.0 112.589 166.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.404 ' HB3' HG23 ' A' ' 79' ' ' ILE . 48.6 mt-30 -59.4 -40.06 85.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 123.967 0.792 . . . . 0.0 112.999 166.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 42.2 tpt85 -57.63 -27.37 62.73 Favored 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 173.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -87.1 -34.99 18.93 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 117.063 2.245 . . . . 0.0 117.063 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 92.0 mt -58.6 -26.16 63.38 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 118.806 -2.434 . . . . 0.0 115.592 167.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -42.28 -44.67 3.92 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 115.663 1.727 . . . . 0.0 115.663 157.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -83.37 -46.12 12.93 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 174.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -62.53 -46.77 86.87 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 125.458 1.503 . . . . 0.0 111.148 -169.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.9 mt -119.09 9.21 11.73 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 111.787 -2.46 . . . . 0.0 109.042 -169.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.79 12.1 74.17 Favored Glycine 0 C--N 1.337 0.596 0 N-CA-C 117.985 1.954 . . . . 0.0 117.985 174.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -97.2 141.59 30.14 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 118.875 2.917 . . . . 0.0 118.875 -157.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.03 123.17 21.04 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-O 116.656 -2.191 . . . . 0.0 110.422 168.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.404 HG23 ' HB3' ' A' ' 68' ' ' GLN . 72.0 mt -53.88 -35.08 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 CA-C-N 118.719 1.259 . . . . 0.0 112.387 -162.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.2 -14.36 61.78 Favored 'General case' 0 N--CA 1.452 -0.355 0 O-C-N 119.308 -2.12 . . . . 0.0 114.491 -171.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 78.0 p -74.56 -44.6 50.2 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 177.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 37.9 mm -68.93 -29.23 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.658 0 CA-C-O 115.091 -2.385 . . . . 0.0 107.453 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 99.0 m -60.89 -32.15 71.62 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 120.908 1.686 . . . . 0.0 114.009 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -69.69 -46.26 66.43 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 120.919 -1.113 . . . . 0.0 113.114 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -75.15 -26.97 65.05 Favored Glycine 0 CA--C 1.525 0.712 0 O-C-N 119.739 -1.851 . . . . 0.0 110.29 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 64.2 m -64.64 -38.93 92.68 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.854 0.862 . . . . 0.0 110.161 169.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -77.34 -30.03 53.72 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 118.697 -2.502 . . . . 0.0 110.757 175.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 23.7 m -67.43 -40.14 85.46 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 122.362 2.346 . . . . 0.0 112.938 170.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.4 tp -64.4 -41.7 96.5 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 117.626 2.454 . . . . 0.0 117.626 168.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 37.8 tttt -57.8 -39.53 77.79 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 119.756 -1.84 . . . . 0.0 111.04 165.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -86.71 3.59 44.2 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 121.422 3.86 . . . . 0.0 121.422 175.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.44 153.36 85.8 Favored Pre-proline 0 N--CA 1.449 -0.482 0 O-C-N 126.336 2.272 . . . . 0.0 108.782 178.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -67.12 148.57 81.28 Favored 'Trans proline' 0 N--CA 1.452 -0.942 0 N-CA-C 109.303 -1.076 . . . . 0.0 109.303 -175.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.14 -30.79 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-O 117.852 -1.071 . . . . 0.0 111.692 -163.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 16.1 pm0 -76.86 -7.96 56.46 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 127.267 2.227 . . . . 0.0 111.392 -177.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 49.3 tp -87.34 -46.85 9.29 Favored 'General case' 0 CA--C 1.517 -0.325 0 O-C-N 124.794 1.309 . . . . 0.0 112.944 168.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 54.5 mtm-85 -56.86 -35.28 68.7 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 119.251 -2.156 . . . . 0.0 110.493 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -66.94 -20.61 65.93 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 116.844 -3.66 . . . . 0.0 117.69 171.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 27.1 t90 -90.27 -42.94 10.7 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 118.061 -2.9 . . . . 0.0 106.715 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.66 -20.45 64.83 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 126.12 1.768 . . . . 0.0 114.683 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -70.21 -48.53 56.69 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 117.861 -3.024 . . . . 0.0 108.677 170.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -71.44 -32.23 68.12 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.239 -175.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 80.8 t -81.37 -59.75 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-O 113.464 -3.16 . . . . 0.0 110.959 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 36.6 mt -96.28 -29.69 13.86 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 127.367 2.917 . . . . 0.0 113.268 -172.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 11.7 mt -107.46 -22.9 12.38 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 114.735 -2.786 . . . . 0.0 110.84 -159.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -59.51 -22.93 62.34 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 125.319 2.485 . . . . 0.0 115.19 -175.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 85.9 p -66.24 -27.73 68.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 111.855 -2.43 . . . . 0.0 117.442 -173.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.252 1.209 0 O-C-N 117.229 -3.419 . . . . 0.0 116.919 176.676 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.6 tmm? . . . . . 0 N--CA 1.473 0.717 0 CA-C-O 118.048 -0.977 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.49 -24.56 63.7 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 127.556 2.342 . . . . 0.0 116.618 -165.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -100.96 -10.31 20.7 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 124.823 2.249 . . . . 0.0 114.601 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -82.5 -50.35 8.93 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 118.31 -2.744 . . . . 0.0 113.786 172.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 34.9 m -88.15 125.21 64.83 Favored Pre-proline 0 N--CA 1.449 -0.475 0 C-N-CA 127.678 2.391 . . . . 0.0 109.433 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -67.63 -19.91 47.47 Favored 'Trans proline' 0 N--CA 1.448 -1.183 0 N-CA-C 121.368 3.565 . . . . 0.0 121.368 172.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . 0.292 78.2 t80 -104.6 133.96 48.57 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 127.499 2.32 . . . . 0.0 108.383 167.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 14.3 t -161.43 124.93 3.24 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 119.382 -2.074 . . . . 0.0 110.886 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.79 -45.45 74.33 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.185 2.594 . . . . 0.0 110.043 174.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.76 -28.82 69.71 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 118.244 2.683 . . . . 0.0 118.244 174.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -82.86 -30.27 28.74 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.289 1.836 . . . . 0.0 108.097 172.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.77 -17.9 65.1 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.438 2.014 . . . . 0.0 116.438 163.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -85.02 -46.14 11.47 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.508 1.123 . . . . 0.0 112.615 171.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 36.5 tp60 -63.77 -28.78 70.11 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 118.392 -0.813 . . . . 0.0 111.863 175.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.448 ' HD3' ' HA ' ' B' ' 15' ' ' ARG . 25.9 mmt180 -85.41 -16.21 40.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 119.774 -1.829 . . . . 0.0 113.793 173.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -80.69 -33.46 35.4 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 119.182 -2.199 . . . . 0.0 108.433 172.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -78.03 -13.52 59.84 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 118.185 -2.822 . . . . 0.0 110.852 175.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -72.91 -39.0 66.68 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 126.183 1.793 . . . . 0.0 113.321 160.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -62.05 -35.94 80.12 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 119.37 -2.081 . . . . 0.0 111.005 173.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 93.9 mt -70.01 -26.78 64.23 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 128.425 2.69 . . . . 0.0 113.963 179.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -54.0 -59.97 3.94 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 115.685 -2.102 . . . . 0.0 110.336 165.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -44.33 -45.74 8.94 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.011 2.187 . . . . 0.0 112.949 166.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 39.8 t -65.29 -48.42 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 -176.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.14 -33.74 73.93 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 117.427 -3.296 . . . . 0.0 113.5 172.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 48.6 tp -61.53 -47.03 87.44 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 177.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.261 65.3 tp -66.96 -39.56 87.27 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.308 -3.37 . . . . 0.0 116.066 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -56.3 -44.8 80.24 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 120.423 -1.423 . . . . 0.0 110.079 173.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -71.87 -30.08 65.04 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . 0.299 . . -68.14 -42.33 80.29 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 113.475 -3.155 . . . . 0.0 114.938 168.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -70.27 -10.59 59.38 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 116.617 2.081 . . . . 0.0 116.617 170.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -84.35 -13.3 52.72 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.845 1.258 . . . . 0.0 112.865 168.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -121.63 6.79 9.99 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 122.513 1.149 . . . . 0.0 112.747 176.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.294 1.7 m-20 57.04 30.12 17.66 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 119.429 -2.045 . . . . 0.0 115.496 -176.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 50.4 mt -102.3 14.21 32.57 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 128.886 2.874 . . . . 0.0 110.127 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -64.93 -38.57 91.39 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 114.583 -2.627 . . . . 0.0 117.764 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . 0.26 34.0 tp -67.59 -55.1 15.33 Favored Pre-proline 0 N--CA 1.447 -0.578 0 O-C-N 126.007 2.067 . . . . 0.0 109.569 -175.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.31 -14.45 22.91 Favored 'Trans proline' 0 N--CA 1.449 -1.135 0 C-N-CA 123.794 2.996 . . . . 0.0 114.025 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 40.4 tp -73.93 -41.74 61.61 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 119.405 -2.059 . . . . 0.0 112.511 163.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 46.3 mt -75.9 -25.57 56.18 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 115.917 -1.992 . . . . 0.0 115.144 175.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -67.76 -41.26 83.61 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.855 1.262 . . . . 0.0 110.345 163.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 26.7 tp -62.3 -46.38 89.02 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 117.671 -3.143 . . . . 0.0 107.283 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 23.7 mmt -77.57 -17.22 58.08 Favored 'General case' 0 N--CA 1.449 -0.519 0 O-C-N 118.602 -2.561 . . . . 0.0 116.975 -169.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 mt -134.01 138.12 45.19 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 118.634 -2.541 . . . . 0.0 108.059 -175.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 64.8 p -89.01 164.98 29.05 Favored Pre-proline 0 N--CA 1.45 -0.467 0 C-N-CA 127.58 2.352 . . . . 0.0 109.607 -171.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -60.66 -27.99 85.78 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 124.215 3.277 . . . . 0.0 117.311 -172.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -76.49 -25.8 54.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 119.67 -1.894 . . . . 0.0 112.052 173.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -92.5 -33.7 14.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 116.628 -3.795 . . . . 0.0 110.168 -169.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 mtm-85 -70.88 -40.96 71.94 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 115.354 -2.26 . . . . 0.0 111.808 176.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -67.27 -30.78 70.76 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 119.891 1.223 . . . . 0.0 111.335 170.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.85 -34.08 60.05 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 120.003 -1.686 . . . . 0.0 115.044 177.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 28.3 mt -62.7 -44.59 95.83 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 118.694 -2.504 . . . . 0.0 110.635 166.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -42.65 -52.43 5.44 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-N 122.295 2.316 . . . . 0.0 114.411 163.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 6.2 m -74.74 -37.86 62.4 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.503 -0.848 . . . . 0.0 111.262 -170.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.42 ' HA ' HD12 ' B' ' 57' ' ' ILE . 89.7 mtt180 -57.48 -35.94 70.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 113.11 -3.329 . . . . 0.0 113.597 168.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 62.5 t -65.7 -35.25 74.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 C-N-CA 114.241 -2.984 . . . . 0.0 106.749 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 48.6 mtp180 -74.98 -22.37 58.59 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 116.973 -1.489 . . . . 0.0 114.788 177.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.42 HD12 ' HA ' ' B' ' 54' ' ' ARG . 31.6 mt -70.17 -47.59 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 119.789 1.177 . . . . 0.0 108.767 173.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.283 47.1 t -73.84 -25.26 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 118.099 -2.876 . . . . 0.0 109.362 -175.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -64.34 -49.45 71.65 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 115.496 1.665 . . . . 0.0 115.496 166.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -64.68 -33.9 77.03 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 127.435 2.959 . . . . 0.0 110.858 175.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 52.1 mt -63.01 -21.22 66.0 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 122.567 2.44 . . . . 0.0 116.74 169.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 39.0 mt -89.05 -38.74 14.15 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 116.9 -1.524 . . . . 0.0 112.173 167.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . 0.281 26.2 ttm105 -55.02 -53.13 59.67 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 123.964 1.84 . . . . 0.0 112.879 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.61 45.91 33.91 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-O 114.666 -3.297 . . . . 0.0 116.034 -172.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -118.26 -44.95 2.66 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 121.107 2.453 . . . . 0.0 115.018 -173.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 50.7 mtt -70.34 148.36 48.55 Favored 'General case' 0 N--CA 1.447 -0.586 2 O-C-N 113.286 -5.884 . . . . 0.0 114.43 179.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 73.0 p -74.96 161.36 29.57 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 128.063 2.545 . . . . 0.0 115.452 158.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -55.02 -24.42 24.46 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.557 0.694 . . . . 0.0 112.119 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 67.0 ttt-85 -77.1 -39.59 48.97 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 127.553 2.341 . . . . 0.0 110.61 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -70.68 -45.44 65.05 Favored 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 127.229 2.831 . . . . 0.0 108.229 174.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 44.7 mt -49.72 -41.02 42.49 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 117.451 2.389 . . . . 0.0 117.451 173.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 17.7 tptp -62.32 -43.91 97.72 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 127.479 2.311 . . . . 0.0 116.491 171.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -114.95 -24.09 8.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 126.02 1.728 . . . . 0.0 113.104 -158.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -105.7 -13.89 15.42 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 125.121 1.368 . . . . 0.0 113.862 175.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 57.4 mt -137.62 -3.6 1.87 Allowed 'General case' 0 N--CA 1.446 -0.628 1 O-C-N 116.044 -4.16 . . . . 0.0 108.398 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 84.46 2.75 88.89 Favored Glycine 0 C--N 1.336 0.561 0 O-C-N 120.033 -1.667 . . . . 0.0 113.902 164.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.54 133.76 52.24 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 117.602 -3.293 . . . . 0.0 118.306 -172.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.59 177.6 39.09 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 127.978 2.704 . . . . 0.0 114.471 174.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 40.6 mm -70.19 -35.86 65.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 O-C-N 118.071 -3.017 . . . . 0.0 111.513 -161.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.35 -36.62 81.77 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 113.894 -2.955 . . . . 0.0 113.127 170.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 74.9 m -54.89 -54.3 44.27 Favored 'General case' 0 N--CA 1.449 -0.495 0 O-C-N 127.898 3.249 . . . . 0.0 114.1 172.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 20.4 mm -79.62 -37.05 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 112.527 -2.124 . . . . 0.0 112.391 -170.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 18.6 m -55.4 -47.39 75.96 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 116.154 -1.879 . . . . 0.0 109.724 168.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -55.68 -53.67 53.64 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 123.13 2.695 . . . . 0.0 116.198 173.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -49.24 -31.68 12.65 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 116.042 1.177 . . . . 0.0 116.042 166.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 60.4 p -81.83 -36.31 28.44 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 119.377 -2.249 . . . . 0.0 114.026 173.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -62.49 -30.48 71.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 115.847 -2.025 . . . . 0.0 114.778 167.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 50.7 m -66.84 -32.04 73.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 122.2 2.273 . . . . 0.0 112.079 171.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 5.7 mt -73.82 -35.27 64.84 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 115.68 -2.105 . . . . 0.0 112.409 168.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 38.3 tttm -66.82 -36.19 81.79 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 121.011 1.732 . . . . 0.0 114.635 164.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.24 -28.26 67.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 118.086 -2.884 . . . . 0.0 108.4 175.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.76 145.82 97.32 Favored Pre-proline 0 N--CA 1.446 -0.647 0 CA-C-N 123.811 3.005 . . . . 0.0 111.306 -170.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -72.9 153.89 53.16 Favored 'Trans proline' 0 N--CA 1.449 -1.122 0 C-N-CA 124.397 3.398 . . . . 0.0 111.526 173.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 16.7 m -64.47 -19.07 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 O-C-N 118.434 -2.666 . . . . 0.0 116.192 -177.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -77.18 -16.07 59.25 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 125.356 1.462 . . . . 0.0 113.738 173.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 18.0 tp -90.85 -47.57 7.53 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 118.209 -2.807 . . . . 0.0 114.248 161.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 21.1 mtp85 -57.75 -48.06 80.71 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 116.2 -1.857 . . . . 0.0 114.404 -176.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -78.82 -12.07 60.01 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 127.088 2.743 . . . . 0.0 115.063 177.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -76.69 -45.0 31.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.563 1.145 . . . . 0.0 109.744 174.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 11.4 mt -62.08 -42.95 99.74 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 118.726 -2.484 . . . . 0.0 113.528 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -58.95 -31.53 68.8 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 115.689 -2.404 . . . . 0.0 115.257 -178.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -92.74 -27.38 17.26 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 128.521 2.728 . . . . 0.0 118.156 -171.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.9 t -82.39 -42.05 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 O-C-N 119.086 -2.259 . . . . 0.0 110.351 168.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 75.9 mt -77.49 -77.04 0.16 Allowed 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 123.574 0.546 . . . . 0.0 112.125 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 13.3 mt -77.35 -24.83 50.66 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.204 1.401 . . . . 0.0 110.77 -153.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -61.03 -22.46 64.58 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 123.641 2.928 . . . . 0.0 110.896 171.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 49.5 m -110.85 8.93 22.45 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 129.588 3.155 . . . . 0.0 115.305 -177.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 26.5 t70 . . . . . 0 C--O 1.25 1.095 0 N-CA-C 116.102 1.89 . . . . 0.0 116.102 178.413 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 19.8 ttt . . . . . 0 N--CA 1.471 0.604 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.53 159.13 25.21 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 122.451 1.12 . . . . 0.0 110.419 -173.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -152.82 155.3 36.85 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.453 2.301 . . . . 0.0 107.745 -167.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -154.32 111.42 3.38 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 -164.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 81.5 p -101.02 159.03 30.64 Favored Pre-proline 0 N--CA 1.444 -0.736 0 O-C-N 118.992 -2.318 . . . . 0.0 109.042 -175.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -63.5 -28.93 70.75 Favored 'Trans proline' 0 N--CA 1.447 -1.25 0 CA-C-O 115.851 -1.812 . . . . 0.0 112.977 -167.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -153.67 142.63 21.19 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 127.827 3.205 . . . . 0.0 111.957 176.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 44.5 t -133.81 118.77 18.41 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 125.665 2.65 . . . . 0.0 107.092 178.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.79 -20.2 60.54 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 119.482 -2.011 . . . . 0.0 109.333 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.19 -26.91 32.94 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 121.752 2.069 . . . . 0.0 112.84 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 17.9 mtt -70.1 -31.94 69.74 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 121.104 3.742 . . . . 0.0 121.104 151.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.84 -40.25 83.68 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 126.147 1.779 . . . . 0.0 112.352 163.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -71.72 -37.7 70.59 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 116.369 -2.132 . . . . 0.0 112.898 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -63.15 -29.76 71.05 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.911 1.284 . . . . 0.0 112.033 173.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . 0.28 0.0 OUTLIER -66.15 -39.3 89.71 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 118.36 -2.713 . . . . 0.0 112.826 163.037 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -68.16 -38.49 82.16 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 115.417 -2.23 . . . . 0.0 113.375 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . 0.255 31.5 mm-40 -67.53 -37.47 82.79 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 172.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -61.19 -40.51 94.21 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 115.734 -2.079 . . . . 0.0 113.697 169.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . 0.498 ' CZ2' HD13 ' D' ' 39' ' ' LEU . 24.8 t-105 -63.89 -46.09 86.41 Favored 'General case' 0 N--CA 1.451 -0.394 1 O-C-N 129.713 4.383 . . . . 0.0 113.519 177.015 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.44 -30.98 70.92 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 113.022 -1.899 . . . . 0.0 109.795 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -67.93 -27.67 66.83 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 118.557 -2.589 . . . . 0.0 115.484 172.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -61.21 -41.91 97.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 119.887 -1.758 . . . . 0.0 114.889 156.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 83.6 t -70.59 -41.76 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 C-N-CA 128.474 2.71 . . . . 0.0 112.0 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.61 -44.83 89.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 117.84 -1.076 . . . . 0.0 113.884 169.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 34.1 tp -56.79 -48.85 76.99 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 120.376 1.444 . . . . 0.0 111.651 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 25.9 tp -63.98 -34.8 78.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.394 1.878 . . . . 0.0 111.668 176.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -60.76 -39.0 87.12 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 118.224 -2.798 . . . . 0.0 114.348 -178.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -76.85 -19.13 57.86 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 125.529 1.768 . . . . 0.0 115.272 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 -22.1 35.45 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 119.148 -2.22 . . . . 0.0 113.877 -172.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -56.83 -46.64 81.57 Favored 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 116.363 -3.96 . . . . 0.0 104.534 170.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -58.67 -35.62 72.86 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 117.041 -3.537 . . . . 0.0 112.065 -170.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -106.26 9.04 32.16 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 117.425 2.38 . . . . 0.0 117.425 174.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.41 7.7 m-20 49.47 39.41 16.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 O-C-N 119.094 -2.254 . . . . 0.0 113.095 177.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 33.9 mt -86.43 -0.35 55.81 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.669 2.388 . . . . 0.0 110.937 160.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -53.65 -51.04 64.39 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 121.19 1.814 . . . . 0.0 109.374 -169.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 9.5 mt -62.05 -52.88 64.33 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-O 115.856 -2.021 . . . . 0.0 114.676 174.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . 0.282 70.5 Cg_exo -43.36 -47.11 9.28 Favored 'Trans proline' 0 N--CA 1.45 -1.054 1 C-N-CA 127.458 5.438 . . . . 0.0 116.259 166.567 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 28.3 tp -64.99 -37.4 87.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 116.987 2.217 . . . . 0.0 116.987 171.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.292 33.0 mt -77.43 -25.14 50.43 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 127.545 3.028 . . . . 0.0 110.921 177.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -59.31 -44.54 92.55 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 117.733 -1.127 . . . . 0.0 108.779 166.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . 0.422 HD22 HD21 ' D' ' 96' ' ' LEU . 64.1 tp -75.71 -46.35 31.59 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 127.989 2.515 . . . . 0.0 111.506 -169.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 84.7 mmm -88.77 -14.77 36.32 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.912 -1.117 . . . . 0.0 113.187 -163.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mp -125.48 164.9 19.46 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 122.536 1.16 . . . . 0.0 109.092 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 69.7 p -97.22 169.37 8.74 Favored Pre-proline 0 N--CA 1.448 -0.564 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 175.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -54.51 -45.8 38.27 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.685 2.257 . . . . 0.0 113.668 174.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -42.92 97.19 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.542 1.937 . . . . 0.0 111.63 177.091 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -59.52 -32.18 70.07 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.417 1.487 . . . . 0.0 114.047 179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . 95.9 mtm-85 -88.02 -34.93 17.84 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 127.665 2.386 . . . . 0.0 112.733 177.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -60.33 -41.18 93.01 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 117.092 2.256 . . . . 0.0 117.092 162.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.12 -53.92 15.01 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 119.425 -2.047 . . . . 0.0 115.303 169.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 26.3 mt -75.71 -32.66 60.16 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 126.371 2.295 . . . . 0.0 115.863 -174.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -62.9 -33.08 86.07 Favored Glycine 0 N--CA 1.448 -0.521 0 O-C-N 120.363 -1.46 . . . . 0.0 110.153 166.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 27.4 m -80.7 -47.26 14.26 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.85 0.825 . . . . 0.0 111.743 -178.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.304 89.0 mtt180 -53.39 -24.43 12.38 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 167.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 39.8 t -68.24 -38.87 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 O-C-N 117.078 -3.514 . . . . 0.0 113.157 169.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 33.9 mtp180 -81.53 -1.7 47.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 123.772 0.829 . . . . 0.0 109.001 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . 0.425 HG23 HD23 ' C' ' 75' ' ' LEU . 79.9 mt -95.17 -52.05 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 O-C-N 119.678 -1.889 . . . . 0.0 108.495 170.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 37.4 t -46.64 -52.58 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 C-N-CA 128.282 2.633 . . . . 0.0 116.949 166.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -56.04 -47.46 77.81 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 122.25 1.024 . . . . 0.0 112.223 173.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -72.53 -18.62 61.63 Favored 'General case' 0 N--CA 1.452 -0.364 1 O-C-N 115.175 -4.703 . . . . 0.0 113.083 -171.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 60.3 mt -87.5 -31.76 19.79 Favored 'General case' 0 N--CA 1.452 -0.337 0 O-C-N 118.384 -2.698 . . . . 0.0 108.313 173.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 24.3 mt -68.55 -10.81 58.14 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 118.507 -2.621 . . . . 0.0 114.358 160.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 41.2 ttm105 -104.32 -43.02 5.32 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 125.302 1.626 . . . . 0.0 113.084 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 96.11 2.16 60.89 Favored Glycine 0 C--N 1.336 0.583 0 O-C-N 119.238 -2.164 . . . . 0.0 112.497 158.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -89.26 -17.41 29.07 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 120.977 -1.308 . . . . 0.0 114.351 -166.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 10.7 mmt -56.08 125.89 23.57 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.409 1.483 . . . . 0.0 114.589 177.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . 0.285 55.4 p -78.14 166.64 22.52 Favored 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 125.932 2.02 . . . . 0.0 110.233 169.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -51.03 -29.88 13.89 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 116.555 2.057 . . . . 0.0 116.555 169.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 -65.74 -44.17 86.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 125.557 2.598 . . . . 0.0 107.788 172.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -75.56 -39.21 58.5 Favored 'General case' 0 N--CA 1.452 -0.336 1 O-C-N 116.027 -4.171 . . . . 0.0 111.572 -174.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 96.8 mt -56.76 -6.59 0.34 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 118.637 2.828 . . . . 0.0 118.637 166.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -112.1 -65.07 1.21 Allowed 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 125.551 1.782 . . . . 0.0 109.912 171.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -85.53 -9.73 56.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 112.96 -3.4 . . . . 0.0 115.892 -169.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -105.74 -45.81 4.3 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 128.71 2.804 . . . . 0.0 114.752 173.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . 0.425 HD23 HG23 ' C' ' 57' ' ' ILE . 5.2 mp -86.51 -12.06 49.92 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 116.865 -1.54 . . . . 0.0 111.659 177.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 58.51 -133.56 52.68 Favored Glycine 0 C--N 1.338 0.641 0 CA-C-N 120.6 1.545 . . . . 0.0 110.848 171.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.72 -23.78 9.99 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 126.687 2.051 . . . . 0.0 110.756 -162.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.07 -13.19 6.41 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 127.404 2.43 . . . . 0.0 117.382 167.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 19.2 tt -58.3 -39.63 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 1 O-C-N 116.181 -4.129 . . . . 0.0 115.501 175.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -49.91 -56.13 11.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 116.919 -1.515 . . . . 0.0 111.975 168.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . 0.337 28.3 m -55.57 -37.98 68.75 Favored 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 125.977 2.048 . . . . 0.0 113.889 -179.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 6.5 mm -70.58 -23.54 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-O 115.105 -2.378 . . . . 0.0 115.509 170.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 52.9 p -122.51 -17.86 6.85 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 129.71 3.204 . . . . 0.0 114.925 -164.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 74.3 mtp85 -104.05 149.44 25.18 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 130.883 3.673 . . . . 0.0 112.283 171.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 98.28 153.45 28.66 Favored Glycine 0 C--N 1.337 0.6 0 CA-C-N 121.216 1.826 . . . . 0.0 109.498 -176.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 4.3 m -75.66 9.92 2.02 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 128.522 2.729 . . . . 0.0 117.045 176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -118.89 -2.64 10.83 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.684 1.593 . . . . 0.0 115.072 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 80.1 p -45.75 166.84 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.01 1.324 . . . . 0.0 114.43 172.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 42.7 tp -56.37 -35.76 68.05 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 117.618 2.451 . . . . 0.0 117.618 -164.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -90.15 -25.2 20.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 126.785 2.034 . . . . 0.0 113.033 174.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.94 -12.66 59.36 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 125.581 1.801 . . . . 0.0 111.801 174.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -57.24 161.23 5.56 Favored Pre-proline 0 N--CA 1.45 -0.457 0 C-N-CA 128.625 2.77 . . . . 0.0 113.701 174.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -68.76 143.78 57.14 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 125.08 3.853 . . . . 0.0 112.411 177.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 81.0 t -54.47 -39.73 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 124.921 1.288 . . . . 0.0 114.439 -173.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 15.6 pm0 -63.85 -33.94 76.8 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 112.511 -3.614 . . . . 0.0 113.523 173.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 32.7 tp -71.16 -43.95 66.48 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 127.558 3.036 . . . . 0.0 116.261 172.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -63.69 -39.5 94.48 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 115.488 -2.196 . . . . 0.0 110.231 -174.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -81.69 -32.75 31.59 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 116.532 -1.699 . . . . 0.0 110.635 172.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 40.3 t90 -67.17 -42.93 83.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 122.598 2.454 . . . . 0.0 112.645 -178.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 22.6 mt -66.5 -16.69 64.33 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 123.604 2.911 . . . . 0.0 114.116 172.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -78.8 -18.89 53.36 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.133 1.773 . . . . 0.0 111.507 172.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -100.18 -41.98 6.88 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 120.173 -1.579 . . . . 0.0 108.963 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 48.9 t -72.12 -62.05 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.492 1 C-N-CA 131.822 4.049 . . . . 0.0 114.54 176.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . 0.26 38.9 mt -77.65 -18.03 57.13 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 124.414 3.279 . . . . 0.0 109.796 -171.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 90.4 mt -117.66 50.84 1.09 Allowed 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 121.039 1.745 . . . . 0.0 114.817 -169.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.257 17.3 pttp -88.42 124.49 34.01 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.605 3.066 . . . . 0.0 112.591 -157.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 17.2 m -125.02 3.87 7.99 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 127.404 2.94 . . . . 0.0 110.583 176.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 58.0 t0 . . . . . 0 C--O 1.252 1.226 0 CA-C-O 115.529 -2.177 . . . . 0.0 110.903 169.44 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.469 0.501 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.91 149.08 27.87 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -166.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -128.35 137.31 51.86 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.289 1.435 . . . . 0.0 110.781 171.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -127.34 143.09 51.28 Favored 'General case' 0 N--CA 1.447 -0.583 0 C-N-CA 127.48 2.312 . . . . 0.0 111.275 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . 0.451 ' HB2' ' HD2' ' D' ' 6' ' ' PRO . 78.0 p -95.33 153.01 39.72 Favored Pre-proline 0 N--CA 1.451 -0.381 0 C-N-CA 128.564 2.746 . . . . 0.0 110.277 173.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . 0.451 ' HD2' ' HB2' ' D' ' 5' ' ' SER . 68.8 Cg_endo -57.86 -30.8 90.72 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 122.935 2.423 . . . . 0.0 113.12 -175.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -148.57 142.91 26.23 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 129.189 2.995 . . . . 0.0 106.914 164.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 26.6 t -76.46 128.26 34.44 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 125.743 2.687 . . . . 0.0 112.263 -173.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.74 -20.86 37.75 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 118.075 -2.891 . . . . 0.0 114.288 165.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -83.76 -33.09 25.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 120.737 -1.227 . . . . 0.0 112.797 172.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 16.6 mmt -66.68 -42.81 85.94 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 118.404 -2.685 . . . . 0.0 112.531 173.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.9 -39.48 62.77 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 169.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -65.15 -55.31 19.41 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 119.471 -2.018 . . . . 0.0 107.466 176.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -50.92 -44.56 60.19 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.918 2.087 . . . . 0.0 109.331 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -11.25 47.8 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 124.425 3.284 . . . . 0.0 110.816 173.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -95.91 -19.28 19.67 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.974 -2.329 . . . . 0.0 108.754 168.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -86.36 -33.24 20.6 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 117.318 -3.364 . . . . 0.0 114.273 176.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -67.29 -33.0 74.37 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 126.637 3.113 . . . . 0.0 111.908 173.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 26.1 t-105 -62.99 -51.14 67.99 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 112.782 -2.008 . . . . 0.0 112.682 168.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.64 -16.97 62.87 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 119.116 -2.24 . . . . 0.0 111.717 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 49.2 ttt-85 -84.1 -6.46 59.41 Favored 'General case' 0 N--CA 1.449 -0.523 1 O-C-N 116.083 -4.135 . . . . 0.0 118.628 161.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -76.06 -41.28 51.13 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 119.28 -2.137 . . . . 0.0 113.207 149.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 99.3 t -66.42 -39.66 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 O-C-N 121.189 -0.945 . . . . 0.0 113.413 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -64.78 -39.63 93.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 124.652 2.168 . . . . 0.0 114.674 174.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 63.5 tp -67.38 -40.59 85.73 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 118.878 -2.389 . . . . 0.0 115.117 173.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 39.6 tp -74.14 -41.6 61.29 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.31 1.844 . . . . 0.0 110.293 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -51.79 -57.81 8.24 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 116.199 1.925 . . . . 0.0 116.199 163.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -63.0 -31.74 72.94 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 117.465 -1.255 . . . . 0.0 110.728 -179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.82 -38.0 80.77 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 120.839 1.654 . . . . 0.0 114.726 167.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -72.62 -14.82 61.69 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 130.43 3.492 . . . . 0.0 109.958 170.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . 0.315 47.8 mt-30 -87.48 -14.9 39.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 118.697 -2.502 . . . . 0.0 109.554 176.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . 0.418 ' ND2' HD12 ' D' ' 34' ' ' LEU 0.39 47.2 p30 -128.76 5.46 5.52 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 129.166 2.986 . . . . 0.0 115.911 179.303 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 62.66 25.49 15.15 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 124.439 2.066 . . . . 0.0 112.826 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . 0.418 HD12 ' ND2' ' D' ' 32' ' ' ASN . 44.2 mt -88.37 -8.0 55.76 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 118.279 -2.763 . . . . 0.0 114.927 170.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -49.03 -57.56 6.35 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 127.967 2.507 . . . . 0.0 115.382 -173.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.321 3.1 mt -53.18 -52.87 61.83 Favored Pre-proline 0 N--CA 1.447 -0.582 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 177.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -62.63 -15.27 45.13 Favored 'Trans proline' 0 N--CA 1.446 -1.317 0 C-N-CA 122.322 2.015 . . . . 0.0 113.406 176.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 47.0 tp -77.46 -43.54 32.0 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 125.592 3.814 . . . . 0.0 111.386 164.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . 0.498 HD13 ' CZ2' ' C' ' 19' ' ' TRP . 25.2 mt -57.94 -45.09 87.17 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 125.413 3.733 . . . . 0.0 111.844 171.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -73.03 -23.32 60.58 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 119.572 -0.851 . . . . 0.0 111.831 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 19.2 tp -78.69 -27.6 45.07 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 119.347 -2.095 . . . . 0.0 111.059 170.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 13.2 mmt -89.24 -41.09 12.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 119.602 -1.936 . . . . 0.0 114.444 -174.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt -117.03 147.26 42.49 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 125.847 2.736 . . . . 0.0 112.798 -171.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 30.4 p -74.09 156.27 87.83 Favored Pre-proline 0 N--CA 1.45 -0.443 0 C-N-CA 128.721 2.808 . . . . 0.0 108.675 172.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -44.57 -44.01 13.94 Favored 'Trans proline' 0 N--CA 1.451 -1.024 1 C-N-CA 126.967 5.111 . . . . 0.0 122.168 173.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.265 18.9 m-20 -71.21 -22.44 62.01 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 120.376 3.473 . . . . 0.0 120.376 170.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -75.71 -36.54 59.97 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 126.143 2.152 . . . . 0.0 112.864 164.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 25.5 mtm180 -67.46 -43.7 80.44 Favored 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 126.205 2.191 . . . . 0.0 109.306 171.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -70.01 -35.84 74.66 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -170.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.28 -32.87 73.33 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 174.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . 0.426 ' HA ' HD23 ' D' ' 51' ' ' LEU . 23.9 mt -77.79 -49.12 14.98 Favored 'General case' 0 N--CA 1.45 -0.451 1 O-C-N 115.388 -4.57 . . . . 0.0 114.113 -176.695 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -51.44 -37.25 39.84 Favored Glycine 0 C--N 1.335 0.507 0 CA-C-O 122.637 1.132 . . . . 0.0 113.906 164.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 86.9 m -72.33 -42.27 65.58 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 118.017 -3.049 . . . . 0.0 108.582 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 36.2 mtt180 -55.3 -23.15 21.87 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 121.579 3.918 . . . . 0.0 121.579 170.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 24.4 t -64.48 -33.5 63.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 172.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -89.02 -20.77 23.97 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 172.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . 0.414 HD13 HG21 ' D' ' 57' ' ' ILE . 17.9 mt -54.19 -49.65 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 118.748 -2.47 . . . . 0.0 111.506 158.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . 0.536 HG22 HD12 ' D' ' 82' ' ' ILE . 65.0 t -68.24 -47.57 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 CA-C-O 117.028 -1.463 . . . . 0.0 109.63 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -51.12 -48.32 61.77 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 119.446 3.128 . . . . 0.0 119.446 170.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -65.42 -24.79 67.29 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.074 2.25 . . . . 0.0 117.074 172.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 59.3 mt -68.27 -13.44 62.26 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 121.859 2.118 . . . . 0.0 113.178 168.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 80.0 mt -104.6 -36.49 7.47 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 114.914 -2.47 . . . . 0.0 105.005 -177.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 44.0 ttm105 -81.4 -39.08 25.52 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.643 2.377 . . . . 0.0 113.083 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 53.01 41.67 59.92 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 120.168 2.827 . . . . 0.0 120.168 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -119.62 -1.91 10.55 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 117.806 -3.173 . . . . 0.0 116.231 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 8.5 mmt -129.86 39.51 3.69 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 128.702 2.801 . . . . 0.0 118.105 169.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 26.1 p -81.01 -179.95 7.58 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 110.235 -3.166 . . . . 0.0 117.532 -168.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . 0.518 ' O ' ' HE2' ' D' ' 72' ' ' LYS . 6.0 tp-100 63.05 -105.43 0.16 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 169.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 73.7 ttt180 -63.84 -43.01 97.45 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.331 1.452 . . . . 0.0 110.92 -176.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -86.81 -16.09 37.26 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 116.876 2.176 . . . . 0.0 116.876 -171.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.42 -31.85 58.14 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.652 1.215 . . . . 0.0 109.664 176.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . 0.518 ' HE2' ' O ' ' D' ' 68' ' ' GLN 0.303 38.6 mtmt -72.09 -45.97 58.58 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 114.58 -1.191 . . . . 0.0 113.052 166.255 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -86.49 -25.81 24.94 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 124.299 2.0 . . . . 0.0 115.582 -163.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -122.39 -45.44 2.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 120.775 -1.203 . . . . 0.0 111.695 -171.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -69.46 -42.51 74.79 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.15 -2.844 . . . . 0.0 110.08 166.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.47 -167.22 18.86 Favored Glycine 0 C--N 1.339 0.742 0 CA-C-N 125.694 3.861 . . . . 0.0 122.273 155.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.71 -19.83 64.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.569 -1.548 . . . . 0.0 114.578 -164.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.45 -17.23 5.85 Favored Glycine 0 N--CA 1.446 -0.644 0 O-C-N 119.278 -2.139 . . . . 0.0 118.261 166.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 10.0 tt -52.5 -33.06 17.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 125.752 1.621 . . . . 0.0 108.032 -177.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -86.28 -12.48 49.39 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.736 2.414 . . . . 0.0 111.522 -173.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 21.3 m -79.75 -25.06 41.17 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 124.999 2.333 . . . . 0.0 114.004 165.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . 0.536 HD12 HG22 ' D' ' 58' ' ' VAL . 26.1 mm -100.11 -31.45 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 C-N-CA 130.219 3.408 . . . . 0.0 115.215 -163.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 81.6 p -117.21 -2.73 11.58 Favored 'General case' 0 N--CA 1.448 -0.572 0 O-C-N 126.348 2.28 . . . . 0.0 114.776 174.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . 0.354 28.5 mtp85 -121.29 175.1 6.31 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 122.447 1.118 . . . . 0.0 112.872 167.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.99 160.96 27.67 Favored Glycine 0 N--CA 1.445 -0.706 0 O-C-N 118.054 -2.904 . . . . 0.0 114.165 -155.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 77.5 p -71.62 -42.01 68.17 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 118.759 -2.613 . . . . 0.0 112.968 -147.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -118.75 63.92 0.77 Allowed 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 128.476 2.71 . . . . 0.0 106.652 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . 0.266 3.1 p -73.46 -175.46 1.97 Allowed 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 117.424 2.379 . . . . 0.0 117.424 173.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.27 5.5 tp -54.76 -32.95 60.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 113.187 -3.292 . . . . 0.0 111.446 162.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -72.44 -2.14 18.36 Favored 'General case' 0 N--CA 1.451 -0.424 0 O-C-N 127.005 2.691 . . . . 0.0 114.03 174.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -124.28 -23.72 4.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 116.359 -1.781 . . . . 0.0 113.76 -171.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . 0.292 . . 63.3 94.37 0.05 OUTLIER Pre-proline 0 N--CA 1.447 -0.576 0 CA-C-N 121.671 2.032 . . . . 0.0 112.226 148.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.324 32.1 Cg_exo 33.81 32.71 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 129.216 0.923 . . . . 0.0 114.351 36.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 88.0 t -56.51 -17.74 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.698 0 C-N-CA 127.988 2.515 . . . . 0.0 110.022 176.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.285 0.1 OUTLIER -92.31 -49.36 6.2 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 117.984 -2.948 . . . . 0.0 112.899 -173.739 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . 0.422 HD21 HD22 ' C' ' 41' ' ' LEU . 54.2 tp -38.38 -53.16 1.53 Allowed 'General case' 0 N--CA 1.448 -0.548 0 O-C-N 128.138 3.399 . . . . 0.0 109.531 150.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 31.7 ttp180 -65.87 -50.99 62.55 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 122.977 1.37 . . . . 0.0 111.856 -167.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -51.99 -28.05 15.55 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.137 -1.392 . . . . 0.0 113.726 170.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 45.6 t90 -85.61 -43.51 13.41 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -177.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.52 -38.86 69.79 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 125.614 1.821 . . . . 0.0 108.974 166.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -72.67 -14.82 61.67 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.873 1.321 . . . . 0.0 112.826 -177.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -94.2 -46.05 7.25 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 118.983 -2.323 . . . . 0.0 111.724 169.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 97.7 t -68.0 -27.92 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 O-C-N 119.345 -2.097 . . . . 0.0 113.869 177.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 82.6 mt -108.78 -18.87 13.6 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 122.055 2.207 . . . . 0.0 114.369 -171.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 4.6 mp -105.96 23.81 13.38 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 118.094 -2.879 . . . . 0.0 108.506 168.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 16.8 pttp -61.19 169.13 2.23 Favored 'General case' 0 N--CA 1.448 -0.534 1 C-N-CA 132.419 4.288 . . . . 0.0 113.342 -172.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 45.5 m -49.73 -45.56 49.4 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 110.654 -2.975 . . . . 0.0 114.557 -170.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 113.362 -3.208 . . . . 0.0 116.089 177.354 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.656 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -49.79 -46.09 50.48 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 120.585 -1.322 . . . . 0.0 113.92 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -74.67 -14.58 60.76 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 -175.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 17.7 mp0 -107.44 1.66 23.71 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.588 2.755 . . . . 0.0 111.703 178.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 29.2 m -132.61 103.54 13.43 Favored Pre-proline 0 N--CA 1.447 -0.583 0 O-C-N 116.993 -3.567 . . . . 0.0 110.4 -174.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -56.13 -25.44 54.95 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 N-CA-C 120.388 3.188 . . . . 0.0 120.388 158.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -131.65 135.28 46.79 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 119.176 -2.203 . . . . 0.0 112.035 -167.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.3 t -149.09 138.8 21.86 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 104.727 -2.323 . . . . 0.0 104.727 158.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.24 -20.41 41.84 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 112.186 -3.769 . . . . 0.0 113.477 169.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -90.36 -20.18 23.14 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 122.457 2.389 . . . . 0.0 110.165 -174.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . 0.253 16.5 tpt -84.72 -43.09 14.63 Favored 'General case' 0 N--CA 1.45 -0.434 1 O-C-N 115.739 -4.35 . . . . 0.0 106.509 176.604 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.6 -27.93 65.11 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 111.933 -3.889 . . . . 0.0 112.391 166.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -73.64 -38.75 64.91 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 126.517 2.386 . . . . 0.0 111.116 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -59.98 -42.14 93.52 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 127.163 2.79 . . . . 0.0 111.147 171.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -68.65 -34.39 75.64 Favored 'General case' 0 N--CA 1.448 -0.555 1 O-C-N 115.75 -4.344 . . . . 0.0 114.096 170.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 36.6 t60 -64.86 -32.58 74.35 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 121.993 2.179 . . . . 0.0 114.6 171.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -67.36 -35.72 79.93 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 174.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -75.28 -30.08 60.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.262 -2.149 . . . . 0.0 109.104 -175.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -76.45 -40.52 50.27 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 119.707 1.139 . . . . 0.0 111.096 172.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 20' ' ' LEU . 51.3 mt -71.96 -15.81 62.08 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.476 -1.39 . . . . 0.0 109.68 -171.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.2 ttt180 -54.03 -57.39 11.23 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 120.162 -1.586 . . . . 0.0 113.582 167.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.591 ' CE1' HD22 ' A' ' 26' ' ' LEU . 77.5 t80 -49.89 -35.15 22.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 120.41 1.459 . . . . 0.0 114.427 168.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.0 t -67.42 -51.83 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 O-C-N 121.225 -0.922 . . . . 0.0 112.533 -175.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -71.46 -23.72 61.88 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 125.435 2.541 . . . . 0.0 110.787 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.0 tp -75.13 -43.58 51.83 Favored 'General case' 0 N--CA 1.451 -0.41 1 O-C-N 114.244 -5.285 . . . . 0.0 108.307 173.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.591 HD22 ' CE1' ' A' ' 22' ' ' PHE . 20.9 tp -64.66 -31.03 72.07 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 116.639 -1.648 . . . . 0.0 110.103 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -57.01 -58.07 9.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 127.599 3.062 . . . . 0.0 109.13 173.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -60.57 -37.79 82.45 Favored 'General case' 0 N--CA 1.447 -0.575 0 O-C-N 117.496 -3.253 . . . . 0.0 108.432 175.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.87 -41.31 83.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 117.716 -3.115 . . . . 0.0 113.569 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.487 ' CE1' ' HB2' ' B' ' 27' ' ' LYS . 16.9 m-85 -61.44 -35.99 79.13 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 124.708 3.413 . . . . 0.0 112.186 172.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . 0.316 84.6 mt-30 -62.78 -16.65 58.93 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 119.448 -2.033 . . . . 0.0 115.139 173.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -124.38 18.84 8.95 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 127.627 2.371 . . . . 0.0 116.52 -176.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 41.32 33.24 0.25 Allowed 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 116.768 2.136 . . . . 0.0 116.768 -165.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.1 mt -91.11 -5.8 54.6 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.577 2.751 . . . . 0.0 114.005 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -68.54 -41.42 79.86 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 113.405 -3.188 . . . . 0.0 113.923 -167.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 36' ' ' LEU 0.28 39.9 mt -61.9 -50.77 79.65 Favored Pre-proline 0 N--CA 1.448 -0.542 0 O-C-N 126.3 2.25 . . . . 0.0 112.593 165.285 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . 0.261 84.8 Cg_exo -51.25 -39.73 61.91 Favored 'Trans proline' 0 N--CA 1.451 -1.004 1 C-N-CA 127.94 5.76 . . . . 0.0 113.256 174.811 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.4 tp -81.39 -36.23 29.79 Favored 'General case' 0 N--CA 1.449 -0.522 1 O-C-N 115.153 -4.717 . . . . 0.0 111.643 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 36.9 mt -74.5 -30.54 61.85 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 126.14 1.776 . . . . 0.0 115.517 -177.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -66.75 -30.05 70.17 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 125.972 2.045 . . . . 0.0 113.625 163.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tt -69.72 -48.15 60.59 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 127.614 2.366 . . . . 0.0 111.019 173.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 80.4 mmm -91.44 -11.42 37.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 118.124 -2.86 . . . . 0.0 115.243 -162.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.8 mt -130.34 136.62 49.3 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 128.04 2.536 . . . . 0.0 110.714 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.2 p -94.49 157.97 36.36 Favored Pre-proline 0 N--CA 1.448 -0.555 0 O-C-N 119.154 -2.216 . . . . 0.0 112.393 176.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -47.89 -39.79 32.12 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.566 2.177 . . . . 0.0 116.135 -169.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . 0.288 5.3 p-10 -72.77 -18.89 61.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 129.121 2.968 . . . . 0.0 112.528 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -97.01 -32.53 11.95 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.884 1.274 . . . . 0.0 108.356 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.2 mtm-85 -69.54 -44.37 71.1 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 119.919 -1.738 . . . . 0.0 112.763 173.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -68.82 -14.56 63.1 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-O 112.043 -3.837 . . . . 0.0 112.158 166.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.45 -46.99 62.76 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 123.553 2.888 . . . . 0.0 113.035 164.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 12.1 mt -70.06 -42.2 73.16 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 118.834 -2.416 . . . . 0.0 110.551 -173.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.26 -42.58 82.89 Favored Glycine 0 C--N 1.333 0.405 0 O-C-N 117.113 -3.492 . . . . 0.0 114.484 167.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.5 m -68.82 -33.15 73.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 124.064 1.887 . . . . 0.0 112.861 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.21 -24.12 67.04 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 116.746 2.128 . . . . 0.0 116.746 178.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.332 5.0 t -61.99 -39.6 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-O 117.171 -1.395 . . . . 0.0 108.138 172.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -70.53 -31.79 69.0 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 121.257 1.844 . . . . 0.0 113.687 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 95.3 mt -64.14 -48.92 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 117.126 -1.416 . . . . 0.0 107.895 176.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 45.1 t -61.89 -41.56 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-O 115.776 -2.059 . . . . 0.0 112.637 170.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -58.4 -53.2 61.02 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 123.372 2.806 . . . . 0.0 112.023 174.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -67.15 -26.4 66.65 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 116.014 1.857 . . . . 0.0 116.014 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.316 76.6 mt -81.93 -35.87 28.66 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 129.101 2.96 . . . . 0.0 112.151 173.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 tp -72.12 -45.75 59.33 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-O 114.418 -2.706 . . . . 0.0 113.292 171.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -53.24 -55.66 22.69 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 120.61 1.55 . . . . 0.0 110.375 163.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.81 -0.8 89.39 Favored Glycine 0 C--N 1.333 0.391 0 CA-C-O 116.561 -2.244 . . . . 0.0 114.503 171.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -75.39 -4.92 42.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 120.437 3.495 . . . . 0.0 120.437 -176.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 94.6 mtp -106.2 155.83 19.07 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 129.252 3.021 . . . . 0.0 113.901 167.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 60.4 p -83.63 156.67 22.58 Favored 'General case' 0 N--CA 1.447 -0.615 0 O-C-N 124.476 1.11 . . . . 0.0 112.647 164.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -42.82 -39.8 2.64 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 120.573 -1.33 . . . . 0.0 111.429 166.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.8 tpt85 -79.77 -23.49 42.17 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 115.656 -2.116 . . . . 0.0 110.96 -175.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -76.12 -31.93 58.91 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 121.954 2.161 . . . . 0.0 112.99 168.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.8 mt -68.14 -31.39 70.94 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 124.39 2.043 . . . . 0.0 114.863 175.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -50.94 -54.39 24.66 Favored 'General case' 0 N--CA 1.449 -0.516 0 O-C-N 117.55 -3.219 . . . . 0.0 108.83 174.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 48.6 m-20 -59.2 -38.04 78.91 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 113.923 1.082 . . . . 0.0 113.923 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -70.56 -32.6 70.08 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 119.448 -2.033 . . . . 0.0 110.307 -177.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 74.3 mt -119.44 -26.45 5.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 116.57 2.063 . . . . 0.0 116.57 -156.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 81.77 -28.29 3.21 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 120.469 2.948 . . . . 0.0 120.469 174.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -77.6 163.83 25.89 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 120.226 -1.749 . . . . 0.0 110.058 -173.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.28 140.85 34.59 Favored Glycine 0 C--N 1.339 0.702 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -177.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . 0.346 89.1 mt -53.07 -27.38 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-O 116.104 -1.903 . . . . 0.0 111.757 -178.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -52.42 -36.15 53.7 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 120.163 1.347 . . . . 0.0 111.064 175.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 56.5 p -80.9 -23.88 38.66 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 119.614 -1.929 . . . . 0.0 110.922 -173.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 50.0 mm -78.81 -42.5 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 C-N-CA 127.529 2.332 . . . . 0.0 108.999 175.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.4 m -67.89 -33.95 75.71 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.837 1.255 . . . . 0.0 108.477 177.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.1 ttt180 -61.55 -46.65 89.0 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 121.796 -0.565 . . . . 0.0 110.762 172.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.28 -26.82 74.27 Favored Glycine 0 C--N 1.334 0.426 0 CA-C-O 117.065 -1.964 . . . . 0.0 113.487 175.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 58.1 m -63.54 -40.29 96.62 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.261 1.825 . . . . 0.0 110.789 174.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -68.88 -43.86 74.44 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 116.988 -1.482 . . . . 0.0 113.96 169.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.0 m -63.26 -25.87 68.52 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 127.21 2.204 . . . . 0.0 106.666 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.0 tp -85.44 -32.35 22.35 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 117.117 -3.489 . . . . 0.0 115.901 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -78.28 -38.0 43.61 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 126.875 2.07 . . . . 0.0 109.069 -173.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.56 -13.03 60.34 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 129.743 3.217 . . . . 0.0 116.132 167.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.82 126.72 92.25 Favored Pre-proline 0 N--CA 1.449 -0.48 0 C-N-CA 131.088 3.755 . . . . 0.0 107.771 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -59.93 152.48 64.12 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 O-C-N 128.209 3.742 . . . . 0.0 115.298 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -34.88 67.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 CA-C-O 116.395 -1.764 . . . . 0.0 111.086 -173.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 95' ' ' GLU . 8.6 pm0 -71.83 -18.07 62.1 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 122.174 2.261 . . . . 0.0 111.896 -178.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 13.6 tp -85.52 -36.35 20.56 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 58.2 mtm-85 -82.41 -35.06 28.0 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 117.545 -3.222 . . . . 0.0 115.934 -171.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -69.58 -6.06 28.59 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.095 1.758 . . . . 0.0 114.148 165.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 40.3 t90 -98.97 -48.34 4.92 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 117.996 2.591 . . . . 0.0 117.996 166.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 36.0 mt -61.59 -32.7 72.82 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 120.015 -1.678 . . . . 0.0 111.589 177.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -61.93 -22.63 65.76 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 122.608 2.458 . . . . 0.0 115.992 172.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -93.9 -7.7 42.34 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 118.799 -2.438 . . . . 0.0 113.381 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 54.1 t -118.95 -25.36 2.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 O-C-N 127.456 2.972 . . . . 0.0 113.905 -175.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 68.5 mt -103.57 -39.34 6.76 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 118.587 -2.571 . . . . 0.0 116.308 167.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.2 mt -88.57 -33.61 17.64 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 119.84 -1.787 . . . . 0.0 115.318 -175.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -66.77 -9.96 42.34 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.448 -1.263 . . . . 0.0 113.73 -166.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 70.5 p -71.54 -24.01 61.87 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 118.703 2.853 . . . . 0.0 118.703 166.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . 0.357 1.4 m-20 . . . . . 0 C--O 1.248 1.018 0 O-C-N 119.217 -2.177 . . . . 0.0 109.537 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.1 -46.52 80.73 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 118.048 -2.907 . . . . 0.0 112.282 -165.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -76.32 7.6 4.18 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 113.57 -1.65 . . . . 0.0 111.035 176.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 61.7 tp60 -122.28 -48.08 2.1 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 117.425 -3.297 . . . . 0.0 109.865 -171.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 40.6 m -81.57 135.41 49.67 Favored Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-O 117.14 -1.409 . . . . 0.0 111.493 -170.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -55.39 -30.43 72.97 Favored 'Trans proline' 0 N--CA 1.448 -1.185 0 C-N-CA 123.349 2.699 . . . . 0.0 113.394 -178.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -109.06 133.35 53.11 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 118.136 -2.853 . . . . 0.0 112.231 164.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 5.2 t -134.2 144.09 48.25 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.602 1.334 . . . . 0.0 114.602 161.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.18 -30.14 67.2 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 119.438 -2.038 . . . . 0.0 112.147 165.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . 0.307 . . -61.42 -49.32 77.32 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 126.275 1.83 . . . . 0.0 108.96 170.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 16.5 mmt -74.85 -28.22 60.58 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -174.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.19 75.05 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 116.389 1.996 . . . . 0.0 116.389 168.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.8 -39.52 66.62 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.787 2.835 . . . . 0.0 114.537 165.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 8.9 tp60 -57.47 -44.03 84.52 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 119.938 -1.726 . . . . 0.0 112.313 171.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 51.7 mmt-85 -74.42 -29.0 61.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 120.926 1.694 . . . . 0.0 112.336 -174.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -75.27 -39.64 59.57 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 117.991 -2.943 . . . . 0.0 113.943 170.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -64.72 -38.81 92.27 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 129.216 3.006 . . . . 0.0 109.384 169.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -70.19 -36.67 74.78 Favored 'General case' 0 N--CA 1.451 -0.397 0 O-C-N 119.108 -2.245 . . . . 0.0 111.591 178.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 6.5 t-105 -63.65 -50.15 70.42 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 116.567 -1.683 . . . . 0.0 109.105 170.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 82.6 mt -64.66 -14.2 57.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 122.131 2.241 . . . . 0.0 113.525 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 64.5 ttt180 -56.41 -54.17 48.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 128.56 2.744 . . . . 0.0 108.33 171.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -65.39 -52.24 54.91 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 123.528 0.731 . . . . 0.0 111.692 -178.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . 0.256 4.2 t -44.19 -48.98 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 126.221 1.808 . . . . 0.0 111.642 178.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -73.44 -41.8 62.77 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 128.448 3.592 . . . . 0.0 109.282 -171.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 33.8 tp -64.53 -43.7 93.17 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.37 176.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 41.1 tp -65.02 -32.88 74.82 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 120.694 -1.254 . . . . 0.0 114.008 171.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.487 ' HB2' ' CE1' ' A' ' 30' ' ' TYR . 57.7 tttt -64.14 -41.48 97.18 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.486 -2.009 . . . . 0.0 112.43 171.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -58.35 -39.15 78.75 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 123.015 2.643 . . . . 0.0 112.811 166.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.8 -33.4 62.22 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.539 -1.35 . . . . 0.0 113.281 -176.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -54.75 -47.7 73.54 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.94 2.096 . . . . 0.0 112.732 169.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -70.77 -6.31 36.65 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.286 1.834 . . . . 0.0 114.426 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -119.86 23.64 10.97 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.556 1.942 . . . . 0.0 113.004 170.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 34.79 48.18 0.3 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 128.372 2.669 . . . . 0.0 110.277 -173.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 33.9 mt -121.63 16.61 11.16 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 114.445 -1.252 . . . . 0.0 113.098 174.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -71.8 -37.95 70.31 Favored 'General case' 0 N--CA 1.452 -0.357 1 O-C-N 115.444 -4.535 . . . . 0.0 111.144 -176.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 43.0 tp -62.13 -55.75 37.71 Favored Pre-proline 0 N--CA 1.449 -0.518 0 CA-C-O 114.587 -2.625 . . . . 0.0 111.454 177.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -65.23 -20.52 62.51 Favored 'Trans proline' 0 N--CA 1.45 -1.05 0 CA-C-N 122.707 2.002 . . . . 0.0 111.696 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 27.7 tp -79.1 -32.85 44.76 Favored 'General case' 0 N--CA 1.451 -0.417 1 CA-C-O 111.56 -4.067 . . . . 0.0 113.047 172.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 59.1 mt -71.08 -32.87 69.64 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 125.603 1.814 . . . . 0.0 107.756 173.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -80.31 -10.2 59.75 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 117.38 2.363 . . . . 0.0 117.38 176.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.3 tp -91.58 -33.42 15.14 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 118.097 -2.877 . . . . 0.0 111.31 160.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 16.2 mmt -85.0 -18.18 35.24 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 128.548 3.655 . . . . 0.0 116.226 -175.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 6.2 mp -126.97 147.77 50.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.21 1.804 . . . . 0.0 112.312 176.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 18.5 p -75.82 165.52 52.63 Favored Pre-proline 0 N--CA 1.448 -0.549 0 CA-C-O 112.305 -3.712 . . . . 0.0 116.44 176.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -58.65 -14.57 22.07 Favored 'Trans proline' 0 N--CA 1.45 -1.042 0 O-C-N 126.371 2.774 . . . . 0.0 116.385 174.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -90.19 -46.37 8.48 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 126.195 1.798 . . . . 0.0 113.218 175.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -67.43 -26.59 66.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 117.115 -1.421 . . . . 0.0 114.448 -178.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 92.8 mtm-85 -60.12 -42.55 94.99 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 125.656 1.848 . . . . 0.0 110.81 172.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -65.35 -27.75 68.8 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 112.141 -2.3 . . . . 0.0 116.148 175.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -84.5 -45.97 12.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 118.256 -2.778 . . . . 0.0 110.748 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.99 -34.22 77.28 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 119.511 -1.993 . . . . 0.0 110.176 -179.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.79 -23.78 72.59 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 118.361 2.104 . . . . 0.0 118.361 170.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 74.7 m -87.9 -25.6 23.16 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.799 2.04 . . . . 0.0 112.803 174.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 42.4 mtt180 -64.5 -24.99 67.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 117.711 2.485 . . . . 0.0 117.711 161.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.02 -41.97 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 120.179 1.354 . . . . 0.0 107.671 175.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 -59.61 -43.84 93.64 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 112.897 -3.43 . . . . 0.0 110.502 176.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 56.5 mt -61.57 -47.76 91.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 123.116 2.689 . . . . 0.0 107.129 -177.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.298 69.2 t -62.18 -33.31 58.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 120.156 1.344 . . . . 0.0 111.766 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -69.45 -43.23 73.7 Favored 'General case' 0 N--CA 1.448 -0.57 0 O-C-N 118.654 -2.529 . . . . 0.0 113.176 173.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -72.4 -36.82 68.74 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 119.417 -2.052 . . . . 0.0 114.118 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 12.7 mt -52.18 -28.06 16.79 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.352 0.596 . . . . 0.0 112.568 165.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 23.4 mt -92.18 -21.94 20.1 Favored 'General case' 0 N--CA 1.445 -0.705 0 O-C-N 117.831 -3.043 . . . . 0.0 118.381 174.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . 0.429 HH21 ' CG ' ' B' ' 108' ' ' ASP . 5.1 ttm105 -88.89 -43.58 11.08 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.833 2.053 . . . . 0.0 105.516 -166.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.99 49.95 31.74 Favored Glycine 0 CA--C 1.524 0.632 0 CA-C-O 117.422 -1.765 . . . . 0.0 116.294 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -116.75 -36.13 3.98 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 119.811 1.805 . . . . 0.0 108.746 -177.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 27.0 mtt -73.33 139.56 46.13 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 126.357 2.98 . . . . 0.0 111.43 -175.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -81.79 170.65 15.46 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 118.973 -2.329 . . . . 0.0 109.438 163.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -59.97 -17.43 38.1 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 117.135 -3.478 . . . . 0.0 110.446 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 48.1 ttt-85 -82.04 -48.39 11.47 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.676 2.39 . . . . 0.0 106.94 -173.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -71.24 -49.28 44.94 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 114.157 -2.83 . . . . 0.0 112.162 178.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 83.0 mt -47.66 -43.27 26.1 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 121.296 1.862 . . . . 0.0 109.279 173.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -61.14 -20.11 62.31 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 119.271 -2.143 . . . . 0.0 113.229 178.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -118.21 -54.22 2.31 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 124.907 3.503 . . . . 0.0 116.785 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.03 -24.56 64.61 Favored 'General case' 0 N--CA 1.446 -0.653 1 C-N-CA 132.142 4.177 . . . . 0.0 113.371 -177.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 60.0 mt -131.28 -3.96 3.86 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 113.274 -1.784 . . . . 0.0 113.258 172.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.9 21.28 67.45 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 126.558 2.028 . . . . 0.0 116.603 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -108.55 110.85 22.43 Favored 'General case' 0 N--CA 1.447 -0.625 0 O-C-N 118.608 -2.701 . . . . 0.0 108.959 -163.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.19 176.53 48.7 Favored Glycine 0 CA--C 1.523 0.565 0 O-C-N 118.811 -2.431 . . . . 0.0 117.289 168.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 14.4 mm -53.51 -48.32 58.44 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.725 0 CA-C-O 117.751 -1.118 . . . . 0.0 111.869 -166.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.82 -33.98 69.18 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 122.059 2.209 . . . . 0.0 112.977 -177.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 54.1 m -75.93 -48.52 20.9 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.38 3.072 . . . . 0.0 111.213 179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 18.9 mm -53.96 -35.94 29.65 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 O-C-N 118.366 -2.709 . . . . 0.0 108.385 167.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 5.3 m -75.64 -27.61 58.46 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 117.17 -1.395 . . . . 0.0 112.917 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -63.69 -48.89 75.31 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 122.7 2.5 . . . . 0.0 110.321 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -76.94 -32.07 50.89 Favored Glycine 0 CA--C 1.525 0.682 0 CA-C-O 118.132 -1.371 . . . . 0.0 112.701 -167.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 89.1 p -68.46 -40.58 81.01 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -61.45 -41.46 97.24 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 118.826 -2.421 . . . . 0.0 110.185 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.6 m -77.94 -24.69 48.12 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 112.391 -3.671 . . . . 0.0 110.127 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.57 -36.66 44.22 Favored 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 127.113 2.758 . . . . 0.0 116.917 170.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -60.71 -45.44 94.22 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 125.26 2.457 . . . . 0.0 111.46 169.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . 0.31 . . -71.2 -17.21 62.53 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 118.222 -2.799 . . . . 0.0 117.62 173.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' B' ' 93' ' ' PRO . . . -72.56 160.17 83.49 Favored Pre-proline 0 N--CA 1.45 -0.451 0 O-C-N 119.906 -1.746 . . . . 0.0 112.548 172.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' B' ' 92' ' ' ALA . 86.0 Cg_exo -67.32 155.75 69.17 Favored 'Trans proline' 0 N--CA 1.447 -1.222 1 C-N-CA 127.942 5.761 . . . . 0.0 118.436 175.165 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.277 12.9 m -65.81 -36.3 77.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 119.262 0.937 . . . . 0.0 113.452 -177.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.332 7.8 pm0 -59.57 -27.75 66.52 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 116.683 2.105 . . . . 0.0 116.683 -177.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 24.7 tp -83.16 -46.6 12.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.569 1.548 . . . . 0.0 109.41 176.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 64.8 mtp85 -57.47 -27.3 62.37 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 175.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -99.32 -8.75 24.47 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 174.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -75.01 -62.59 1.5 Allowed 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 127.968 2.507 . . . . 0.0 105.78 168.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 83.2 mt -57.77 -31.74 66.81 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 131.391 3.876 . . . . 0.0 109.029 -169.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -69.62 -43.13 73.34 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 124.267 3.212 . . . . 0.0 111.326 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -71.85 -48.15 48.08 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 124.871 2.272 . . . . 0.0 108.565 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 65.2 t -60.31 -50.03 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 113.481 -1.691 . . . . 0.0 111.455 -170.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 13.5 mt -76.16 -54.56 6.63 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 127.862 3.696 . . . . 0.0 115.399 176.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 60.6 mt -76.6 -36.6 57.42 Favored 'General case' 0 N--CA 1.45 -0.44 1 O-C-N 114.431 -5.168 . . . . 0.0 116.907 -165.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -80.19 -5.88 56.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 112.518 -3.611 . . . . 0.0 108.408 177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 70.6 m -105.73 -10.25 16.85 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 128.398 2.679 . . . . 0.0 109.701 -178.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . 0.429 ' CG ' HH21 ' B' ' 63' ' ' ARG . 9.8 t70 . . . . . 0 C--O 1.25 1.11 0 C-N-CA 129.834 3.253 . . . . 0.0 115.346 -173.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 15.7 mtt . . . . . 0 N--CA 1.472 0.639 0 CA-C-O 123.816 1.769 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.42 147.4 30.99 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 112.587 -2.097 . . . . 0.0 114.747 -178.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -140.67 156.91 46.11 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 127.854 2.461 . . . . 0.0 113.204 165.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -122.21 164.8 17.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.995 1.718 . . . . 0.0 108.885 175.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 42.9 p -127.99 153.97 78.38 Favored Pre-proline 0 N--CA 1.451 -0.398 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 -179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.94 -38.21 93.07 Favored 'Trans proline' 0 N--CA 1.447 -1.261 0 O-C-N 125.69 2.416 . . . . 0.0 116.976 172.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -149.82 148.59 29.36 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 124.72 2.2 . . . . 0.0 110.605 175.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 20.1 t -145.46 133.79 21.78 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 118.286 -2.759 . . . . 0.0 114.556 170.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.64 -26.43 59.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 112.95 -3.405 . . . . 0.0 107.806 175.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.33 -34.63 78.77 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 125.853 3.933 . . . . 0.0 110.044 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 18.4 mtt -82.32 -34.48 28.55 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 125.338 1.649 . . . . 0.0 114.84 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.62 -38.82 82.36 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 125.576 1.551 . . . . 0.0 114.337 164.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -67.29 -33.13 74.65 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.619 1.568 . . . . 0.0 112.659 167.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -59.08 -40.98 86.93 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 119.206 -2.184 . . . . 0.0 111.46 167.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -21.52 65.1 Favored 'General case' 0 N--CA 1.449 -0.506 1 O-C-N 114.635 -5.041 . . . . 0.0 117.792 169.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -76.82 -46.56 24.4 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 120.888 -1.132 . . . . 0.0 113.205 177.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -53.92 -23.15 11.91 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 119.191 3.034 . . . . 0.0 119.191 159.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -81.75 -45.13 16.08 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 127.329 2.251 . . . . 0.0 106.375 171.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 23.8 t-105 -66.9 -37.11 83.75 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 118.072 -2.893 . . . . 0.0 112.406 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' C' ' 20' ' ' LEU . 1.9 mp -73.03 -27.6 61.86 Favored 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 127.11 2.756 . . . . 0.0 111.281 -176.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 27.1 ttt180 -75.38 -35.23 61.12 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 119.33 -2.106 . . . . 0.0 113.151 172.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -61.06 -42.38 98.38 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 169.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . 0.368 76.0 t -54.81 -61.99 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 CA-C-O 117.097 -1.43 . . . . 0.0 108.921 167.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -53.24 -43.35 67.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 117.834 2.531 . . . . 0.0 117.834 178.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 60.9 tp -45.17 -55.07 6.11 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 127.721 2.408 . . . . 0.0 112.268 176.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 25.6 tp -67.25 -27.01 66.86 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 119.641 -1.912 . . . . 0.0 114.825 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -56.43 -50.56 71.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 119.398 -2.064 . . . . 0.0 110.302 166.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -68.65 -8.73 44.94 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 119.821 -1.799 . . . . 0.0 112.086 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -97.17 -20.77 17.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 -178.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -76.0 -22.89 55.34 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-O 125.796 2.712 . . . . 0.0 115.123 164.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . 0.305 45.7 tt0 -62.07 -16.37 51.66 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 129.598 3.159 . . . . 0.0 116.582 169.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -147.24 6.01 0.85 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 116.954 2.205 . . . . 0.0 116.954 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.263 3.6 m-20 59.16 29.98 19.65 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 118.228 2.677 . . . . 0.0 118.228 -173.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 96.9 mt -82.31 7.52 13.72 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 118.679 -2.513 . . . . 0.0 114.536 162.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 7.0 p-80 -59.33 -44.99 92.56 Favored 'General case' 0 N--CA 1.449 -0.525 0 N-CA-C 119.121 3.008 . . . . 0.0 119.121 173.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . 0.323 6.5 mt -60.25 -55.44 45.29 Favored Pre-proline 0 N--CA 1.452 -0.352 0 O-C-N 125.085 1.491 . . . . 0.0 110.312 175.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -54.35 -50.62 12.86 Favored 'Trans proline' 0 N--CA 1.445 -1.329 0 C-N-CA 123.488 2.792 . . . . 0.0 113.12 174.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 56.6 tp -55.4 -30.53 60.58 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 173.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . 0.387 15.3 mt -94.92 -18.48 21.08 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 122.496 2.407 . . . . 0.0 114.187 177.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -67.24 -26.18 66.46 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 117.596 -1.192 . . . . 0.0 111.635 161.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 19.9 tp -77.5 -52.54 8.9 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 127.638 2.375 . . . . 0.0 114.708 170.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 49.2 mmm -78.72 -15.8 58.01 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 117.117 -1.421 . . . . 0.0 113.752 -164.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 7.8 mp -121.29 144.45 48.62 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 130.669 3.588 . . . . 0.0 113.523 -175.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 55.7 p -75.42 157.13 84.94 Favored Pre-proline 0 N--CA 1.444 -0.74 0 CA-C-N 122.26 2.3 . . . . 0.0 113.356 164.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -57.88 -34.1 97.88 Favored 'Trans proline' 0 N--CA 1.447 -1.214 0 CA-C-N 121.52 1.578 . . . . 0.0 110.872 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.74 -41.18 94.84 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.868 172.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -67.83 -31.49 71.38 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.652 1.181 . . . . 0.0 112.309 176.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . 0.433 ' HD2' ' CE2' ' D' ' 19' ' ' TRP . 85.8 mtm-85 -69.75 -44.08 70.94 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.067 2.147 . . . . 0.0 110.888 175.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . 0.254 40.5 tt0 -68.89 -22.65 64.17 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 127.967 2.507 . . . . 0.0 114.34 168.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.51 -28.76 64.13 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 121.62 2.009 . . . . 0.0 110.704 173.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 57.2 mt -74.75 -46.11 39.47 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 118.424 2.75 . . . . 0.0 118.424 177.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.49 -43.8 36.26 Favored Glycine 0 CA--C 1.526 0.766 0 O-C-N 126.482 2.364 . . . . 0.0 110.532 169.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 99.6 m -59.59 -55.92 28.45 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 126.576 1.95 . . . . 0.0 109.958 178.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -57.69 -42.03 82.86 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 115.5 -2.19 . . . . 0.0 113.504 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 50.2 t -58.59 -36.02 57.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 CA-C-N 124.464 3.302 . . . . 0.0 114.671 178.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -80.82 -30.91 35.73 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 113.536 -1.666 . . . . 0.0 110.788 178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . 0.417 HG12 ' HG ' ' C' ' 75' ' ' LEU 0.325 7.9 mt -60.16 -51.67 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 1 O-C-N 115.6 -4.438 . . . . 0.0 110.755 165.039 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . 0.267 62.5 t -49.08 -55.81 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 C-N-CA 125.488 1.515 . . . . 0.0 113.484 174.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -49.05 -45.71 43.31 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.338 1.855 . . . . 0.0 114.672 174.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . 0.265 29.9 mm-40 -78.83 -11.01 59.98 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 123.179 1.466 . . . . 0.0 114.882 -174.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 46.2 mt -101.53 -4.5 26.63 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 115.21 -2.329 . . . . 0.0 108.847 168.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.53 -39.95 11.08 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 114.362 -2.732 . . . . 0.0 113.222 166.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 7.9 ttm105 -67.38 -31.62 71.98 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 126.139 2.15 . . . . 0.0 113.664 167.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.84 17.23 73.12 Favored Glycine 0 N--CA 1.445 -0.764 0 CA-C-N 113.71 -1.587 . . . . 0.0 116.746 171.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -97.94 -2.02 41.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 121.644 2.722 . . . . 0.0 112.03 -160.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 19.1 mmt -79.38 136.7 37.05 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 124.851 1.344 . . . . 0.0 108.547 -177.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 65.7 p -90.33 174.8 7.38 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 129.274 3.029 . . . . 0.0 113.001 166.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -57.93 -40.49 80.56 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -173.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 39.0 ttp-105 -57.17 -46.25 82.97 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 126.155 1.782 . . . . 0.0 109.417 173.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -80.42 -22.29 41.34 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 119.724 -1.86 . . . . 0.0 111.279 -170.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 16.3 mt -73.25 -21.14 60.69 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.038 -2.914 . . . . 0.0 110.799 172.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -89.06 -54.64 4.02 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.894 -2.379 . . . . 0.0 112.382 171.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -72.55 -49.04 35.32 Favored 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 125.191 1.557 . . . . 0.0 111.835 -172.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -73.31 -38.87 65.69 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 115.909 -1.996 . . . . 0.0 115.993 177.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . 0.417 ' HG ' HG12 ' C' ' 57' ' ' ILE . 8.0 mp -97.0 -30.86 12.83 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 120.77 3.618 . . . . 0.0 120.77 -171.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 62.18 -160.37 31.38 Favored Glycine 0 C--N 1.337 0.608 0 CA-C-O 124.021 1.901 . . . . 0.0 114.844 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -74.84 -21.58 59.18 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 116.998 2.221 . . . . 0.0 116.998 -175.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.53 -12.71 9.83 Favored Glycine 0 CA--C 1.522 0.531 0 C-N-CA 128.858 3.123 . . . . 0.0 117.204 173.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 16.8 tt -54.11 -38.09 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 161.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.86 -46.35 89.58 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 113.915 -2.945 . . . . 0.0 110.858 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 40.6 m -50.68 -32.54 19.57 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 129.603 3.161 . . . . 0.0 115.669 166.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.298 52.0 mm -89.18 -10.1 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 119.441 -2.037 . . . . 0.0 114.073 177.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 39.8 p -136.67 5.1 2.87 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 118.285 -1.366 . . . . 0.0 114.215 -161.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 52.5 mtp85 -126.43 158.98 34.58 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 123.433 1.587 . . . . 0.0 110.723 169.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 81.64 163.37 31.36 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-O 117.155 -1.914 . . . . 0.0 115.118 -178.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . 0.317 20.0 m -67.55 -12.88 61.39 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 127.334 2.432 . . . . 0.0 117.048 -167.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . 0.268 63.2 m-80 -99.83 -1.81 36.59 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 112.013 -2.358 . . . . 0.0 114.153 -179.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 52.7 p -70.06 167.0 18.58 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 121.101 1.773 . . . . 0.0 110.395 -174.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 27.2 tp -56.45 -29.53 61.78 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -161.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 45.3 mttt -99.54 -4.8 30.39 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 118.786 -2.446 . . . . 0.0 116.164 170.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.33 -23.9 22.14 Favored 'General case' 0 N--CA 1.452 -0.355 1 O-C-N 115.536 -4.478 . . . . 0.0 115.38 166.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.45 156.61 30.06 Favored Pre-proline 0 N--CA 1.449 -0.514 0 C-N-CA 124.849 1.26 . . . . 0.0 112.938 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -63.72 147.26 92.65 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 O-C-N 116.667 -2.333 . . . . 0.0 110.584 -177.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 68.3 t -62.58 -31.08 50.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 127.751 2.421 . . . . 0.0 111.671 -172.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . 0.275 22.6 pm0 -65.24 -28.27 69.24 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 125.566 1.547 . . . . 0.0 114.213 175.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . 0.44 HD22 ' HB2' ' D' ' 37' ' ' PRO . 13.7 tp -82.97 -42.5 17.52 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.395 -0.812 . . . . 0.0 108.891 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 -61.1 -54.39 45.2 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 127.927 2.491 . . . . 0.0 110.566 -175.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -52.71 -53.5 46.82 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 127.787 3.18 . . . . 0.0 112.665 172.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 66.9 t90 -64.08 -39.17 93.48 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -177.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' C' ' 100' ' ' LEU . 13.3 mt -60.1 -39.28 85.59 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 116.948 -1.901 . . . . 0.0 114.642 172.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -64.23 -30.64 71.69 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.271 1.028 . . . . 0.0 112.711 175.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -67.86 -37.52 81.95 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 128.724 2.81 . . . . 0.0 116.751 173.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 61.6 t -86.42 -51.17 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 129.757 3.223 . . . . 0.0 113.315 -176.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 70.4 mt -77.76 -19.12 55.67 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 113.852 -2.975 . . . . 0.0 108.13 -174.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 35.1 mt -124.5 49.3 1.83 Allowed 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 122.564 2.438 . . . . 0.0 111.224 176.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 4.5 pttp -74.32 155.13 38.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 114.908 -2.472 . . . . 0.0 116.142 -172.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 27.6 m -132.88 -32.99 1.2 Allowed 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 128.03 3.331 . . . . 0.0 111.838 -166.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 35.3 t70 . . . . . 0 C--O 1.251 1.134 0 O-C-N 118.403 -2.686 . . . . 0.0 117.983 -163.935 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 14.6 ttt . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 116.346 -1.787 . . . . 0.0 109.876 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.56 152.29 36.55 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 127.644 2.378 . . . . 0.0 112.075 -176.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -122.89 159.79 27.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 111.059 -2.791 . . . . 0.0 109.689 164.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -142.06 142.14 32.83 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 126.619 1.968 . . . . 0.0 115.909 158.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 55.0 p -83.62 157.49 64.2 Favored Pre-proline 0 N--CA 1.447 -0.596 0 O-C-N 116.712 -3.742 . . . . 0.0 110.84 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -63.62 -20.7 69.7 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 115.089 -2.807 . . . . 0.0 111.405 169.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -161.29 137.43 8.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 106.758 -1.571 . . . . 0.0 106.758 172.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 18.1 t -78.72 132.91 37.15 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 126.896 2.623 . . . . 0.0 111.602 -167.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.02 -34.54 74.99 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 116.615 -1.659 . . . . 0.0 114.209 169.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.69 -38.99 57.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 125.277 2.465 . . . . 0.0 114.722 166.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 12.8 mmt -81.91 -22.95 36.52 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 115.635 -2.126 . . . . 0.0 114.879 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.56 -17.93 57.41 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 118.59 2.811 . . . . 0.0 118.59 165.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . 0.336 40.0 tp10 -76.97 -45.04 28.94 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 116.96 -1.495 . . . . 0.0 110.622 156.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -65.64 -31.66 72.81 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 117.687 2.477 . . . . 0.0 117.687 -173.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.95 -21.05 63.3 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 116.614 2.079 . . . . 0.0 116.614 176.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -86.1 -24.09 26.41 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 165.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -81.66 -30.33 32.77 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.206 -1.559 . . . . 0.0 108.677 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -70.76 -22.41 62.4 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 117.901 -3.0 . . . . 0.0 111.881 169.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . 0.433 ' CE2' ' HD2' ' C' ' 48' ' ' ARG . 6.7 t-105 -87.39 -48.44 7.97 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 114.806 -2.521 . . . . 0.0 110.932 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 46.3 mt -57.13 -34.27 68.21 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 126.925 2.09 . . . . 0.0 109.504 167.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -63.11 -35.54 80.61 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 116.729 -3.732 . . . . 0.0 114.377 169.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -69.68 -36.71 76.22 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 121.255 1.843 . . . . 0.0 110.037 167.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 97.9 t -68.46 -35.86 72.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 CA-C-N 122.455 2.389 . . . . 0.0 110.739 -177.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.91 -42.35 94.8 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 128.188 2.595 . . . . 0.0 114.158 168.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . 0.457 ' HA ' HD12 ' D' ' 25' ' ' LEU . 57.5 tp -65.89 -47.8 73.62 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 116.27 -1.824 . . . . 0.0 109.236 177.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 39.5 tp -64.44 -38.31 90.59 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 125.537 1.773 . . . . 0.0 114.844 177.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -49.67 -58.06 6.02 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 123.846 0.858 . . . . 0.0 111.878 166.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -74.41 -12.87 60.63 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 117.133 -1.413 . . . . 0.0 113.127 -176.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.396 . . -77.08 -27.41 54.24 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.691 2.478 . . . . 0.0 117.691 157.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -68.0 -29.99 69.14 Favored 'General case' 0 N--CA 1.447 -0.614 0 O-C-N 117.362 -3.336 . . . . 0.0 113.101 171.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -73.21 -36.95 66.58 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 129.187 2.995 . . . . 0.0 116.254 -172.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 40.7 p30 -105.92 9.91 32.55 Favored 'General case' 0 N--CA 1.448 -0.528 0 O-C-N 125.259 1.599 . . . . 0.0 113.571 171.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 64.95 30.7 11.81 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 131.391 3.876 . . . . 0.0 115.287 -176.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 34.9 mt -96.39 12.91 29.57 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 118.713 -2.492 . . . . 0.0 116.228 174.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -53.77 51.67 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 128.07 2.548 . . . . 0.0 110.15 178.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.27 1.1 mt -63.1 -50.88 73.88 Favored Pre-proline 0 N--CA 1.448 -0.534 0 O-C-N 121.246 -0.909 . . . . 0.0 111.679 -171.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . 0.44 ' HB2' HD22 ' C' ' 96' ' ' LEU . 35.9 Cg_exo -53.09 -27.35 36.31 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 N-CA-C 118.606 2.502 . . . . 0.0 118.606 166.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 27.2 tp -83.45 -43.2 16.09 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 120.084 1.311 . . . . 0.0 111.971 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 93.1 mt -62.35 -37.36 85.37 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 119.991 1.269 . . . . 0.0 110.425 170.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -81.9 -30.72 31.78 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 116.734 -1.603 . . . . 0.0 113.769 -174.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 13.8 tp -58.52 -58.64 7.64 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 129.389 3.076 . . . . 0.0 111.166 157.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 14.9 mmt -56.04 -35.97 67.5 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 127.167 2.187 . . . . 0.0 112.677 -178.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 70.0 mt -121.7 124.98 45.55 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 117.576 -3.202 . . . . 0.0 106.365 -161.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . 0.436 ' HB ' ' HD2' ' D' ' 45' ' ' PRO . 81.4 p -60.42 153.49 59.56 Favored Pre-proline 0 N--CA 1.453 -0.313 0 C-N-CA 127.665 2.386 . . . . 0.0 109.927 162.388 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . 0.436 ' HD2' ' HB ' ' D' ' 44' ' ' THR . 61.7 Cg_endo -74.61 -27.12 11.09 Favored 'Trans proline' 0 N--CA 1.449 -1.133 0 CA-C-O 116.606 -1.498 . . . . 0.0 115.513 -158.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -15.08 63.04 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 113.988 -2.91 . . . . 0.0 114.711 165.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -76.99 -29.72 55.63 Favored 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 125.544 1.777 . . . . 0.0 115.294 167.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 28.9 mtm-85 -77.06 -37.97 53.58 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.833 1.653 . . . . 0.0 112.022 175.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -56.82 -41.44 77.8 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 123.728 1.728 . . . . 0.0 114.414 166.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . 0.319 . . -64.32 -42.22 96.42 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.76 -1.838 . . . . 0.0 113.877 175.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 20.0 mt -72.05 -38.72 69.43 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.12 -28.58 73.79 Favored Glycine 0 C--N 1.336 0.545 0 CA-C-N 120.034 1.288 . . . . 0.0 110.724 167.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 91.2 m -70.5 -23.08 62.6 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 119.164 -2.374 . . . . 0.0 110.928 170.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . . . . . . . . . 21.5 mtt180 -81.6 -23.86 36.8 Favored 'General case' 0 N--CA 1.448 -0.558 0 O-C-N 116.622 -3.799 . . . . 0.0 110.329 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 69.5 t -58.33 -39.14 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 120.594 1.543 . . . . 0.0 113.859 164.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -84.4 -19.44 33.53 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.839 -1.788 . . . . 0.0 115.747 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 80.4 mt -66.8 -51.57 54.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 C-N-CA 127.315 2.246 . . . . 0.0 110.353 160.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . 0.278 67.9 t -55.7 -52.35 49.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 O-C-N 126.352 2.282 . . . . 0.0 109.099 169.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -56.2 -42.55 77.36 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 120.065 1.302 . . . . 0.0 112.289 -168.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -76.16 -35.33 59.23 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 119.007 2.965 . . . . 0.0 119.007 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 54.4 mt -53.66 -37.32 63.03 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 115.562 -2.161 . . . . 0.0 113.22 167.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 94.1 mt -80.74 -36.2 32.36 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 127.984 2.514 . . . . 0.0 107.358 177.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -68.53 -50.49 51.58 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 122.488 2.404 . . . . 0.0 110.261 -177.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 77.63 48.15 8.2 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-O 114.933 -3.148 . . . . 0.0 106.651 161.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -130.74 -54.5 1.07 Allowed 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 126.385 1.874 . . . . 0.0 107.081 179.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 15.7 mmt -80.28 49.91 1.19 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 127.766 2.426 . . . . 0.0 108.679 -176.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 23.6 p -82.4 -166.02 1.17 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 119.977 3.325 . . . . 0.0 119.977 -175.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 50.59 -95.47 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 126.124 1.77 . . . . 0.0 113.761 169.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -70.58 -39.14 74.03 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 117.498 -3.251 . . . . 0.0 113.025 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -79.01 -38.71 35.96 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 112.885 -1.961 . . . . 0.0 110.656 -161.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . 0.3 3.8 mt -56.65 -34.76 67.62 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.415 170.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -78.45 -29.85 47.14 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 177.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -116.65 -16.81 10.68 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 128.177 2.591 . . . . 0.0 116.207 -162.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . 0.27 15.8 tp10 -122.14 -44.93 2.26 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 130.971 3.708 . . . . 0.0 107.821 -173.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -82.17 -47.15 12.85 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 113.282 -3.247 . . . . 0.0 114.879 165.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 99.53 -164.14 19.93 Favored Glycine 0 CA--C 1.523 0.592 0 CA-C-N 121.144 1.793 . . . . 0.0 113.415 155.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -66.69 -22.49 66.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 125.808 1.534 . . . . 0.0 113.947 -159.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.94 -15.81 22.26 Favored Glycine 0 C--N 1.337 0.6 1 CA-C-O 112.483 -4.509 . . . . 0.0 112.099 171.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 10.0 tt -49.8 -22.11 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 1 CA-C-N 124.211 4.006 . . . . 0.0 114.926 172.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -102.19 -15.21 16.73 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 131.356 3.862 . . . . 0.0 112.649 -171.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 57.1 m -64.78 -32.4 74.07 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 116.264 -1.827 . . . . 0.0 113.341 153.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 28.0 mm -98.18 -23.55 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 126.817 2.047 . . . . 0.0 113.388 -173.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 44.8 p -118.17 0.56 11.79 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 118.836 -2.415 . . . . 0.0 115.118 177.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -120.22 -177.53 3.45 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.308 1.843 . . . . 0.0 108.083 154.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 95.14 166.3 35.51 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-O 117.183 -1.898 . . . . 0.0 112.127 -144.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 53.3 p -77.83 -32.31 52.13 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 118.872 2.916 . . . . 0.0 118.872 -166.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -131.57 101.71 5.61 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.014 -1.448 . . . . 0.0 112.485 161.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 69.1 p -101.33 -177.28 3.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 124.273 1.987 . . . . 0.0 112.433 -172.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 tp -63.34 -22.5 66.91 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 114.165 -1.38 . . . . 0.0 113.371 168.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 46.5 tttt -75.17 -15.48 60.57 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 119.453 -2.03 . . . . 0.0 111.306 170.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -110.1 -15.36 14.04 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 115.874 -2.013 . . . . 0.0 115.263 -170.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 38.68 92.43 0.05 OUTLIER Pre-proline 0 N--CA 1.45 -0.45 0 O-C-N 126.539 2.399 . . . . 0.0 115.886 172.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . 0.449 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.365 15.2 Cg_exo 24.43 38.49 0.0 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.342 0 CA-C-O 116.319 -1.617 . . . . 0.0 115.948 50.694 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 15.4 t -51.8 -33.34 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 C-N-CA 126.137 1.775 . . . . 0.0 107.45 -176.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . 0.449 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.332 0.0 OUTLIER -76.38 -43.27 41.36 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -174.36 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 14.7 tp -59.51 -46.85 87.66 Favored 'General case' 0 N--CA 1.447 -0.606 1 O-C-N 129.263 4.102 . . . . 0.0 105.805 174.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 45.2 ttp180 -65.94 -55.1 18.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.62 0.768 . . . . 0.0 110.43 -171.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -45.22 -37.64 4.76 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 126.638 2.461 . . . . 0.0 113.564 173.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . 0.272 90.4 t90 -74.03 -52.67 11.99 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 172.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 97.0 mt -51.39 -29.65 16.39 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 118.519 -2.613 . . . . 0.0 112.579 169.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -82.73 -16.22 48.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 120.049 -1.657 . . . . 0.0 110.933 -175.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -116.38 6.07 13.61 Favored 'General case' 0 N--CA 1.45 -0.444 0 O-C-N 117.0 -3.562 . . . . 0.0 115.875 175.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 44.1 t -109.88 -38.14 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 128.122 2.569 . . . . 0.0 108.87 170.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 31.3 mt -99.34 -20.62 16.42 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 121.965 2.166 . . . . 0.0 112.198 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 4.3 mp -116.6 44.49 2.01 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 126.928 3.251 . . . . 0.0 112.677 171.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 17.1 pttp -71.64 -179.89 2.78 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 112.136 -2.302 . . . . 0.0 113.704 -174.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 69.2 m -50.97 -31.8 18.99 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.619 -1.173 . . . . 0.0 112.636 -173.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 . . . . . 0 C--O 1.251 1.157 1 O-C-N 116.297 -4.002 . . . . 0.0 114.487 -175.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.3 mmt . . . . . 0 N--CA 1.472 0.63 0 CA-C-O 116.101 -1.904 . . . . 0.0 114.123 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -43.7 -33.4 1.23 Allowed 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 119.82 3.267 . . . . 0.0 119.82 -174.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -88.05 -35.82 17.32 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -178.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -69.12 -58.85 3.52 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 127.086 2.154 . . . . 0.0 113.959 170.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . 0.277 36.9 m -86.52 119.99 71.75 Favored Pre-proline 0 N--CA 1.453 -0.307 0 CA-C-N 111.422 -2.626 . . . . 0.0 114.858 -175.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . 0.297 41.8 Cg_endo -75.93 6.64 3.66 Favored 'Trans proline' 0 N--CA 1.448 -1.165 1 C-N-CA 125.833 4.356 . . . . 0.0 120.066 -176.487 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -152.96 156.8 39.57 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 129.423 3.089 . . . . 0.0 112.725 -171.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.1 p -154.28 153.11 31.13 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 125.352 2.501 . . . . 0.0 105.497 153.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . 0.352 . . -66.65 -43.88 83.41 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 113.136 -3.316 . . . . 0.0 114.146 176.174 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.29 -31.31 43.25 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 113.865 -2.969 . . . . 0.0 111.723 167.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 16.9 tpt -85.26 -30.41 23.83 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 120.944 1.702 . . . . 0.0 108.247 177.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.07 -37.0 85.44 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 118.426 -1.31 . . . . 0.0 113.583 174.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -62.91 -39.29 94.09 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 118.981 -2.324 . . . . 0.0 112.884 171.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -72.04 -30.43 65.17 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.134 -1.394 . . . . 0.0 112.473 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 37.4 mmt-85 -75.16 -28.08 59.96 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 119.098 2.999 . . . . 0.0 119.098 162.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -64.95 -42.33 94.71 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 117.036 -1.459 . . . . 0.0 110.543 171.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.9 mm-40 -79.68 -18.15 52.02 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 125.049 1.468 . . . . 0.0 112.276 -175.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -74.28 -36.55 63.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 128.734 2.814 . . . . 0.0 107.334 173.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.44 ' CZ2' ' HD2' ' B' ' 48' ' ' ARG . 11.1 t-105 -71.17 -62.08 1.53 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 124.914 2.292 . . . . 0.0 110.697 172.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 7.3 mt -57.05 -13.81 3.17 Favored 'General case' 0 N--CA 1.447 -0.604 1 O-C-N 115.535 -4.478 . . . . 0.0 117.422 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -52.37 -44.95 65.55 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 118.732 -2.48 . . . . 0.0 113.798 160.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -72.4 -35.66 68.45 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 118.034 -2.916 . . . . 0.0 114.221 179.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.557 HG21 HD13 ' B' ' 36' ' ' LEU . 92.8 t -62.65 -34.72 66.87 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 124.141 1.924 . . . . 0.0 110.226 176.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -76.5 -31.49 57.75 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 118.47 -2.643 . . . . 0.0 114.352 171.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 27.3 tp -68.13 -66.23 0.59 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.695 1.198 . . . . 0.0 111.588 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 42.0 tp -46.37 -29.45 1.69 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 117.514 2.413 . . . . 0.0 117.514 167.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -62.8 -49.39 75.12 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 116.329 -3.982 . . . . 0.0 110.924 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -70.94 -17.86 62.66 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 116.501 -1.714 . . . . 0.0 112.563 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . 0.301 . . -84.28 -28.68 26.99 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 114.482 1.289 . . . . 0.0 114.482 176.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -56.33 -49.67 73.69 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.094 1.758 . . . . 0.0 110.435 163.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -62.08 -7.16 3.61 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 118.404 2.742 . . . . 0.0 118.404 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -126.66 8.66 6.98 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 129.625 3.17 . . . . 0.0 112.29 -175.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 42.41 21.64 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 118.282 2.697 . . . . 0.0 118.282 -168.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 mt -84.06 2.86 37.19 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.466 1.906 . . . . 0.0 111.898 172.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.9 p-80 -66.35 -45.38 80.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 -178.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.1 mt -64.57 -40.47 50.1 Favored Pre-proline 0 N--CA 1.451 -0.423 0 C-N-CA 116.44 -2.104 . . . . 0.0 112.333 174.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -60.69 -39.65 61.77 Favored 'Trans proline' 0 N--CA 1.449 -1.119 1 C-N-CA 126.791 4.994 . . . . 0.0 112.584 178.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 33.9 tp -63.32 -47.66 81.31 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-O 125.427 2.537 . . . . 0.0 114.925 169.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 62.5 mt -70.41 -37.31 74.43 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 118.384 -2.698 . . . . 0.0 112.105 -169.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -68.34 -9.42 47.81 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 119.836 -1.79 . . . . 0.0 114.035 171.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.293 1.0 OUTLIER -86.34 -56.56 3.38 Favored 'General case' 0 N--CA 1.445 -0.712 0 O-C-N 118.263 -2.773 . . . . 0.0 106.89 178.902 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.3 mmt -66.17 -22.77 66.37 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.367 48.5 mt -123.56 131.28 53.58 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.276 2.63 . . . . 0.0 112.946 -170.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 73.8 p -87.56 152.74 52.41 Favored Pre-proline 0 N--CA 1.447 -0.575 0 CA-C-O 117.229 -1.367 . . . . 0.0 111.899 177.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -49.69 -48.24 19.96 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 123.709 2.939 . . . . 0.0 118.619 -175.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -65.66 -35.77 81.74 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 116.693 -1.622 . . . . 0.0 110.365 175.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -60.69 -40.14 91.06 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 123.887 3.04 . . . . 0.0 112.71 169.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 46.0 mtm-85 -65.86 -54.36 27.66 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -50.45 -45.76 56.23 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.391 1.476 . . . . 0.0 108.377 170.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.37 -33.97 77.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 117.638 -3.164 . . . . 0.0 109.983 -178.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.409 HD23 ' HD2' ' A' ' 54' ' ' ARG . 12.8 mt -75.75 -27.5 58.11 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 125.262 1.602 . . . . 0.0 113.554 176.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -64.27 -47.14 87.79 Favored Glycine 0 CA--C 1.521 0.447 0 CA-C-O 115.436 -2.869 . . . . 0.0 108.229 172.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.3 m -57.79 -36.31 72.01 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 120.419 2.11 . . . . 0.0 114.321 174.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.409 ' HD2' HD23 ' A' ' 51' ' ' LEU . 82.2 mtt180 -59.54 -19.85 51.36 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 117.4 2.37 . . . . 0.0 117.4 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.9 t -64.86 -45.74 93.98 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 CA-C-O 117.25 -1.357 . . . . 0.0 113.932 167.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 46.6 ttt180 -71.35 -26.57 62.87 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 125.759 1.912 . . . . 0.0 116.142 171.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . 0.304 34.5 mt -61.66 -53.34 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 O-C-N 128.047 3.342 . . . . 0.0 115.679 165.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 57.0 t -67.55 -30.76 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 O-C-N 126.558 2.411 . . . . 0.0 110.544 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -50.97 -55.16 18.67 Favored 'General case' 0 N--CA 1.452 -0.334 0 O-C-N 116.397 -3.939 . . . . 0.0 115.369 172.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.447 ' HA ' ' OE1' ' A' ' 60' ' ' GLU . 22.5 mm-40 -76.05 -29.28 57.97 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.158 1.783 . . . . 0.0 106.393 -174.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -80.56 -18.61 47.86 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 113.087 -3.34 . . . . 0.0 112.077 178.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 25.5 tp -87.18 -35.47 18.56 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 113.131 -3.319 . . . . 0.0 109.18 167.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -66.66 -45.41 79.0 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 123.294 2.77 . . . . 0.0 109.448 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.65 20.42 44.21 Favored Glycine 0 CA--C 1.525 0.673 0 CA-C-O 125.689 2.827 . . . . 0.0 113.183 158.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -105.06 -43.46 5.04 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.919 1.688 . . . . 0.0 113.531 -170.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 24.6 mtp -79.49 145.32 33.3 Favored 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 117.796 -3.065 . . . . 0.0 109.448 178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.55 165.17 21.38 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 126.091 2.12 . . . . 0.0 113.494 170.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -67.68 -27.99 67.31 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 126.481 2.363 . . . . 0.0 108.662 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 47.1 tpt85 -78.45 -33.34 48.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 124.823 1.249 . . . . 0.0 113.542 173.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -67.24 -40.32 86.28 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 124.223 1.963 . . . . 0.0 109.533 172.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.4 mt -68.68 -22.38 64.38 Favored 'General case' 0 N--CA 1.449 -0.507 0 O-C-N 118.51 -2.619 . . . . 0.0 110.822 -175.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -61.6 -46.05 91.48 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 116.816 -1.564 . . . . 0.0 114.852 167.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -60.73 -15.72 32.25 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 120.22 1.373 . . . . 0.0 113.27 172.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -91.05 -50.8 5.66 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 124.937 2.303 . . . . 0.0 113.821 176.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.6 mt -100.4 -20.26 15.89 Favored 'General case' 0 N--CA 1.451 -0.381 1 N-CA-C 121.895 4.035 . . . . 0.0 121.895 -172.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 61.07 -4.85 0.25 Allowed Glycine 0 CA--C 1.521 0.418 0 N-CA-C 118.608 2.203 . . . . 0.0 118.608 -164.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.71 154.08 39.95 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 125.189 2.423 . . . . 0.0 112.827 -178.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.75 136.97 50.75 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 126.45 1.976 . . . . 0.0 117.021 171.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 26.8 mt -74.91 -25.92 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 O-C-N 118.014 -3.051 . . . . 0.0 113.464 -175.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . 0.298 . . -58.3 -33.97 70.05 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 120.159 3.392 . . . . 0.0 120.159 167.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . 0.277 33.4 p -83.12 -26.38 31.05 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 114.582 -2.627 . . . . 0.0 113.971 174.048 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 13.7 mm -68.66 -38.01 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 162.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.2 m -64.91 -44.75 88.53 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 118.633 -2.542 . . . . 0.0 112.856 176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -60.68 -49.13 78.73 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 113.732 -1.576 . . . . 0.0 111.85 172.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -50.17 -38.55 32.9 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 117.071 1.588 . . . . 0.0 117.071 171.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.4 m -63.58 -41.79 98.34 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 128.877 2.871 . . . . 0.0 114.347 174.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 49.4 m-20 -77.67 -38.98 46.41 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.065 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 70.3 m -54.51 -33.24 59.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 126.426 1.89 . . . . 0.0 114.247 166.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 89' ' ' LEU . 37.3 tp -69.89 -49.27 53.87 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.862 1.665 . . . . 0.0 111.857 172.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -56.28 -37.82 70.37 Favored 'General case' 0 N--CA 1.446 -0.658 0 O-C-N 117.157 -3.464 . . . . 0.0 107.728 172.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.89 5.05 26.77 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 121.434 1.925 . . . . 0.0 114.579 -173.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.86 147.65 94.27 Favored Pre-proline 0 N--CA 1.452 -0.367 0 C-N-CA 127.959 2.504 . . . . 0.0 113.131 166.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -59.43 150.14 77.15 Favored 'Trans proline' 0 N--CA 1.446 -1.285 0 C-N-CA 125.094 3.863 . . . . 0.0 112.925 165.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.2 m -59.1 -36.91 65.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 O-C-N 126.116 2.135 . . . . 0.0 105.725 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -73.88 -37.89 64.57 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 123.498 2.863 . . . . 0.0 109.584 -168.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 21.8 tp -61.12 -43.82 98.3 Favored 'General case' 0 N--CA 1.448 -0.527 0 O-C-N 117.365 -3.334 . . . . 0.0 111.479 168.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 50.7 mtm-85 -67.31 -40.01 85.98 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 121.477 1.944 . . . . 0.0 113.322 -179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.37 -43.12 83.3 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 126.842 2.057 . . . . 0.0 115.266 166.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -63.39 -53.56 50.59 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 116.299 -1.81 . . . . 0.0 115.831 164.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 51.4 mt -59.72 -25.05 64.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 127.44 2.296 . . . . 0.0 112.488 -177.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -67.73 -35.23 78.38 Favored 'General case' 0 N--CA 1.452 -0.332 1 O-C-N 116.257 -4.027 . . . . 0.0 111.895 170.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -80.11 -24.72 40.32 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 120.529 -1.357 . . . . 0.0 111.83 178.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.4 t -66.72 -61.04 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 O-C-N 117.314 -3.366 . . . . 0.0 114.291 164.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.2 mt -87.5 -31.66 19.84 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 117.375 2.361 . . . . 0.0 117.375 -166.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 24.4 mt -109.14 -4.64 16.41 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 -163.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.8 tttt -87.73 -33.8 18.58 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -164.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 17.0 p -78.07 -26.06 47.99 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 116.94 2.2 . . . . 0.0 116.94 -171.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.15 0 CA-C-O 124.045 1.878 . . . . 0.0 113.474 -178.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.683 0 CA-C-O 116.082 -1.913 . . . . 0.0 107.966 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.62 -23.49 56.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 114.815 -2.517 . . . . 0.0 114.547 -142.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -98.75 5.32 47.63 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 123.892 3.042 . . . . 0.0 109.447 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . 0.337 27.0 tp60 -113.66 -55.35 2.52 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.476 1.91 . . . . 0.0 107.895 -172.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 61.0 m -67.86 123.64 87.52 Favored Pre-proline 0 N--CA 1.451 -0.411 0 O-C-N 126.556 2.41 . . . . 0.0 110.515 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_exo -75.94 -21.69 13.93 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 124.304 3.336 . . . . 0.0 110.261 -170.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -101.59 136.87 40.71 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 119.853 1.206 . . . . 0.0 110.598 158.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 26.3 t -165.43 136.25 3.82 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 130.216 3.406 . . . . 0.0 115.637 171.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.99 -29.43 64.22 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 112.418 -2.174 . . . . 0.0 114.027 171.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.16 -36.45 77.39 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 118.744 -1.182 . . . . 0.0 109.262 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -34.72 67.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 117.182 2.29 . . . . 0.0 117.182 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.02 -45.23 91.24 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 123.41 1.576 . . . . 0.0 109.711 173.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . 0.302 48.3 tp10 -61.73 -38.09 86.65 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 128.501 2.72 . . . . 0.0 110.628 174.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -70.3 -42.36 72.1 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 122.232 2.287 . . . . 0.0 109.39 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -80.8 -2.81 48.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 115.004 -2.427 . . . . 0.0 112.266 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -82.58 -44.97 15.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 119.933 3.308 . . . . 0.0 119.933 152.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -65.14 -21.38 66.78 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.299 1.592 . . . . 0.0 115.299 170.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -64.95 -37.04 86.33 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 117.88 2.548 . . . . 0.0 117.88 161.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 15.9 t-105 -68.44 -41.42 80.3 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 117.143 -1.408 . . . . 0.0 108.815 -177.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 59.7 mt -65.92 -27.79 68.45 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 127.346 2.904 . . . . 0.0 110.739 -176.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 32.3 ttt180 -63.31 -31.66 72.88 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 125.251 1.595 . . . . 0.0 114.677 -178.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -74.48 -49.36 22.5 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 124.814 1.321 . . . . 0.0 109.847 171.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.18 -37.41 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.774 1.63 . . . . 0.0 108.48 -173.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.45 -35.01 63.32 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 127.846 2.458 . . . . 0.0 113.601 175.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 16.8 tp -57.79 -50.09 74.42 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 116.879 -3.638 . . . . 0.0 110.597 166.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' B' ' 29' ' ' ALA . 22.4 tp -63.52 -45.45 90.54 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.844 178.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -56.73 -44.94 82.13 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.812 2.045 . . . . 0.0 113.419 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -66.55 -43.94 83.73 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 172.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' B' ' 26' ' ' LEU . . . -50.44 -49.35 55.18 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 119.214 -2.179 . . . . 0.0 114.238 173.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . 0.404 ' C ' ' H ' ' B' ' 32' ' ' ASN . 1.6 m-85 -64.65 -37.69 88.45 Favored 'General case' 0 N--CA 1.45 -0.457 1 CA-C-O 111.37 -4.157 . . . . 0.0 105.206 -176.166 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -57.26 -4.94 0.24 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 123.639 2.927 . . . . 0.0 116.47 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . 0.404 ' H ' ' C ' ' B' ' 30' ' ' TYR . 49.0 m-80 -141.48 3.18 1.69 Allowed 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 129.002 2.921 . . . . 0.0 114.61 -167.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 65.79 19.43 11.35 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 129.503 3.121 . . . . 0.0 118.298 170.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 26.2 mt -87.81 0.69 55.45 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 113.367 -1.742 . . . . 0.0 114.843 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -59.19 -40.92 87.24 Favored 'General case' 0 N--CA 1.45 -0.425 1 O-C-N 115.573 -4.454 . . . . 0.0 113.286 -170.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.557 HD13 HG21 ' A' ' 23' ' ' VAL . 29.4 tp -66.89 -47.61 53.46 Favored Pre-proline 0 N--CA 1.451 -0.41 0 CA-C-O 113.51 -3.138 . . . . 0.0 110.109 -178.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -51.22 -49.07 18.27 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 124.934 3.756 . . . . 0.0 116.567 167.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 21.8 tp -56.08 -40.78 74.13 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 119.201 3.037 . . . . 0.0 119.201 168.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 82.4 mt -73.61 -16.55 61.23 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 113.986 -2.912 . . . . 0.0 109.338 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . 0.344 33.6 m-20 -78.8 -40.46 32.95 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 123.025 2.648 . . . . 0.0 110.945 169.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 56.4 tp -65.88 -30.13 70.69 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 117.336 2.347 . . . . 0.0 117.336 169.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.2 mmt -105.82 -8.27 17.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 121.535 1.97 . . . . 0.0 109.039 -169.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 19.5 mt -134.94 135.23 41.34 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 120.501 1.5 . . . . 0.0 109.298 176.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 59.0 p -75.42 159.32 82.21 Favored Pre-proline 0 N--CA 1.45 -0.466 0 CA-C-O 114.037 -2.887 . . . . 0.0 112.879 170.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -67.97 -20.56 44.64 Favored 'Trans proline' 0 N--CA 1.453 -0.886 0 CA-C-O 113.025 -2.99 . . . . 0.0 112.885 -172.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -58.78 -35.65 73.13 Favored 'General case' 0 N--CA 1.448 -0.533 0 O-C-N 128.153 3.408 . . . . 0.0 112.372 166.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -86.8 -36.57 18.46 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 126.078 2.111 . . . . 0.0 112.28 -176.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . 0.44 ' HD2' ' CZ2' ' A' ' 19' ' ' TRP . 16.3 mtm-85 -68.19 -30.21 69.25 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.069 -1.423 . . . . 0.0 114.157 170.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -71.38 -25.91 62.56 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 114.651 -2.595 . . . . 0.0 114.135 167.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.81 -53.02 62.41 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 124.592 2.139 . . . . 0.0 114.915 158.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.292 30.7 mt -62.12 -42.78 99.57 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 116.63 -1.653 . . . . 0.0 114.849 -175.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.32 -31.67 79.69 Favored Glycine 0 CA--C 1.522 0.519 0 C-N-CA 118.096 -2.002 . . . . 0.0 113.798 174.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . 0.258 25.8 m -64.01 -45.05 90.67 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.638 2.375 . . . . 0.0 111.303 170.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -73.08 -27.51 61.76 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 118.891 -2.38 . . . . 0.0 112.385 -171.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 23.8 t -56.85 -38.28 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 1 O-C-N 115.01 -4.807 . . . . 0.0 112.889 163.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -76.97 -33.06 57.66 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 120.656 1.571 . . . . 0.0 110.38 -176.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 45.0 mt -64.3 -56.08 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 128.383 2.673 . . . . 0.0 113.536 173.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.267 94.0 t -44.69 -48.16 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 119.136 3.013 . . . . 0.0 119.136 167.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -58.75 -54.72 43.89 Favored 'General case' 0 N--CA 1.446 -0.625 0 O-C-N 126.99 2.681 . . . . 0.0 110.924 173.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -59.93 -33.29 71.69 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 119.831 -1.793 . . . . 0.0 109.437 -175.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 42.6 mt -60.89 -42.59 98.27 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 116.308 -1.805 . . . . 0.0 108.901 178.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 47.8 mt -72.64 -24.55 61.06 Favored 'General case' 0 N--CA 1.449 -0.52 0 O-C-N 125.753 1.908 . . . . 0.0 114.995 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 31.9 ttm105 -87.08 -50.12 6.85 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.421 -1.276 . . . . 0.0 112.208 -176.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.02 37.91 36.85 Favored Glycine 0 CA--C 1.525 0.687 0 CA-C-N 121.249 1.841 . . . . 0.0 116.865 177.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -113.23 -28.94 7.44 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 118.237 -2.92 . . . . 0.0 114.14 -175.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 24.5 mtt -82.72 131.17 35.21 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 -168.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 29.6 p -62.61 166.25 5.53 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 128.338 2.655 . . . . 0.0 113.066 170.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -72.15 -25.04 61.55 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 123.921 3.055 . . . . 0.0 112.428 -177.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -63.33 -48.06 79.58 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 131.437 3.895 . . . . 0.0 109.202 169.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -67.06 -38.93 86.65 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.409 HD23 HD12 ' B' ' 75' ' ' LEU . 78.0 mt -54.68 -42.05 70.92 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 124.471 1.107 . . . . 0.0 112.133 168.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -71.33 -21.51 62.04 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 115.09 -2.386 . . . . 0.0 113.595 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -130.41 -39.37 1.31 Allowed 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 124.758 3.435 . . . . 0.0 110.159 -163.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -71.38 -49.39 42.62 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 124.874 2.273 . . . . 0.0 112.091 173.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.409 HD12 HD23 ' B' ' 71' ' ' LEU . 16.9 mt -96.53 3.86 52.4 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 112.766 -2.016 . . . . 0.0 115.977 170.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 56.79 33.39 63.17 Favored Glycine 0 C--N 1.337 0.593 0 O-C-N 118.037 -2.914 . . . . 0.0 115.387 172.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -127.71 139.94 52.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 120.952 2.376 . . . . 0.0 115.389 -168.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.23 153.86 36.18 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 127.889 2.661 . . . . 0.0 114.006 169.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . 0.251 23.8 mm -62.85 -23.18 32.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 120.557 2.179 . . . . 0.0 112.148 -172.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.67 -41.89 95.96 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 119.728 -1.857 . . . . 0.0 112.504 167.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 98.3 m -69.16 -19.18 64.0 Favored 'General case' 0 N--CA 1.45 -0.459 0 O-C-N 116.722 -3.736 . . . . 0.0 114.188 174.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 34.2 mm -81.35 -54.16 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 CA-C-O 123.969 1.842 . . . . 0.0 113.591 172.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 25.7 m -55.71 -35.17 65.79 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 118.573 -2.579 . . . . 0.0 114.86 174.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -56.81 -50.65 71.74 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 118.746 -2.471 . . . . 0.0 114.409 168.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -57.25 -42.99 93.73 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 128.402 2.905 . . . . 0.0 118.927 173.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 4.0 p -72.39 -42.41 65.22 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 175.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -47.57 -37.59 12.64 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 158.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 13.8 m -75.32 -28.75 59.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 120.086 1.312 . . . . 0.0 112.487 -176.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 mt -84.68 -43.73 14.07 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 128.179 2.591 . . . . 0.0 106.448 -178.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 18.5 tttm -54.13 -40.8 67.7 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 121.858 2.117 . . . . 0.0 110.711 176.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.05 4.55 44.77 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 117.606 2.447 . . . . 0.0 117.606 -179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.408 ' HB1' HD23 ' B' ' 96' ' ' LEU . . . -67.07 135.62 93.95 Favored Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 117.539 2.422 . . . . 0.0 117.539 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -51.83 128.76 27.69 Favored 'Trans proline' 0 N--CA 1.452 -0.915 0 N-CA-C 106.755 -2.056 . . . . 0.0 106.755 176.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 34.5 m -65.32 -23.21 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -163.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -62.24 -31.58 72.16 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 170.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.408 HD23 ' HB1' ' B' ' 92' ' ' ALA . 13.7 tp -80.28 -36.54 34.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 126.588 1.955 . . . . 0.0 112.674 171.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 58.0 mtp85 -61.92 -43.96 97.76 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 177.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.69 -37.66 85.19 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.06 1.344 . . . . 0.0 110.415 177.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 79.1 t90 -67.15 -45.62 76.51 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 124.765 2.222 . . . . 0.0 108.906 -172.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 70.2 mt -67.98 -27.26 66.43 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 111.835 -3.936 . . . . 0.0 110.378 -178.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -68.99 -37.09 78.53 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 125.191 3.632 . . . . 0.0 109.266 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -82.04 -30.2 31.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.435 2.294 . . . . 0.0 114.852 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 76.9 t -62.17 -55.3 24.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 O-C-N 121.327 -0.858 . . . . 0.0 108.859 167.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . 0.29 33.2 mt -82.17 -55.2 4.69 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 124.345 2.021 . . . . 0.0 111.73 -156.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 32.1 mt -79.59 -2.78 44.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 118.087 -2.883 . . . . 0.0 114.13 -163.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -123.33 4.03 9.13 Favored 'General case' 0 N--CA 1.454 -0.268 1 C-N-CA 132.765 4.426 . . . . 0.0 110.926 -177.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 16.5 m -114.43 -35.95 4.78 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-O 115.532 -2.175 . . . . 0.0 110.949 162.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 33.0 t70 . . . . . 0 C--O 1.25 1.091 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 169.395 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . 0.296 61.9 mtp . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.428 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . 0.294 . . -87.78 132.58 34.11 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 126.327 1.851 . . . . 0.0 110.054 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -109.05 132.75 53.81 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 119.513 1.051 . . . . 0.0 110.899 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -103.59 149.85 24.52 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 166.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . 0.417 ' HA ' ' HD3' ' C' ' 6' ' ' PRO . 32.7 p -125.03 150.45 66.61 Favored Pre-proline 0 N--CA 1.45 -0.446 0 O-C-N 126.682 2.489 . . . . 0.0 109.545 177.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' C' ' 5' ' ' SER . 63.6 Cg_exo -66.32 -9.85 25.37 Favored 'Trans proline' 0 N--CA 1.446 -1.282 0 C-N-CA 124.573 3.515 . . . . 0.0 116.388 -174.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -155.08 158.08 38.52 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 118.082 -2.886 . . . . 0.0 107.589 176.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 10.6 t -150.06 121.89 8.14 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 131.311 3.844 . . . . 0.0 112.065 157.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.34 -40.9 78.98 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 116.845 -3.66 . . . . 0.0 114.579 171.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.57 -41.41 73.26 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 120.78 1.627 . . . . 0.0 115.355 172.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 25.3 mtt -56.67 -40.73 76.05 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 125.651 1.58 . . . . 0.0 108.694 178.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.94 -37.79 79.09 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 119.305 -2.122 . . . . 0.0 112.94 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -68.95 -16.8 63.83 Favored 'General case' 0 N--CA 1.448 -0.541 1 CA-C-O 109.224 -5.179 . . . . 0.0 116.79 165.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -84.66 -31.1 24.35 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 125.04 3.563 . . . . 0.0 110.868 163.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -33.27 75.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 O-C-N 124.677 1.236 . . . . 0.0 113.114 170.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . 0.265 84.7 t60 -78.59 -30.83 46.9 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 126.019 2.075 . . . . 0.0 109.62 -177.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -69.18 -23.93 63.99 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 117.413 -1.715 . . . . 0.0 114.863 171.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -77.6 -32.82 53.82 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 124.502 1.121 . . . . 0.0 111.84 -179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -64.9 -43.04 94.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 130.899 3.68 . . . . 0.0 114.225 165.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 mp -66.86 -30.04 70.1 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 116.612 -3.805 . . . . 0.0 110.279 177.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 26.8 ttt180 -74.53 -34.02 62.9 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 124.085 1.898 . . . . 0.0 110.739 -175.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . 0.411 ' CE2' HD22 ' D' ' 51' ' ' LEU . 5.4 t80 -59.99 -39.33 85.36 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 115.916 -1.992 . . . . 0.0 112.622 170.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 78.7 t -68.55 -46.23 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 C-N-CA 128.284 2.633 . . . . 0.0 110.983 174.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -64.77 -41.54 95.78 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 117.723 2.49 . . . . 0.0 117.723 176.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 45.7 tp -57.11 -40.94 78.06 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 127.442 3.496 . . . . 0.0 110.689 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 15.8 tp -71.65 -28.39 63.73 Favored 'General case' 0 N--CA 1.447 -0.579 1 O-C-N 115.955 -4.215 . . . . 0.0 116.579 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -63.86 -44.11 94.08 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 116.129 -1.891 . . . . 0.0 108.728 170.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -71.69 -31.39 66.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 126.834 2.584 . . . . 0.0 111.229 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.42 83.85 Favored 'General case' 0 N--CA 1.443 -0.785 0 O-C-N 119.15 -2.219 . . . . 0.0 115.232 172.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -58.17 -24.74 60.06 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 126.768 3.175 . . . . 0.0 117.167 169.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -76.51 -22.99 53.73 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 111.821 -2.445 . . . . 0.0 114.092 -178.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 32.7 p-10 -135.55 19.38 3.33 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.237 2.215 . . . . 0.0 112.253 -174.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.263 1.6 m-20 60.92 24.34 14.37 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 117.362 -3.336 . . . . 0.0 115.619 178.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 18.4 mt -89.2 4.46 48.56 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 118.167 -0.921 . . . . 0.0 110.642 171.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . 0.402 32.6 p-80 -53.66 -56.74 14.6 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 117.454 2.39 . . . . 0.0 117.454 175.397 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.73 -57.15 27.55 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-O 115.862 -2.018 . . . . 0.0 105.813 175.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -52.69 -37.56 75.46 Favored 'Trans proline' 0 N--CA 1.451 -0.985 0 CA-C-N 124.323 2.58 . . . . 0.0 114.507 175.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 64.4 tp -74.65 -23.28 58.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 122.927 2.603 . . . . 0.0 112.654 -177.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 35.4 mt -90.09 -38.21 13.71 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 119.512 1.051 . . . . 0.0 112.237 174.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -43.93 -38.4 3.4 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.712 1.205 . . . . 0.0 110.446 162.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 57.6 tp -83.43 -40.15 19.68 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 118.42 -2.675 . . . . 0.0 114.004 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . 0.4 ' SD ' ' HB3' ' D' ' 54' ' ' ARG . 26.1 mmm -96.07 -6.28 38.98 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 119.786 -1.821 . . . . 0.0 112.143 -171.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . . 10.1 mp -119.24 146.8 44.92 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.044 1.738 . . . . 0.0 108.158 175.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . 0.387 41.6 p -70.2 156.83 91.2 Favored Pre-proline 0 N--CA 1.449 -0.487 0 C-N-CA 127.468 2.307 . . . . 0.0 114.518 158.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -50.25 -31.46 29.39 Favored 'Trans proline' 0 N--CA 1.45 -1.063 0 C-N-CA 124.743 3.629 . . . . 0.0 112.001 165.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.66 -30.6 65.9 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 127.248 2.219 . . . . 0.0 113.419 175.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -82.21 -36.87 26.83 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 120.447 -1.408 . . . . 0.0 108.453 -174.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . 0.405 ' HD2' ' CE2' ' D' ' 19' ' ' TRP . 73.1 mtm-85 -66.04 -42.33 89.72 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 115.394 -2.241 . . . . 0.0 112.903 171.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -58.04 -52.42 65.6 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 127.901 3.251 . . . . 0.0 111.271 176.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . . . . -41.88 -59.89 1.56 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 128.37 2.668 . . . . 0.0 110.791 169.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 28.7 mt -63.78 -34.42 77.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 119.213 3.042 . . . . 0.0 119.213 178.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -57.84 -56.47 24.95 Favored Glycine 0 C--N 1.336 0.55 0 O-C-N 126.798 2.561 . . . . 0.0 113.124 170.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . 0.315 17.6 m -45.04 -53.77 7.43 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 159.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . 0.419 ' HA ' HD12 ' C' ' 57' ' ' ILE . 95.2 mtt180 -59.7 -33.66 71.89 Favored 'General case' 0 N--CA 1.449 -0.498 1 O-C-N 114.756 -4.965 . . . . 0.0 117.88 172.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 17.1 t -57.38 -51.63 67.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 O-C-N 121.19 -0.944 . . . . 0.0 110.612 169.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 45.9 mtp180 -66.52 -26.72 67.29 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 113.396 -3.192 . . . . 0.0 113.593 -174.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . 0.419 HD12 ' HA ' ' C' ' 54' ' ' ARG 0.251 77.8 mt -70.42 -27.17 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 105.392 -2.077 . . . . 0.0 105.392 175.284 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 40.1 t -78.84 -39.7 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 122.369 2.35 . . . . 0.0 112.335 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -49.83 -47.09 51.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 119.042 -2.286 . . . . 0.0 111.366 169.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -75.79 -22.3 56.52 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 115.336 -2.269 . . . . 0.0 116.034 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 63.6 mt -86.39 -15.23 41.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 123.579 2.9 . . . . 0.0 108.255 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 16.7 mt -83.03 -41.71 18.35 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 123.256 2.753 . . . . 0.0 108.824 172.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 44.5 ttm105 -66.02 -25.93 67.29 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 116.687 2.106 . . . . 0.0 116.687 170.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 49.77 2.39 0.02 OUTLIER Glycine 0 C--N 1.336 0.548 0 C-N-CA 127.517 2.484 . . . . 0.0 118.469 -178.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -66.06 -39.42 90.08 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 121.815 2.807 . . . . 0.0 110.903 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 16.0 mmt -55.58 123.15 13.08 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 124.659 2.171 . . . . 0.0 113.157 175.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 92.5 p -83.91 -174.96 5.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 112.826 -1.988 . . . . 0.0 111.791 -174.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -67.5 -28.31 67.73 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 122.208 2.276 . . . . 0.0 112.112 -173.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 34.1 ttp-105 -59.48 -64.55 0.9 Allowed 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 127.63 2.372 . . . . 0.0 113.872 171.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -53.69 -39.94 65.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 128.301 2.64 . . . . 0.0 112.976 176.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 77.2 mt -64.17 -12.22 38.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.375 -1.453 . . . . 0.0 114.706 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -107.08 -48.64 3.43 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 128.023 2.529 . . . . 0.0 112.783 171.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -88.96 10.9 19.78 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 -174.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -137.85 -36.71 0.61 Allowed 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 111.929 -3.891 . . . . 0.0 110.08 166.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . . . . . . . . . 7.8 mp -95.77 0.22 52.11 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 120.477 3.51 . . . . 0.0 120.477 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 44.3 -125.36 5.87 Favored Glycine 0 C--N 1.338 0.666 0 CA-C-O 115.199 -3.0 . . . . 0.0 119.85 171.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -101.04 -18.85 16.07 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 120.728 2.264 . . . . 0.0 113.149 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.11 -29.3 73.98 Favored Glycine 0 CA--C 1.523 0.57 0 O-C-N 117.299 -3.375 . . . . 0.0 109.656 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 9.2 tt -43.81 -34.81 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 117.733 2.494 . . . . 0.0 117.733 162.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.64 -59.22 5.22 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 121.126 3.75 . . . . 0.0 121.126 173.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 9.1 m -43.62 -47.13 7.51 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 115.341 -2.266 . . . . 0.0 109.849 172.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . 0.259 44.5 mm -60.29 -30.42 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-N 122.213 2.279 . . . . 0.0 113.203 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 61.0 p -118.34 3.22 11.93 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 119.127 -2.233 . . . . 0.0 114.536 -163.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 67.8 mtp85 -116.76 136.67 52.78 Favored 'General case' 0 N--CA 1.45 -0.428 1 C-N-CA 131.856 4.062 . . . . 0.0 115.039 175.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 97.76 161.59 31.05 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-O 115.794 -2.67 . . . . 0.0 113.816 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 66.7 m -56.83 -12.28 1.86 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 113.465 -3.16 . . . . 0.0 117.812 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -103.84 15.01 29.7 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 122.387 2.358 . . . . 0.0 113.698 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 3.0 p -68.05 162.91 23.54 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 116.803 -1.57 . . . . 0.0 114.504 -171.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 17.3 tp -47.01 -42.64 18.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 121.979 2.172 . . . . 0.0 115.791 -172.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -91.16 -10.76 40.62 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 119.989 3.329 . . . . 0.0 119.989 171.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.72 -28.53 64.8 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 116.872 -1.537 . . . . 0.0 109.819 167.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.77 162.98 31.8 Favored Pre-proline 0 N--CA 1.453 -0.316 0 C-N-CA 129.526 3.13 . . . . 0.0 117.716 -163.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_exo -55.36 148.14 52.94 Favored 'Trans proline' 0 N--CA 1.451 -0.984 0 C-N-CA 124.285 3.323 . . . . 0.0 111.957 172.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 18.1 t -71.13 -45.35 72.02 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 CA-C-N 110.139 -3.21 . . . . 0.0 106.991 -169.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 18.7 pm0 -65.77 -28.43 69.02 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-O 113.788 -3.006 . . . . 0.0 111.672 -179.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 36.6 tp -71.36 -46.27 60.85 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 125.184 2.421 . . . . 0.0 115.57 169.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 72.4 mtp180 -63.18 -33.73 76.12 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 112.37 -3.681 . . . . 0.0 110.022 -177.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -83.35 -31.29 26.86 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 127.618 3.074 . . . . 0.0 113.378 173.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 82.0 t90 -63.29 -54.19 40.99 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 170.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 78.8 mt -55.55 -29.24 58.63 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.513 1.125 . . . . 0.0 109.329 -175.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -71.52 -34.91 70.49 Favored 'General case' 0 N--CA 1.452 -0.34 1 C-N-CA 132.08 4.152 . . . . 0.0 109.825 -178.031 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -75.19 -26.26 58.88 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 111.075 -2.784 . . . . 0.0 113.117 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 54.2 t -97.42 -47.98 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-N 113.145 -1.843 . . . . 0.0 113.142 -176.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 73.4 mt -85.38 -22.7 28.29 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -169.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 64.5 mt -111.36 17.06 20.53 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 119.088 -2.258 . . . . 0.0 112.698 176.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -55.3 132.45 47.95 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 125.941 2.781 . . . . 0.0 116.69 176.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 17.5 m -106.88 -26.63 11.14 Favored 'General case' 0 N--CA 1.452 -0.345 0 O-C-N 117.342 -3.349 . . . . 0.0 114.464 173.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 25.2 t0 . . . . . 0 C--O 1.249 1.049 0 N-CA-C 118.207 2.669 . . . . 0.0 118.207 177.134 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 9.5 ttt . . . . . 0 N--CA 1.473 0.716 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . 0.285 . . -154.97 172.57 17.88 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 128.247 2.619 . . . . 0.0 112.755 176.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -140.66 157.84 44.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 124.337 2.018 . . . . 0.0 110.723 -167.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -140.72 145.93 37.11 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 128.2 2.6 . . . . 0.0 112.539 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 1.7 p -126.81 161.29 54.26 Favored Pre-proline 0 N--CA 1.449 -0.483 0 C-N-CA 128.089 2.556 . . . . 0.0 115.802 174.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -76.09 -0.04 9.87 Favored 'Trans proline' 0 N--CA 1.444 -1.383 0 CA-C-O 117.587 -1.089 . . . . 0.0 112.615 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -162.89 120.29 1.96 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 128.184 2.593 . . . . 0.0 110.455 165.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 15.8 p -74.82 149.88 39.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 113.147 -3.421 . . . . 0.0 110.965 -168.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.77 -33.91 73.68 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 126.299 1.84 . . . . 0.0 115.347 174.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -78.36 -14.28 59.47 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 124.474 2.083 . . . . 0.0 112.491 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 4.8 mmt -87.15 -36.13 18.22 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 117.804 -3.06 . . . . 0.0 105.81 -175.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.98 -23.25 66.29 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 116.627 -3.796 . . . . 0.0 117.331 168.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -74.35 -40.75 61.95 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 126.927 2.642 . . . . 0.0 116.035 156.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -62.72 -36.92 84.54 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 119.815 1.189 . . . . 0.0 109.465 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -36.25 77.17 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 115.158 -2.353 . . . . 0.0 113.735 175.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -69.88 -24.87 63.47 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 122.564 2.438 . . . . 0.0 117.412 172.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -82.09 -39.53 23.23 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.342 1.057 . . . . 0.0 108.544 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -62.92 -29.32 70.7 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 169.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . 0.405 ' CE2' ' HD2' ' C' ' 48' ' ' ARG . 38.4 t-105 -70.69 -35.84 72.98 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 117.49 -3.256 . . . . 0.0 112.859 166.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 64.4 mt -80.19 -18.36 49.86 Favored 'General case' 0 N--CA 1.452 -0.358 0 O-C-N 119.059 -2.276 . . . . 0.0 115.442 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 42.3 ttt180 -69.05 -29.11 67.18 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 126.535 1.934 . . . . 0.0 112.857 162.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 94.0 t80 -75.09 -48.4 24.03 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 114.409 -2.71 . . . . 0.0 112.347 166.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 46.7 t -56.67 -38.78 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 124.524 3.329 . . . . 0.0 112.272 174.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -73.05 -48.27 37.54 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 125.528 1.768 . . . . 0.0 113.081 173.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 39.0 tp -52.93 -48.61 67.18 Favored 'General case' 0 N--CA 1.448 -0.563 1 O-C-N 115.173 -4.704 . . . . 0.0 109.307 173.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 41.5 tp -62.25 -46.7 87.67 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 120.364 1.438 . . . . 0.0 110.507 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -51.61 -46.83 63.74 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 116.123 1.898 . . . . 0.0 116.123 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -66.73 -27.85 67.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 119.109 -2.244 . . . . 0.0 108.578 174.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . 0.307 . . -69.66 -23.91 63.53 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 129.049 2.94 . . . . 0.0 114.785 173.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -76.43 -28.26 56.54 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 120.449 -1.407 . . . . 0.0 111.031 165.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -75.44 -24.28 57.03 Favored 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 119.895 -1.753 . . . . 0.0 113.085 -175.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . . 55.1 p30 -116.33 9.93 14.61 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 121.134 3.753 . . . . 0.0 121.134 164.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 55.59 32.54 19.39 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 116.693 -1.622 . . . . 0.0 115.278 -178.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 60.8 mt -80.78 -1.51 43.21 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 120.411 1.46 . . . . 0.0 112.578 164.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . 0.331 0.0 OUTLIER -38.8 -75.6 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 119.418 3.118 . . . . 0.0 119.418 -179.279 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.292 50.8 mt -46.44 -45.33 44.37 Favored Pre-proline 0 N--CA 1.446 -0.631 0 CA-C-O 113.528 -3.13 . . . . 0.0 115.298 174.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -55.0 -37.23 93.86 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 124.538 3.492 . . . . 0.0 114.063 168.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 41.3 tp -75.09 -46.94 31.28 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 176.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . . . . . . . . . 61.8 mt -57.85 -31.23 66.47 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 126.757 2.023 . . . . 0.0 112.804 171.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -79.0 -40.61 31.05 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 117.0 -3.563 . . . . 0.0 112.31 176.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 54.9 tp -51.01 -55.92 15.07 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 118.954 -2.341 . . . . 0.0 111.68 164.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . . . . . . . . . 22.2 mmt -83.5 -25.03 31.45 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 115.943 -1.98 . . . . 0.0 115.401 -172.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 31.9 mt -116.96 141.3 48.42 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 122.173 2.26 . . . . 0.0 113.2 -176.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . 0.437 ' HB ' ' HD2' ' D' ' 45' ' ' PRO . 46.4 p -70.58 156.03 92.54 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 127.923 2.489 . . . . 0.0 109.347 170.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . 0.437 ' HD2' ' HB ' ' D' ' 44' ' ' THR . 17.7 Cg_endo -65.28 -36.69 34.75 Favored 'Trans proline' 0 N--CA 1.451 -0.983 0 O-C-N 117.93 -1.668 . . . . 0.0 113.868 -168.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . 0.255 0.1 OUTLIER -69.65 -10.82 59.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 O-C-N 118.834 -2.416 . . . . 0.0 115.477 173.894 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -78.91 -40.3 32.57 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.508 1.523 . . . . 0.0 108.982 166.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 41.0 mtm-85 -71.14 -36.44 72.09 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 119.164 -2.21 . . . . 0.0 116.829 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.19 -36.19 82.82 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 119.667 -1.896 . . . . 0.0 112.493 167.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -79.1 -30.38 43.8 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 117.72 -3.113 . . . . 0.0 111.421 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . 0.411 HD22 ' CE2' ' C' ' 22' ' ' PHE . 56.4 mt -68.84 -52.7 27.13 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 118.625 -2.547 . . . . 0.0 113.844 167.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -48.45 -36.36 17.17 Favored Glycine 0 N--CA 1.446 -0.679 0 CA-C-O 115.614 -2.77 . . . . 0.0 115.162 164.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 25.6 m -76.13 -26.55 56.46 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 121.087 2.444 . . . . 0.0 113.516 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . 0.4 ' HB3' ' SD ' ' C' ' 42' ' ' MET . 72.9 mtt180 -66.22 -34.36 77.84 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 116.928 -1.51 . . . . 0.0 109.354 171.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . 0.255 42.8 t -44.71 -49.09 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 CA-C-O 126.471 3.034 . . . . 0.0 115.562 171.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -86.42 -21.98 26.81 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 112.017 -2.356 . . . . 0.0 116.507 -176.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . . . . . . . . . 92.0 mt -64.13 -39.05 84.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-O 122.35 1.071 . . . . 0.0 112.932 166.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 85.0 t -60.69 -54.44 35.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 C-N-CA 127.928 2.491 . . . . 0.0 112.415 165.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -67.06 -35.63 80.28 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -178.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -79.24 -18.19 53.32 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 121.922 2.147 . . . . 0.0 112.484 176.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 17.0 mt -63.43 -58.8 5.9 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 117.686 -1.149 . . . . 0.0 109.09 162.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 11.1 mt -63.55 -42.48 98.38 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 105.242 -2.132 . . . . 0.0 105.242 -171.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -62.46 -41.6 98.87 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 177.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 59.16 44.53 96.33 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 118.064 1.985 . . . . 0.0 118.064 175.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -132.16 -22.52 2.26 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 121.732 2.766 . . . . 0.0 115.966 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 25.1 mmt -92.49 56.57 2.76 Favored 'General case' 0 N--CA 1.448 -0.566 1 O-C-N 129.433 4.208 . . . . 0.0 108.019 168.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 64.4 p -93.22 176.16 6.5 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 125.603 1.814 . . . . 0.0 112.777 -148.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 51.69 -82.76 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 114.653 -2.594 . . . . 0.0 112.027 168.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -88.43 -24.57 22.99 Favored 'General case' 0 N--CA 1.451 -0.39 1 CA-C-N 126.803 4.365 . . . . 0.0 113.346 -174.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -83.79 -44.06 14.77 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 53.0 mt -45.52 -43.01 11.48 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 120.534 3.531 . . . . 0.0 120.534 163.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 30.3 mtmm -79.73 -38.84 32.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 116.564 2.061 . . . . 0.0 116.564 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -112.22 -17.62 12.73 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 -162.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -107.21 -50.02 3.16 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.106 1.762 . . . . 0.0 114.398 168.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.56 -27.49 51.5 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.551 1.541 . . . . 0.0 112.355 170.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . 0.412 ' O ' HG22 ' D' ' 79' ' ' ILE . . . 84.92 -157.33 32.16 Favored Glycine 0 CA--C 1.522 0.505 1 O-C-N 113.496 -5.752 . . . . 0.0 118.206 136.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . . . . -53.67 -23.42 11.32 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 126.432 1.893 . . . . 0.0 114.11 -169.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.56 14.13 25.47 Favored Glycine 0 C--N 1.334 0.47 1 O-C-N 115.227 -4.671 . . . . 0.0 114.682 177.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . 0.412 HG22 ' O ' ' D' ' 76' ' ' GLY . 14.9 tt -93.59 -15.19 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.826 0 C-N-CA 117.9 -1.52 . . . . 0.0 108.598 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.15 -18.6 42.25 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 130.303 3.441 . . . . 0.0 108.802 176.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 95.7 m -84.62 -34.03 23.19 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 121.749 -0.594 . . . . 0.0 110.256 175.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . . 18.6 mm -87.07 -35.65 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 C-N-CA 127.421 2.288 . . . . 0.0 111.764 -178.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 11.5 p -118.39 4.46 11.82 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 116.879 -1.534 . . . . 0.0 114.386 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 33.1 mtp85 -119.66 -169.68 1.81 Allowed 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 120.453 1.479 . . . . 0.0 112.246 151.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 79.17 171.04 40.17 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.936 -159.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 90.4 p -71.43 -35.2 70.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 120.155 3.391 . . . . 0.0 120.155 -164.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -130.35 72.36 1.49 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 126.209 2.909 . . . . 0.0 104.678 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . . . . . . . . . 6.5 p -88.26 -177.96 5.8 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 129.66 3.184 . . . . 0.0 111.579 173.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.07 -15.5 61.5 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 117.528 -3.232 . . . . 0.0 113.629 167.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -70.63 -25.81 63.19 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 114.756 1.391 . . . . 0.0 114.756 161.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . . . . . . . . . . . -78.96 -34.68 44.14 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -176.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . . . . . . . . . . . 56.85 72.64 0.92 Allowed Pre-proline 0 N--CA 1.447 -0.612 0 O-C-N 126.582 2.426 . . . . 0.0 115.48 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . 0.595 ' HA ' ' OE2' ' D' ' 95' ' ' GLU 0.326 0.1 OUTLIER 24.07 33.51 0.0 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.283 0 N-CA-C 116.502 1.693 . . . . 0.0 116.502 45.509 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 63.1 t -59.14 -31.17 45.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 173.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . 0.595 ' OE2' ' HA ' ' D' ' 93' ' ' PRO 0.327 0.0 OUTLIER -67.91 -35.18 78.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.528 -2.607 . . . . 0.0 115.166 176.384 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 30.6 tp -66.89 -53.08 35.79 Favored 'General case' 0 N--CA 1.448 -0.539 0 O-C-N 126.754 2.533 . . . . 0.0 107.043 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 23.8 ttp180 -52.28 -38.52 58.54 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 120.967 3.692 . . . . 0.0 120.967 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.18 -24.95 54.75 Favored 'General case' 0 N--CA 1.444 -0.729 0 O-C-N 126.23 2.206 . . . . 0.0 109.979 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 54.8 t90 -87.72 -41.12 13.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 O-C-N 127.693 3.12 . . . . 0.0 110.508 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 29.6 mt -60.61 -32.05 71.2 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 114.934 -2.46 . . . . 0.0 109.655 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -58.89 -44.79 91.26 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 123.013 2.642 . . . . 0.0 114.868 177.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -91.8 -5.35 53.61 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 129.186 2.994 . . . . 0.0 113.743 -173.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 98.8 t -95.44 -41.7 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 O-C-N 118.658 -2.526 . . . . 0.0 112.611 164.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 16.9 mt -97.17 -27.71 14.43 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 121.055 0.455 . . . . 0.0 111.538 -172.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.352 3.3 mp -108.38 54.98 0.65 Allowed 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 121.22 -0.925 . . . . 0.0 112.149 167.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -78.12 176.75 8.92 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 126.983 3.277 . . . . 0.0 112.789 -173.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 59.7 m -61.72 -27.16 68.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 117.424 2.379 . . . . 0.0 117.424 -172.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.251 1.133 0 C-N-CA 130.831 3.652 . . . . 0.0 110.576 176.454 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 tmt? . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 117.439 -1.267 . . . . 0.0 113.716 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.16 77.59 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 123.821 3.009 . . . . 0.0 113.7 -168.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -72.92 -34.49 66.63 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.787 1.235 . . . . 0.0 112.81 168.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.7 mp0 -80.36 -8.67 59.6 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 120.775 1.625 . . . . 0.0 113.694 -175.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.2 m -76.67 129.19 80.04 Favored Pre-proline 0 N--CA 1.45 -0.447 0 C-N-CA 126.917 2.087 . . . . 0.0 107.644 -161.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.58 -32.36 4.81 Favored 'Trans proline' 0 N--CA 1.448 -1.16 0 CA-C-O 115.798 -1.834 . . . . 0.0 112.281 -169.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -139.38 160.91 38.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 128.162 2.585 . . . . 0.0 114.91 177.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 30.6 t -139.13 122.02 16.61 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 122.321 2.328 . . . . 0.0 111.54 163.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.17 -46.21 72.26 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 123.691 1.71 . . . . 0.0 112.662 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.03 -36.43 84.34 Favored 'General case' 0 N--CA 1.45 -0.427 1 O-C-N 115.833 -4.292 . . . . 0.0 117.593 177.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.8 tpt -70.23 -37.93 75.12 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 115.95 -1.976 . . . . 0.0 109.594 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.59 -25.6 68.04 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 120.329 1.422 . . . . 0.0 112.433 170.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -75.63 -38.9 58.53 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 117.682 -3.136 . . . . 0.0 109.817 175.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -66.0 -45.43 81.6 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.639 -0.696 . . . . 0.0 109.296 179.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -63.11 -22.2 66.7 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 128.729 2.811 . . . . 0.0 116.481 169.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -80.71 -48.91 11.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 125.543 1.777 . . . . 0.0 112.046 173.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -65.05 -20.82 66.67 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 125.526 1.53 . . . . 0.0 112.82 172.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -72.13 -48.95 39.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 170.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.42 ' CH2' HD13 ' B' ' 39' ' ' LEU . 0.2 OUTLIER -62.01 -37.16 83.8 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.56 2.744 . . . . 0.0 115.535 -179.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . 0.299 51.9 mt -63.73 -13.77 46.45 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.812 1.645 . . . . 0.0 115.247 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -75.31 -26.65 58.84 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 118.343 -2.723 . . . . 0.0 117.633 173.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -68.25 -26.8 65.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 124.655 1.182 . . . . 0.0 111.446 163.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.7 t -80.6 -23.71 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 122.061 2.21 . . . . 0.0 114.287 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -77.57 -41.3 39.34 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 128.744 2.817 . . . . 0.0 114.892 161.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 10.0 tp -67.17 -40.97 86.69 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 124.937 1.398 . . . . 0.0 113.02 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.9 tp -70.23 -31.54 69.0 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 119.447 -2.033 . . . . 0.0 113.613 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -71.12 -38.09 72.31 Favored 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 127.361 2.913 . . . . 0.0 110.801 178.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -64.68 -37.87 89.06 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 174.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.87 -36.5 82.46 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 120.038 1.29 . . . . 0.0 113.42 176.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -54.28 -35.26 62.39 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 118.074 2.62 . . . . 0.0 118.074 166.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -74.02 -25.66 60.0 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 119.208 -2.182 . . . . 0.0 115.539 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -98.81 0.06 43.55 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 128.541 2.736 . . . . 0.0 113.172 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 39.42 35.69 0.18 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 118.242 2.682 . . . . 0.0 118.242 -155.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.1 mt -89.02 2.41 54.06 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -71.38 -43.8 66.17 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 117.705 -3.122 . . . . 0.0 115.946 -161.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.44 -42.56 5.27 Favored Pre-proline 0 N--CA 1.452 -0.356 0 CA-C-N 121.626 2.012 . . . . 0.0 107.193 -177.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -42.4 -55.61 2.49 Favored 'Trans proline' 0 N--CA 1.448 -1.155 0 C-N-CA 124.991 3.794 . . . . 0.0 111.895 162.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 52.7 tp -64.88 -33.17 75.37 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 117.297 2.332 . . . . 0.0 117.297 177.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.3 mt -77.86 -30.63 51.0 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 122.136 2.244 . . . . 0.0 110.781 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -65.41 -29.67 70.39 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 122.297 2.317 . . . . 0.0 112.92 165.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.4 tp -67.09 -49.4 65.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 117.451 -3.281 . . . . 0.0 109.689 171.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 32.6 mmt -76.52 -36.11 57.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 126.421 1.889 . . . . 0.0 115.578 -177.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 48.2 mt -111.39 132.91 54.08 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 122.149 2.25 . . . . 0.0 115.153 -175.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.9 p -61.79 166.41 6.09 Favored Pre-proline 0 N--CA 1.448 -0.527 0 CA-C-O 114.393 -2.717 . . . . 0.0 117.573 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -64.86 -23.4 62.31 Favored 'Trans proline' 0 N--CA 1.452 -0.943 0 N-CA-C 119.684 2.917 . . . . 0.0 119.684 -177.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -94.48 -24.2 17.39 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 124.465 1.103 . . . . 0.0 111.533 -174.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -75.31 -22.29 57.79 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 118.416 -1.314 . . . . 0.0 111.124 168.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.3 mtm-85 -72.94 -48.94 32.46 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 114.948 -2.454 . . . . 0.0 109.443 172.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -66.69 -32.05 73.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 127.306 2.879 . . . . 0.0 112.618 175.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.96 -48.77 75.18 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.193 2.269 . . . . 0.0 110.517 167.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 35.5 mt -65.16 -45.05 86.51 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 116.598 -3.814 . . . . 0.0 113.792 -175.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.16 -36.61 83.05 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 118.779 2.272 . . . . 0.0 118.779 171.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.3 m -67.27 -34.65 77.85 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 119.788 -2.007 . . . . 0.0 114.102 173.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -69.19 -16.92 63.73 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 115.937 1.829 . . . . 0.0 115.937 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 52.3 t -72.34 -38.49 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 126.273 1.829 . . . . 0.0 109.457 167.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 33.5 ttt180 -61.79 -42.62 99.23 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 121.927 2.149 . . . . 0.0 112.045 167.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.1 mt -53.84 -50.97 48.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 3.3 t -76.25 -25.21 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -172.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -70.97 -52.5 19.41 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 116.293 -1.813 . . . . 0.0 106.355 171.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -69.61 -23.48 63.52 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 123.525 2.875 . . . . 0.0 115.282 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . 0.311 80.6 mt -69.48 -49.23 56.75 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 128.553 2.741 . . . . 0.0 116.136 171.022 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 40.7 tp -65.81 -40.2 91.62 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 128.219 2.607 . . . . 0.0 111.407 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -74.97 -48.31 24.91 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 126.974 2.11 . . . . 0.0 111.302 172.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.6 16.17 75.8 Favored Glycine 0 C--O 1.224 -0.47 0 C-N-CA 124.829 1.204 . . . . 0.0 113.517 167.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -70.83 -44.88 65.6 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.235 -3.509 . . . . 0.0 113.174 173.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 50.9 mtp -79.78 124.45 28.62 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 131.612 3.965 . . . . 0.0 111.212 168.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.5 p -97.21 177.34 5.6 Favored 'General case' 0 N--CA 1.446 -0.671 0 O-C-N 127.215 2.822 . . . . 0.0 112.804 -174.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -54.0 -44.68 71.1 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 118.981 -2.324 . . . . 0.0 114.863 -178.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 50.2 tpt85 -71.43 -29.02 64.39 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 125.747 1.905 . . . . 0.0 107.281 -175.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -73.23 -44.05 60.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 117.199 -1.381 . . . . 0.0 108.967 178.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 36.2 mt -70.13 -10.8 59.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 116.005 -1.95 . . . . 0.0 114.219 -175.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -75.33 -42.16 55.01 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 113.479 -3.153 . . . . 0.0 109.182 171.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -55.05 -31.71 61.34 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 128.436 3.585 . . . . 0.0 117.219 171.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -91.04 -41.33 11.14 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 118.443 -2.66 . . . . 0.0 114.724 -166.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 44.5 mt -109.51 -9.5 14.91 Favored 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -176.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 83.38 -29.38 3.59 Favored Glycine 0 C--N 1.339 0.709 0 CA-C-O 115.139 -3.034 . . . . 0.0 116.237 170.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -85.77 -159.18 0.44 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 117.984 2.587 . . . . 0.0 117.984 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.49 154.74 40.67 Favored Glycine 0 C--N 1.337 0.599 0 CA-C-O 116.809 -2.106 . . . . 0.0 111.348 -166.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 11.3 mt -59.62 -30.04 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-O 116.221 -1.847 . . . . 0.0 111.034 170.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.91 -18.57 65.33 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 122.628 2.467 . . . . 0.0 115.544 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 44.0 p -60.35 -29.59 69.0 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 118.137 -0.935 . . . . 0.0 111.895 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.9 mm -83.69 -53.67 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 C-N-CA 127.789 2.436 . . . . 0.0 105.153 175.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.2 m -54.4 -56.27 20.29 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.606 1.962 . . . . 0.0 112.786 -174.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 27.8 ttt180 -58.79 -36.34 74.27 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.77 -37.18 75.73 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 114.05 -1.432 . . . . 0.0 114.533 177.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 5.4 m -63.44 -51.27 66.43 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 113.447 -1.377 . . . . 0.0 111.122 173.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -62.42 -43.38 98.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 127.028 2.131 . . . . 0.0 111.576 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.9 m -65.65 -26.75 67.94 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 114.635 -2.602 . . . . 0.0 116.916 169.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.452 ' O ' ' HB3' ' A' ' 92' ' ' ALA . 19.7 tp -76.38 -34.15 58.88 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 127.418 2.949 . . . . 0.0 110.433 177.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -61.08 -31.75 71.41 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 118.032 2.604 . . . . 0.0 118.032 161.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . 0.283 . . -86.66 -4.76 59.22 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 124.284 1.992 . . . . 0.0 113.359 170.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 89' ' ' LEU . . . -58.46 150.53 54.87 Favored Pre-proline 0 N--CA 1.445 -0.684 0 O-C-N 117.934 -2.979 . . . . 0.0 115.636 167.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -65.8 158.04 55.82 Favored 'Trans proline' 0 N--CA 1.448 -1.176 1 C-N-CA 125.895 4.397 . . . . 0.0 108.787 162.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.5 m -77.35 -38.54 26.93 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 O-C-N 122.204 -0.31 . . . . 0.0 111.752 -166.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -59.68 -24.3 63.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 119.561 -1.962 . . . . 0.0 112.33 177.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 16.4 tp -67.02 -55.87 12.55 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 119.903 1.228 . . . . 0.0 113.138 172.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 46.2 mtm-85 -57.1 -45.8 83.08 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 115.708 1.744 . . . . 0.0 115.708 169.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -63.09 -28.53 70.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 118.164 -2.835 . . . . 0.0 111.852 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 29.7 t90 -73.49 -44.67 57.32 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 169.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 104' ' ' LEU . 70.7 mt -59.72 -27.89 66.86 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 115.449 -2.215 . . . . 0.0 109.751 174.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -74.3 -24.16 59.2 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 123.599 2.909 . . . . 0.0 115.024 175.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -86.28 -30.0 22.64 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 123.697 0.799 . . . . 0.0 112.666 -178.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.4 t -84.37 -34.99 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 O-C-N 118.951 -2.343 . . . . 0.0 110.627 173.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 100' ' ' LEU . 27.3 mt -94.02 -45.3 7.65 Favored 'General case' 0 N--CA 1.45 -0.454 1 O-C-N 114.857 -4.902 . . . . 0.0 112.287 -167.07 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 56.8 mt -111.5 0.69 16.58 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 120.799 3.629 . . . . 0.0 120.799 -169.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . 0.254 67.9 tttt -82.18 -43.96 17.03 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 116.473 -3.892 . . . . 0.0 113.748 -165.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 14.4 p -76.58 -32.65 58.28 Favored 'General case' 0 N--CA 1.45 -0.463 1 O-C-N 116.209 -4.057 . . . . 0.0 115.751 -174.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 . . . . . 0 C--O 1.251 1.155 0 O-C-N 123.888 0.742 . . . . 0.0 111.07 -169.4 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tmt? . . . . . 0 N--CA 1.473 0.723 0 CA-C-O 121.678 0.751 . . . . 0.0 108.984 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.04 -51.04 17.07 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 117.015 -3.553 . . . . 0.0 116.503 -150.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -66.41 -18.21 65.23 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 167.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -85.86 -45.73 11.28 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 117.451 2.389 . . . . 0.0 117.451 178.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 66.4 m -76.1 143.44 73.72 Favored Pre-proline 0 N--CA 1.446 -0.666 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -168.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -18.5 22.77 Favored 'Trans proline' 0 N--CA 1.449 -1.143 0 C-N-CA 123.889 3.059 . . . . 0.0 113.385 173.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -142.67 162.05 36.47 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 122.123 2.238 . . . . 0.0 110.962 154.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' SER . . . . . . . . . . . . . 10.1 t -149.17 140.17 22.93 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 127.342 2.257 . . . . 0.0 111.052 174.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.59 -40.44 76.7 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 116.917 -3.614 . . . . 0.0 110.511 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.09 -41.77 79.51 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 123.326 1.536 . . . . 0.0 110.595 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 13.1 mmt -63.01 -40.16 96.93 Favored 'General case' 0 N--CA 1.449 -0.496 1 O-C-N 115.948 -4.22 . . . . 0.0 112.885 176.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.01 -44.83 79.34 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.873 3.269 . . . . 0.0 111.545 -178.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -62.97 -30.93 71.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 120.791 1.632 . . . . 0.0 114.313 168.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -69.94 -36.56 75.39 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 114.555 -2.64 . . . . 0.0 111.314 172.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -72.71 -27.17 61.9 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 115.433 -2.222 . . . . 0.0 113.016 176.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -71.95 -36.6 69.92 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 124.822 3.465 . . . . 0.0 113.505 168.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -67.01 -37.14 83.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 117.103 -1.427 . . . . 0.0 110.302 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -72.84 -24.62 60.91 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 114.308 -2.758 . . . . 0.0 107.741 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 7.1 t-105 -69.5 -51.39 36.27 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 124.512 3.324 . . . . 0.0 108.965 169.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.65 -16.53 49.47 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 126.52 1.928 . . . . 0.0 115.441 177.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -64.03 -48.23 77.13 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.093 1.757 . . . . 0.0 110.733 173.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -56.54 -40.41 75.05 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.213 1.405 . . . . 0.0 113.185 173.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 14.0 t -80.61 -33.93 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 O-C-N 118.968 -2.332 . . . . 0.0 114.659 -178.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -66.78 -39.22 87.75 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.113 0.965 . . . . 0.0 113.067 169.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 25.4 tp -50.62 -63.38 1.14 Allowed 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 118.979 -2.326 . . . . 0.0 107.427 161.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . 0.252 41.8 tp -59.72 -45.83 90.97 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 121.421 1.919 . . . . 0.0 115.244 -172.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -51.93 -43.17 63.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 116.828 2.159 . . . . 0.0 116.828 170.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -67.42 -37.5 83.14 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 116.677 2.103 . . . . 0.0 116.677 170.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.28 -38.37 52.39 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.498 1.919 . . . . 0.0 111.87 173.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -64.31 -48.14 76.76 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 128.176 2.591 . . . . 0.0 113.264 175.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -44.26 -31.86 1.13 Allowed 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 117.631 -3.168 . . . . 0.0 114.523 171.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -108.57 -3.84 17.68 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 129.46 3.104 . . . . 0.0 115.167 -175.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . 0.33 4.9 m-20 60.28 10.68 2.48 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 -176.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 80.1 mt -69.22 1.19 3.92 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 167.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -64.4 -44.7 90.46 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 115.868 -2.015 . . . . 0.0 114.97 -171.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 65.5 tp -72.58 -36.79 3.91 Favored Pre-proline 0 N--CA 1.447 -0.609 0 CA-C-N 121.631 2.014 . . . . 0.0 112.315 -173.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 0.8 OUTLIER -58.2 -29.35 87.24 Favored 'Trans proline' 0 N--CA 1.445 -1.349 0 N-CA-C 121.537 3.63 . . . . 0.0 121.537 161.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 27.2 tp -72.75 -35.29 67.47 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 172.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' LEU . . . . . 0.42 HD13 ' CH2' ' A' ' 19' ' ' TRP 0.253 60.8 mt -73.61 -22.81 59.91 Favored 'General case' 0 N--CA 1.445 -0.677 1 O-C-N 115.717 -4.364 . . . . 0.0 114.456 176.502 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -70.04 -33.41 71.93 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.836 0.854 . . . . 0.0 108.952 171.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 48.8 tp -84.26 -46.63 11.63 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 126.077 1.751 . . . . 0.0 106.343 -178.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 15.7 mmt -86.12 -17.41 35.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 123.861 0.726 . . . . 0.0 112.296 -161.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mp -126.34 138.4 53.57 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 120.867 -1.146 . . . . 0.0 112.521 171.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 46.8 p -78.64 161.52 69.05 Favored Pre-proline 0 N--CA 1.446 -0.626 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 -178.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -46.68 -45.39 20.04 Favored 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 123.012 2.475 . . . . 0.0 114.261 175.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.48 -36.08 68.7 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 126.626 3.108 . . . . 0.0 117.338 177.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -90.56 -25.17 20.34 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 112.062 -2.336 . . . . 0.0 113.22 -178.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 62.8 mtm-85 -61.09 -35.11 76.11 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 119.421 3.119 . . . . 0.0 119.421 155.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -73.05 -35.65 66.75 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 126.332 2.27 . . . . 0.0 111.826 174.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.35 -53.73 53.85 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 115.442 -2.218 . . . . 0.0 110.358 167.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . 0.282 33.1 mt -63.93 -52.34 60.24 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 121.595 1.998 . . . . 0.0 112.609 178.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.97 -27.12 12.68 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 118.456 2.142 . . . . 0.0 118.456 173.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 32.0 m -80.87 -50.63 9.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 116.132 -1.89 . . . . 0.0 112.806 163.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 76.0 mtt180 -53.18 -32.48 48.09 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 122.774 2.534 . . . . 0.0 110.104 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.4 -41.05 90.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 O-C-N 117.253 -3.404 . . . . 0.0 107.78 176.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -80.92 -26.34 36.83 Favored 'General case' 0 N--CA 1.449 -0.497 1 O-C-N 114.898 -4.876 . . . . 0.0 112.265 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . . . . . . . . . 68.7 mt -65.58 -45.18 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 O-C-N 118.918 -2.364 . . . . 0.0 108.436 173.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 65.6 t -69.66 -36.92 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 O-C-N 117.943 -2.973 . . . . 0.0 108.92 -179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -61.92 -47.34 85.38 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 124.357 2.027 . . . . 0.0 113.834 169.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -74.92 -22.02 58.86 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 116.359 -3.963 . . . . 0.0 111.94 -177.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . 79.8 mt -70.3 -14.83 62.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.764 0.826 . . . . 0.0 111.601 167.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 84.2 mt -106.77 -13.81 15.16 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.421 1.088 . . . . 0.0 113.511 177.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' ARG . . . . . . . . . . . . . 20.4 ttm105 -87.41 -47.57 8.67 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.162 -2.836 . . . . 0.0 111.962 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 65.37 69.9 1.23 Allowed Glycine 0 C--N 1.334 0.465 1 O-C-N 130.018 4.574 . . . . 0.0 115.201 -175.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -139.39 -30.69 0.71 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 119.745 1.773 . . . . 0.0 113.511 176.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' MET . . . . . . . . . . . . . 33.2 mtt -81.62 134.67 35.51 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 117.132 2.271 . . . . 0.0 117.132 -172.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 83.0 p -81.88 168.6 17.76 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 128.574 3.671 . . . . 0.0 112.218 179.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.404 ' HA ' HD12 ' B' ' 71' ' ' LEU . 67.1 mt-30 -64.22 -17.25 63.38 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 121.291 1.859 . . . . 0.0 114.658 -175.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -74.03 -51.11 16.87 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 168.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -75.11 -22.56 58.14 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 116.619 -2.032 . . . . 0.0 115.981 -175.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' B' ' 68' ' ' GLN . 78.5 mt -57.66 -45.48 85.47 Favored 'General case' 0 N--CA 1.451 -0.417 1 CA-C-O 131.311 5.339 . . . . 0.0 111.79 170.101 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -66.33 -28.32 68.58 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 117.958 -2.964 . . . . 0.0 113.021 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -87.29 -75.56 0.4 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 121.614 2.007 . . . . 0.0 116.241 167.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -56.58 -33.56 66.3 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 120.563 3.542 . . . . 0.0 120.563 -179.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 29.5 mt -101.11 -8.75 21.98 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 120.014 1.279 . . . . 0.0 109.726 169.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.54 7.49 40.75 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-O 118.285 -1.286 . . . . 0.0 112.421 172.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' ALA . . . . . . . . . . . . . . . -112.36 156.89 21.73 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 -174.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.17 158.2 52.17 Favored Glycine 0 C--N 1.334 0.434 0 CA-C-N 110.737 -2.938 . . . . 0.0 113.922 167.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 37.3 mm -71.16 -31.85 45.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 C-N-CA 124.331 1.052 . . . . 0.0 111.634 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.76 -43.81 90.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 120.368 -1.458 . . . . 0.0 114.169 165.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 3.5 m -54.19 -36.9 63.92 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 113.319 -3.229 . . . . 0.0 111.56 169.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 19.2 mm -73.0 -40.66 59.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 O-C-N 126.361 2.288 . . . . 0.0 105.265 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 32.2 m -74.85 -33.87 62.19 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 115.586 1.698 . . . . 0.0 115.586 -167.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -49.43 -44.1 45.15 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 114.634 -2.603 . . . . 0.0 112.478 155.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.4 -55.34 15.78 Favored Glycine 0 C--N 1.335 0.479 0 C-N-CA 126.387 1.946 . . . . 0.0 111.789 177.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 2.4 p -50.52 -37.37 38.78 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 123.574 3.687 . . . . 0.0 114.189 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -71.31 -35.69 71.36 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 119.741 -1.85 . . . . 0.0 115.57 173.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 44.3 m -67.3 -27.96 67.6 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 166.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.91 -42.67 66.44 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 125.156 1.535 . . . . 0.0 109.977 178.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -67.53 -38.91 84.91 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 172.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.14 -4.51 39.15 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 115.423 -2.227 . . . . 0.0 113.229 177.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.41 157.8 55.46 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 120.626 1.557 . . . . 0.0 111.331 -169.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -54.91 132.94 55.05 Favored 'Trans proline' 0 N--CA 1.45 -1.082 1 C-N-CA 125.841 4.361 . . . . 0.0 110.461 176.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . 0.309 16.6 m -59.8 -26.39 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 116.158 1.91 . . . . 0.0 116.158 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' GLU . . . . . . . . . . . . 0.309 17.5 pm0 -49.57 -52.67 28.53 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 126.681 1.993 . . . . 0.0 114.53 165.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 17.4 tp -63.32 -42.82 99.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 124.894 2.283 . . . . 0.0 108.344 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 60.5 mtp85 -63.62 -47.4 81.53 Favored 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 119.855 -1.778 . . . . 0.0 113.858 -175.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -61.37 -37.92 85.14 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 115.584 -2.151 . . . . 0.0 115.009 170.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' TRP . . . . . . . . . . . . . 16.7 t90 -70.68 -38.13 73.71 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 119.97 1.259 . . . . 0.0 108.519 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 26.1 mt -68.58 -37.49 79.89 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 119.826 1.194 . . . . 0.0 111.86 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -65.56 -38.71 90.34 Favored 'General case' 0 N--CA 1.445 -0.678 1 O-C-N 115.443 -4.535 . . . . 0.0 114.841 173.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -62.18 -55.21 30.87 Favored 'General case' 0 N--CA 1.448 -0.567 0 O-C-N 118.893 -2.379 . . . . 0.0 112.181 164.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.23 -34.5 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 C-N-CA 123.139 0.575 . . . . 0.0 110.015 -164.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 87.9 mt -90.38 -49.72 6.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 118.688 2.847 . . . . 0.0 118.688 -176.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 19.1 mt -82.59 -34.31 27.71 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 123.488 1.613 . . . . 0.0 112.921 -166.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -67.3 -16.69 64.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 113.63 -1.623 . . . . 0.0 111.971 164.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 48.9 m -103.05 6.12 38.51 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 117.935 -2.978 . . . . 0.0 118.944 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . 0.312 33.6 t70 . . . . . 0 C--O 1.25 1.084 0 N-CA-C 120.112 3.375 . . . . 0.0 120.112 -169.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . 0.257 6.1 mtt . . . . . 0 N--CA 1.469 0.516 0 CA-C-O 123.926 1.822 . . . . 0.0 106.951 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.94 179.25 7.82 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 125.745 1.618 . . . . 0.0 112.629 179.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 3' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -151.28 119.25 6.22 Favored 'General case' 0 N--CA 1.448 -0.529 1 O-C-N 116.115 -4.116 . . . . 0.0 107.519 -171.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -108.3 149.47 28.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 119.443 -2.036 . . . . 0.0 107.685 171.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 5' ' ' SER . . . . . . . . . . . . . 25.0 p -129.94 148.16 68.45 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 103.476 -2.787 . . . . 0.0 103.476 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 6' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -53.6 -38.93 84.42 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.071 2.514 . . . . 0.0 118.12 -171.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 7' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -145.98 166.27 26.53 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 117.568 -3.208 . . . . 0.0 107.021 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 3.1 t -154.55 132.15 11.35 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 105.143 -2.169 . . . . 0.0 105.143 170.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.35 -41.33 89.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.44 1.496 . . . . 0.0 112.676 168.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.25 86.84 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 119.028 -2.295 . . . . 0.0 111.384 177.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 11' ' ' MET . . . . . . . . . . . . . 37.4 mtt -60.61 -35.6 76.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 120.046 -1.659 . . . . 0.0 113.086 171.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.76 -25.2 63.7 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.116 1.366 . . . . 0.0 113.659 168.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -71.02 -26.57 63.17 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 122.679 1.228 . . . . 0.0 109.036 171.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 14' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -77.29 -38.61 50.33 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 118.247 -2.783 . . . . 0.0 108.665 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.34 -37.1 86.32 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 124.193 1.949 . . . . 0.0 112.039 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 16' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -62.76 -41.63 99.31 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 112.813 -1.994 . . . . 0.0 105.985 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 -69.95 -24.32 63.33 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 117.828 -3.045 . . . . 0.0 112.346 178.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 18' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -62.93 -48.41 79.04 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 126.088 2.851 . . . . 0.0 114.206 169.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 19' ' ' TRP . . . . . . . . . . . . . 54.9 t-105 -55.58 -42.44 74.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 116.453 -3.904 . . . . 0.0 118.058 160.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 20' ' ' LEU . . . . . . . . . . . . . 3.8 mp -63.08 -15.16 55.7 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 122.019 2.19 . . . . 0.0 115.975 167.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 21' ' ' ARG . . . . . . . . . . . . . 43.6 ttt-85 -87.43 -32.55 19.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 122.539 1.162 . . . . 0.0 111.363 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 22' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -54.48 -42.65 70.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 117.449 -3.282 . . . . 0.0 113.112 157.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 17.1 t -78.79 -26.93 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 C-N-CA 126.462 1.905 . . . . 0.0 107.115 -171.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -83.02 -29.38 28.94 Favored 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 123.418 0.687 . . . . 0.0 112.627 172.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 25' ' ' LEU . . . . . . . . . . . . . 33.2 tp -68.26 -47.3 68.09 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 121.078 -1.014 . . . . 0.0 111.03 172.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 67.2 tp -68.36 -32.11 71.96 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -176.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -55.46 -53.37 57.19 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 118.825 -2.422 . . . . 0.0 109.381 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 28' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -68.3 -22.58 64.71 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 125.976 2.048 . . . . 0.0 116.051 174.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.89 -27.34 65.7 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 116.869 -3.645 . . . . 0.0 113.454 -177.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 30' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -61.23 -30.95 70.75 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 117.795 2.517 . . . . 0.0 117.795 167.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 31' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -71.91 -22.24 61.51 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 118.345 2.72 . . . . 0.0 118.345 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 32' ' ' ASN . . . . . . . . . . . . . 51.0 p-10 -114.8 24.19 11.99 Favored 'General case' 0 N--CA 1.446 -0.653 0 O-C-N 120.264 -1.522 . . . . 0.0 112.342 161.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 33' ' ' ASP . . . . . . . . . . . . 0.331 18.3 m-20 57.21 24.42 9.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.914 2.486 . . . . 0.0 114.767 173.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 44.1 mt -85.96 -12.44 50.43 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 173.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 35' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 -40.39 -56.3 2.05 Favored 'General case' 0 N--CA 1.448 -0.529 1 O-C-N 115.621 -4.425 . . . . 0.0 114.035 174.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 81.0 mt -68.53 -48.13 33.94 Favored Pre-proline 0 N--CA 1.449 -0.508 0 CA-C-O 116.802 -1.57 . . . . 0.0 111.925 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . 0.31 30.3 Cg_endo -55.69 -25.32 50.25 Favored 'Trans proline' 0 N--CA 1.449 -1.098 1 C-N-CA 127.279 5.32 . . . . 0.0 115.216 168.666 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 58.7 tp -73.92 -48.15 32.78 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 123.178 2.717 . . . . 0.0 107.109 172.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 39' ' ' LEU . . . . . . . . . . . . . 84.8 mt -63.99 -25.34 68.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 125.752 1.907 . . . . 0.0 114.723 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 40' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -68.19 -27.79 66.71 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 119.352 0.978 . . . . 0.0 112.809 165.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 41' ' ' LEU . . . . . . . . . . . . . 14.2 tp -78.59 -55.18 5.39 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 126.634 3.112 . . . . 0.0 110.969 172.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 42' ' ' MET . . . . . . . . . . . . . 55.3 mmm -67.76 -18.25 64.81 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 121.679 3.955 . . . . 0.0 121.679 -168.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 43' ' ' LEU . . . . . . . . . . . . 0.269 8.5 mp -131.5 165.37 23.72 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 117.971 -2.956 . . . . 0.0 106.156 -178.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 44' ' ' THR . . . . . . . . . . . . . 29.3 p -91.51 154.54 44.29 Favored Pre-proline 0 N--CA 1.449 -0.509 0 C-N-CA 124.935 1.294 . . . . 0.0 112.226 165.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 45' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_exo -49.71 -31.26 24.94 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 N-CA-C 115.596 1.345 . . . . 0.0 115.596 167.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.65 -24.92 60.06 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 176.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 47' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -76.68 -36.33 57.34 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 120.416 -1.427 . . . . 0.0 113.929 168.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . 0.252 90.3 mtm-85 -57.82 -37.69 74.25 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 115.193 -2.337 . . . . 0.0 109.856 176.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 49' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -70.41 -53.34 16.88 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 128.954 3.909 . . . . 0.0 109.319 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 50' ' ' ALA . . . . . . . . . . . . 0.343 . . -44.88 -49.87 10.7 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 116.301 -3.999 . . . . 0.0 117.715 165.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 33.6 mt -63.81 -44.14 94.17 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 117.102 -1.427 . . . . 0.0 112.817 177.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.45 -26.59 69.65 Favored Glycine 0 CA--C 1.523 0.54 0 O-C-N 126.409 2.318 . . . . 0.0 111.309 -177.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 6.0 m -80.65 -32.95 36.01 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 118.41 -2.818 . . . . 0.0 114.241 173.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 54' ' ' ARG . . . . . . . . . . . . 0.25 91.1 mtt180 -71.71 -19.77 62.01 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 115.801 -2.047 . . . . 0.0 113.092 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 55' ' ' VAL . . . . . 0.424 ' HA ' ' HE1' ' D' ' 42' ' ' MET . 23.7 t -69.14 -40.79 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 C-N-CA 128.045 2.538 . . . . 0.0 109.977 162.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 56' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -68.75 -37.0 79.09 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 112.158 -3.782 . . . . 0.0 110.507 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 57' ' ' ILE . . . . . 0.492 HG23 HD23 ' C' ' 75' ' ' LEU . 37.7 mt -60.39 -43.11 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 O-C-N 126.576 2.422 . . . . 0.0 109.25 175.05 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 58' ' ' VAL . . . . . . . . . . . . . 47.4 t -67.48 -42.36 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 120.917 1.69 . . . . 0.0 111.297 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 59' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -51.0 -49.31 60.64 Favored 'General case' 0 N--CA 1.449 -0.514 1 C-N-CA 131.707 4.003 . . . . 0.0 114.479 166.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 60' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -64.56 -38.23 90.28 Favored 'General case' 0 N--CA 1.449 -0.51 0 O-C-N 118.193 -2.817 . . . . 0.0 114.479 173.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 61' ' ' LEU . . . . . . . . . . . . . 20.1 mt -78.23 -30.53 48.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 122.406 2.366 . . . . 0.0 109.642 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 62' ' ' LEU . . . . . . . . . . . . . 35.1 mt -80.4 -22.21 41.5 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 117.56 -3.212 . . . . 0.0 114.443 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -66.76 -37.16 84.08 Favored 'General case' 0 N--CA 1.449 -0.494 1 C-N-CA 134.502 5.121 . . . . 0.0 110.218 169.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.25 19.75 64.42 Favored Glycine 0 CA--C 1.521 0.431 0 CA-C-O 116.629 -2.206 . . . . 0.0 114.423 177.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 65' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -96.83 -30.76 12.98 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -171.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 66' ' ' MET . . . . . . . . . . . . . 18.8 mmt -55.3 142.75 30.68 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 118.003 2.594 . . . . 0.0 118.003 166.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 67' ' ' SER . . . . . . . . . . . . . 30.7 p -95.18 170.17 9.58 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 129.543 3.137 . . . . 0.0 109.005 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 68' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.57 -35.21 75.52 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 116.19 -1.862 . . . . 0.0 113.014 -172.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 69' ' ' ARG . . . . . . . . . . . . . 32.8 ttp180 -67.47 -41.73 84.15 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 120.935 1.698 . . . . 0.0 115.456 172.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 70' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -74.11 -35.53 64.15 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 -175.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 71' ' ' LEU . . . . . . . . . . . . . 24.2 mt -57.99 -21.1 42.98 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 129.311 3.044 . . . . 0.0 110.341 169.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 72' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -106.34 -29.64 9.64 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 123.87 3.032 . . . . 0.0 112.688 175.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 73' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -97.78 -37.33 9.9 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 115.539 1.681 . . . . 0.0 115.539 -174.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 74' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -90.04 -43.47 10.49 Favored 'General case' 0 N--CA 1.446 -0.669 0 O-C-N 119.438 -2.039 . . . . 0.0 109.939 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 75' ' ' LEU . . . . . 0.492 HD23 HG23 ' C' ' 57' ' ' ILE . 10.9 mp -86.04 9.03 18.38 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-O 124.275 1.988 . . . . 0.0 114.922 173.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 76' ' ' GLY . . . . . . . . . . . . . . . 58.97 -142.13 46.62 Favored Glycine 0 C--N 1.337 0.597 1 C-N-CA 130.834 4.064 . . . . 0.0 112.238 161.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 77' ' ' ALA . . . . . . . . . . . . . . . -87.36 -26.8 23.18 Favored 'General case' 0 N--CA 1.45 -0.465 0 O-C-N 119.469 -2.195 . . . . 0.0 113.413 164.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.13 2.81 3.68 Favored Glycine 0 CA--C 1.525 0.713 1 CA-C-O 112.586 -4.452 . . . . 0.0 116.41 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 79' ' ' ILE . . . . . . . . . . . . . 10.2 tt -66.67 -40.38 86.0 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 CA-C-N 120.748 2.274 . . . . 0.0 115.259 165.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.49 -23.78 52.01 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 127.474 2.31 . . . . 0.0 115.775 171.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 81' ' ' THR . . . . . . . . . . . . . 1.7 m -71.75 -28.32 63.58 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 119.885 -1.76 . . . . 0.0 112.704 169.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 82' ' ' ILE . . . . . . . . . . . . . 9.2 mm -92.65 -22.91 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 1 O-C-N 115.525 -4.485 . . . . 0.0 117.127 -171.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 83' ' ' THR . . . . . . . . . . . . . 73.0 p -123.32 -1.23 8.68 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 118.177 2.658 . . . . 0.0 118.177 -164.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 84' ' ' ARG . . . . . . . . . . . . . 69.1 mtp85 -125.8 158.93 33.74 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 129.021 2.929 . . . . 0.0 111.575 -178.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 85' ' ' GLY . . . . . . . . . . . . . . . 76.96 164.08 19.64 Favored Glycine 0 C--O 1.224 -0.497 0 O-C-N 121.168 -0.957 . . . . 0.0 112.807 -177.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 86' ' ' SER . . . . . . . . . . . . . 66.7 m -67.96 -7.98 33.25 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 112.205 -3.76 . . . . 0.0 117.016 -163.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 87' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -117.82 18.62 14.01 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 131.078 3.751 . . . . 0.0 112.697 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 88' ' ' SER . . . . . . . . . . . . . 17.0 p -68.38 178.19 2.07 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 89' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' C' ' 89' ' ' LEU . 20.4 tp -59.86 -38.59 82.56 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 118.468 -1.293 . . . . 0.0 112.338 -173.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . 0.346 94.1 mttt -101.75 6.41 41.74 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 127.537 2.335 . . . . 0.0 117.027 -176.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 91' ' ' ALA . . . . . . . . . . . . . . . -120.61 -9.07 9.44 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 125.189 1.396 . . . . 0.0 112.135 167.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.19 160.21 18.13 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-O 125.743 2.687 . . . . 0.0 112.276 164.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 93' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -58.57 125.68 19.06 Favored 'Trans proline' 0 N--CA 1.447 -1.217 1 C-N-CA 126.221 4.614 . . . . 0.0 110.5 -177.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 50.7 t -37.64 -41.08 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.571 0 C-N-CA 125.851 1.66 . . . . 0.0 110.711 178.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 95' ' ' GLU . . . . . . . . . . . . . 16.9 pm0 -74.88 -18.3 60.45 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 116.285 -1.817 . . . . 0.0 110.83 -174.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 96' ' ' LEU . . . . . . . . . . . . . 6.8 tp -81.43 -38.42 26.48 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 122.596 2.453 . . . . 0.0 110.694 165.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 97' ' ' ARG . . . . . . . . . . . . . 68.0 mtp180 -59.37 -52.42 65.72 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 118.605 -2.559 . . . . 0.0 110.096 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -47.6 -54.23 12.43 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 126.241 2.213 . . . . 0.0 114.521 166.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 99' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -66.12 -42.1 89.66 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 114.316 -1.311 . . . . 0.0 114.046 -173.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 61.0 mt -61.49 -48.53 80.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 126.449 1.9 . . . . 0.0 108.984 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 101' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -45.67 -41.42 10.37 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 116.721 -3.737 . . . . 0.0 118.823 164.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -73.95 -32.62 63.57 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.607 1.163 . . . . 0.0 109.529 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 103' ' ' VAL . . . . . . . . . . . . . 38.9 t -88.38 -46.42 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 -175.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 104' ' ' LEU . . . . . . . . . . . . . 51.0 mt -82.84 -18.55 40.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 117.63 -3.169 . . . . 0.0 113.028 -158.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 35.0 mt -118.33 3.31 11.92 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 120.573 1.533 . . . . 0.0 114.797 -173.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 106' ' ' LYS . . . . . . . . . . . . 0.352 21.6 pttp -48.37 117.28 1.9 Allowed 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 129.771 3.228 . . . . 0.0 111.53 -170.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 3.7 m -112.63 24.78 12.11 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.919 2.888 . . . . 0.0 117.288 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t0 . . . . . 0 C--O 1.252 1.193 0 CA-C-O 115.33 -2.271 . . . . 0.0 111.685 -171.651 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 16.2 ttt . . . . . 0 N--CA 1.472 0.644 0 CA-C-O 115.404 -2.236 . . . . 0.0 109.022 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' D' D ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.46 149.44 49.57 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 120.575 1.534 . . . . 0.0 112.965 -173.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 3' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -128.01 128.41 44.94 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 128.233 2.613 . . . . 0.0 108.485 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -99.83 123.06 43.69 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.084 -1.417 . . . . 0.0 111.396 -175.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 5' ' ' SER . . . . . . . . . . . . . 98.1 p -98.86 179.8 0.99 Allowed Pre-proline 0 N--CA 1.448 -0.539 0 C-N-CA 125.89 1.676 . . . . 0.0 114.648 162.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 6' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -92.24 -23.35 0.39 Allowed 'Trans proline' 0 N--CA 1.452 -0.927 0 N-CA-C 116.717 1.776 . . . . 0.0 116.717 175.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 7' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -151.12 129.56 12.11 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 129.63 3.172 . . . . 0.0 106.377 -169.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.83 137.64 42.0 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 112.444 -2.162 . . . . 0.0 110.854 176.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.24 -30.98 69.77 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 120.255 -1.528 . . . . 0.0 111.377 176.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.56 -14.89 59.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 114.897 -2.478 . . . . 0.0 111.695 175.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 11' ' ' MET . . . . . . . . . . . . . 7.2 mmt -70.25 -27.37 64.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 121.782 2.083 . . . . 0.0 113.73 169.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.45 -41.66 72.54 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 120.622 -1.299 . . . . 0.0 112.291 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 21.4 tp10 -63.4 -36.22 83.0 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-O 113.591 -3.1 . . . . 0.0 107.014 170.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 14' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -73.92 -34.84 64.51 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 121.533 1.969 . . . . 0.0 107.797 -174.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 15' ' ' ARG . . . . . 0.408 ' HE ' ' HA ' ' D' ' 15' ' ' ARG 0.298 0.0 OUTLIER -65.63 -29.37 69.94 Favored 'General case' 0 N--CA 1.447 -0.62 1 O-C-N 114.432 -5.168 . . . . 0.0 113.728 -176.997 . . . . . . . . 5 4 . 1 . 015 nuclear nobuild full ' D' D ' 16' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -77.63 -29.72 51.89 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 117.47 2.396 . . . . 0.0 117.47 167.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 17' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -73.87 -28.4 61.55 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 123.003 1.382 . . . . 0.0 111.04 -178.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 18' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -89.56 -18.1 27.25 Favored 'General case' 0 N--CA 1.448 -0.557 0 O-C-N 120.325 -1.484 . . . . 0.0 107.652 -176.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 19' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 -76.06 -47.35 24.99 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 116.914 -1.517 . . . . 0.0 111.251 162.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.48 -35.38 80.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 117.196 2.295 . . . . 0.0 117.196 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 21' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -63.94 -26.31 68.53 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 118.143 -1.423 . . . . 0.0 113.982 170.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -62.85 -53.46 53.79 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 113.844 -2.979 . . . . 0.0 111.142 166.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.62 -35.09 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 CA-C-N 121.179 1.809 . . . . 0.0 110.716 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.33 -41.3 81.0 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 115.628 1.714 . . . . 0.0 115.628 170.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 25' ' ' LEU . . . . . . . . . . . . . 13.4 tp -63.73 -48.66 76.13 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 26' ' ' LEU . . . . . 0.472 HD13 HD21 ' D' ' 39' ' ' LEU . 53.7 tp -51.67 -48.12 63.54 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 115.36 -2.257 . . . . 0.0 116.402 173.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 27' ' ' LYS . . . . . . . . . . . . . 19.5 ttpp -59.32 -52.32 66.17 Favored 'General case' 0 N--CA 1.449 -0.486 0 O-C-N 125.397 1.685 . . . . 0.0 110.078 174.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 28' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -61.62 -33.83 74.61 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 117.447 -1.263 . . . . 0.0 110.713 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.75 -38.75 89.97 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 123.674 2.943 . . . . 0.0 114.975 171.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 30' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -61.65 -29.89 70.36 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 123.769 1.747 . . . . 0.0 115.535 172.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 31' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -81.28 -25.18 36.75 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -177.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 32' ' ' ASN . . . . . . . . . . . . 0.329 54.3 p30 -102.74 3.74 37.24 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 120.56 -1.338 . . . . 0.0 114.011 164.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 33' ' ' ASP . . . . . . . . . . . . 0.254 1.7 m-20 63.72 26.5 14.51 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 128.744 2.818 . . . . 0.0 113.337 177.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 34' ' ' LEU . . . . . . . . . . . . . 43.9 mt -93.71 16.86 12.94 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 165.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 35' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -52.22 -58.42 6.67 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 126.972 2.109 . . . . 0.0 110.152 174.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . 0.415 22.6 mt -41.87 -63.86 0.78 Allowed Pre-proline 0 N--CA 1.448 -0.549 0 C-N-CA 128.05 2.54 . . . . 0.0 110.964 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 37' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -58.87 -36.65 96.6 Favored 'Trans proline' 0 N--CA 1.451 -0.992 0 CA-C-O 114.81 -2.246 . . . . 0.0 115.916 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 33.1 tp -56.0 -54.41 45.16 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 125.226 3.648 . . . . 0.0 112.292 171.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 39' ' ' LEU . . . . . 0.472 HD21 HD13 ' D' ' 26' ' ' LEU . 88.6 mt -62.55 -31.63 72.45 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 115.846 -2.026 . . . . 0.0 110.652 176.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -74.71 -28.35 60.76 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 117.236 -1.786 . . . . 0.0 114.474 170.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -74.07 -51.9 14.31 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 118.44 -2.662 . . . . 0.0 108.615 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 42' ' ' MET . . . . . 0.424 ' HE1' ' HA ' ' C' ' 55' ' ' VAL . 24.8 mmt -63.36 -43.63 97.11 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 113.827 -2.987 . . . . 0.0 116.664 173.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 43' ' ' LEU . . . . . . . . . . . . . 61.4 mt -121.26 142.58 49.79 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 124.81 3.459 . . . . 0.0 107.144 -166.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 44' ' ' THR . . . . . . . . . . . . . 38.9 p -77.65 159.26 77.19 Favored Pre-proline 0 N--CA 1.444 -0.738 0 C-N-CA 129.848 3.259 . . . . 0.0 115.729 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 45' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -41.84 -50.35 5.08 Favored 'Trans proline' 0 N--CA 1.451 -0.99 0 O-C-N 125.052 2.08 . . . . 0.0 114.341 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -73.53 -20.63 60.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 122.285 2.311 . . . . 0.0 116.288 176.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 47' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -70.32 -38.27 74.87 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 123.321 2.782 . . . . 0.0 109.946 170.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 48' ' ' ARG . . . . . . . . . . . . . 26.0 mtm-85 -74.16 -36.6 64.11 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 118.36 2.726 . . . . 0.0 118.36 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 49' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.44 -45.62 84.5 Favored 'General case' 0 N--CA 1.447 -0.62 0 O-C-N 128.672 3.732 . . . . 0.0 114.018 161.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.77 -36.68 62.56 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 117.174 2.287 . . . . 0.0 117.174 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 51' ' ' LEU . . . . . . . . . . . . . 47.4 mt -62.18 -32.02 72.6 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 120.063 -1.648 . . . . 0.0 107.671 171.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.93 -41.69 71.39 Favored Glycine 0 C--N 1.338 0.677 0 O-C-N 119.109 -2.244 . . . . 0.0 112.365 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 24.8 m -62.77 -31.52 72.5 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 127.05 2.14 . . . . 0.0 112.971 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 54' ' ' ARG . . . . . 0.463 ' HA ' ' HB ' ' D' ' 57' ' ' ILE . 24.3 mtt180 -71.6 -24.68 61.94 Favored 'General case' 0 N--CA 1.448 -0.544 1 O-C-N 116.134 -4.104 . . . . 0.0 111.834 -177.086 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' D' D ' 55' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.66 -43.26 98.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 O-C-N 118.694 -2.504 . . . . 0.0 111.044 170.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 56' ' ' ARG . . . . . . . . . . . . 0.357 3.7 ptm180 -81.92 -25.63 34.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 116.583 2.068 . . . . 0.0 116.583 172.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 57' ' ' ILE . . . . . 0.463 ' HB ' ' HA ' ' D' ' 54' ' ' ARG . 54.0 mt -67.0 -32.84 59.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 122.024 0.129 . . . . 0.0 110.775 170.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 58' ' ' VAL . . . . . . . . . . . . . 57.9 t -68.94 -48.25 71.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-O 116.28 -1.819 . . . . 0.0 113.69 165.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -70.15 -27.1 64.27 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 117.721 -1.592 . . . . 0.0 115.095 -174.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 60' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -74.96 -7.93 55.02 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 116.242 -1.837 . . . . 0.0 113.898 165.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 mt -89.13 -7.75 55.1 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 121.691 2.041 . . . . 0.0 114.288 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 62' ' ' LEU . . . . . . . . . . . . . 44.0 mt -97.65 -35.75 10.49 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 116.424 2.009 . . . . 0.0 116.424 165.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -75.33 -32.41 60.9 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 112.08 -3.819 . . . . 0.0 111.768 -178.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . 47.03 55.4 8.57 Favored Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 121.042 3.177 . . . . 0.0 121.042 168.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 65' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -130.73 -30.19 1.86 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.082 1.353 . . . . 0.0 107.579 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 66' ' ' MET . . . . . . . . . . . . . 22.5 mmt -94.88 51.83 1.42 Allowed 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.844 2.458 . . . . 0.0 106.18 172.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 67' ' ' SER . . . . . . . . . . . . . 59.1 p -66.34 171.01 5.21 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 112.194 -2.276 . . . . 0.0 115.277 -169.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 68' ' ' GLN . . . . . . . . . . . . 0.303 6.6 tp-100 49.86 -89.28 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.73 1.612 . . . . 0.0 114.774 166.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 69' ' ' ARG . . . . . . . . . . . . . 22.7 ttt180 -80.82 -35.14 33.3 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 118.273 -2.767 . . . . 0.0 110.238 -172.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 70' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -78.24 -31.69 49.37 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 126.459 1.904 . . . . 0.0 112.294 -172.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 71' ' ' LEU . . . . . . . . . . . . . 7.4 mt -51.67 -31.1 24.44 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.82 1.648 . . . . 0.0 113.566 168.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 72' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -104.63 -38.65 6.65 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 128.055 2.542 . . . . 0.0 108.43 -172.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -111.33 -14.32 13.8 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 121.982 2.174 . . . . 0.0 113.141 -164.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 74' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -118.32 -24.66 6.82 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 113.346 -3.216 . . . . 0.0 115.555 167.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 75' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' D' ' 75' ' ' LEU . 2.5 mm? -83.86 -27.55 28.61 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 122.332 2.333 . . . . 0.0 110.752 162.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 76' ' ' GLY . . . . . . . . . . . . . . . 95.13 -175.34 33.44 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 129.64 3.495 . . . . 0.0 115.647 169.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 77' ' ' ALA . . . . . . . . . . . . 0.293 . . -68.64 -10.73 57.9 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 119.887 -1.949 . . . . 0.0 115.803 -164.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.39 -23.82 43.35 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 127.415 2.436 . . . . 0.0 111.094 169.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -46.5 -33.56 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 175.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 80' ' ' ALA . . . . . . . . . . . . . . . -100.67 -4.56 28.08 Favored 'General case' 0 N--CA 1.45 -0.452 1 O-C-N 116.085 -4.135 . . . . 0.0 114.678 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 81' ' ' THR . . . . . . . . . . . . . 53.3 m -67.86 -33.45 74.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 120.19 1.359 . . . . 0.0 109.75 148.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 82' ' ' ILE . . . . . . . . . . . . 0.389 41.1 mm -85.85 -24.32 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 C-N-CA 131.449 3.899 . . . . 0.0 112.597 -168.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 83' ' ' THR . . . . . . . . . . . . . 66.7 p -129.55 6.68 5.23 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 112.106 -2.315 . . . . 0.0 115.203 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 84' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -134.16 177.21 7.92 Favored 'General case' 0 N--CA 1.452 -0.354 1 O-C-N 114.616 -5.053 . . . . 0.0 108.318 165.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 85' ' ' GLY . . . . . . . . . . . . . . . 84.03 157.59 25.92 Favored Glycine 0 C--N 1.337 0.587 0 O-C-N 117.043 -3.536 . . . . 0.0 111.634 -147.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 86' ' ' SER . . . . . . . . . . . . . 38.7 p -72.09 -26.78 62.29 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 118.888 2.922 . . . . 0.0 118.888 -166.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 87' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -133.54 85.81 2.24 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 124.925 2.298 . . . . 0.0 109.62 -170.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 88' ' ' SER . . . . . 0.474 ' H ' ' HB3' ' D' ' 91' ' ' ALA . 59.5 p -131.25 -169.28 2.15 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 128.644 2.778 . . . . 0.0 109.301 175.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 89' ' ' LEU . . . . . . . . . . . . 0.392 5.4 mp -87.85 27.85 1.1 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 124.091 1.9 . . . . 0.0 109.886 -177.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 90' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -107.17 10.59 30.0 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 119.879 -1.763 . . . . 0.0 115.006 147.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 91' ' ' ALA . . . . . 0.474 ' HB3' ' H ' ' D' ' 88' ' ' SER . . . -144.65 -3.81 0.79 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 112.414 -3.66 . . . . 0.0 109.818 -162.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 92' ' ' ALA . . . . . 0.498 ' HA ' ' N ' ' D' ' 94' ' ' VAL . . . 66.01 85.85 0.15 Allowed Pre-proline 0 N--CA 1.448 -0.564 0 CA-C-N 124.676 3.398 . . . . 0.0 117.91 169.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 93' ' ' PRO . . . . . . . . . . . . 0.309 0.0 OUTLIER 30.42 23.23 0.0 OUTLIER 'Cis proline' 0 N--CA 1.451 -1.018 0 N-CA-C 121.107 3.464 . . . . 0.0 121.107 17.373 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' D' D ' 94' ' ' VAL . . . . . 0.498 ' N ' ' HA ' ' D' ' 92' ' ' ALA . 15.1 t -65.74 -31.91 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 119.571 1.078 . . . . 0.0 110.526 161.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 95' ' ' GLU . . . . . . . . . . . . 0.358 0.0 OUTLIER -78.52 -36.76 44.38 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 128.716 2.806 . . . . 0.0 109.607 -178.769 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . 0.286 16.3 tp -55.96 -57.41 12.2 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.718 168.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 97' ' ' ARG . . . . . . . . . . . . . 26.4 ttp-105 -49.09 -40.57 32.46 Favored 'General case' 0 N--CA 1.451 -0.381 1 CA-C-O 110.793 -4.432 . . . . 0.0 115.75 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 98' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -62.35 -24.12 67.17 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 127.7 3.125 . . . . 0.0 115.183 177.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 99' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -98.22 -35.12 10.46 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 117.661 -3.149 . . . . 0.0 110.84 175.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 100' ' ' LEU . . . . . . . . . . . . . 48.0 mt -53.46 -39.74 64.71 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 120.631 1.559 . . . . 0.0 114.839 168.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . 0.297 15.5 tt0 -80.05 -13.13 59.54 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 117.016 -1.874 . . . . 0.0 107.986 -176.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -104.59 4.76 33.18 Favored 'General case' 0 N--CA 1.45 -0.439 0 O-C-N 119.244 -2.16 . . . . 0.0 113.611 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 103' ' ' VAL . . . . . . . . . . . . . 2.5 t -123.49 -27.06 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 114.401 -2.714 . . . . 0.0 113.73 162.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 104' ' ' LEU . . . . . . . . . . . . . 29.0 mt -92.99 -27.39 17.05 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 123.985 3.084 . . . . 0.0 118.261 166.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . 0.313 74.7 mt -114.66 30.45 7.32 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 122.615 2.462 . . . . 0.0 107.628 172.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 106' ' ' LYS . . . . . . . . . . . . . 20.2 pttp -61.49 174.71 0.7 Allowed 'General case' 0 N--CA 1.449 -0.481 1 C-N-CA 131.993 4.117 . . . . 0.0 111.626 -174.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' D' D ' 107' ' ' SER . . . . . . . . . . . . . 14.6 m -58.13 -38.1 75.89 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 112.776 -2.011 . . . . 0.0 113.655 -169.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 108' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.953 2.501 . . . . 0.0 115.423 -174.478 . . . . . . . . 0 0 . 1 stop_ save_